A0A087WPV0_MOUSE Loading...

Zinc finger protein 708

AlphaFold DB , UniProt , Accession A0A087WPV0, Species MOUSE (Mus musculus, Mouse), Gene Zfp708, Length 496 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.1	Very low	43	Very low	205 Å²	205	121.3 Å²	121.3	100%	1.01	62%	0.617	S	S	*	*				0	-42.4	0	-76.7	-120.9	-82.3	0	0	113.6
2	L	38.7	Very low	42.6	Very low	142 Å²	142	116.4 Å²	116.4	74%	0.743	62%	0.62	S	S	*	*	H	α-helix	trans	-69	-29.8	174.4	-91.1	98.7	0	0	0	114.2	N4 Y5 S6	L2-N4 PolarHBondContact O-N 2.88Å; L2-Y5 WeakPolarHBondContact O-CB 3.36Å; L2-Y5 PolarHBondContact O-N 3.18Å; L2-Y5 VanDerWaalsContact O-N 3.13Å; L2-S6 PolarHBondContact O-N 3.28Å
3	E	41.7	Very low	43.1	Very low	160 Å²	160	116.2 Å²	116.2	75%	0.748	62%	0.618	S	S	*	*	H	α-helix	trans	-70.4	-34.1	-176.4	-146.1	143.5	-158.9	0	0	112.9	Y5 N7	E3-Y5 VanDerWaalsContact C-N 3.34Å; E3-N7 PolarHBondContact O-N 3.36Å; E3-N7 PolarHBondContact O-ND2 2.97Å; E3-N7 VanDerWaalsContact O-ND2 3.15Å
4	N	45.9	Very low	42.9	Very low	115 Å²	115	110.4 Å²	110.4	62%	0.615	59%	0.594	S	S	*	*	H	α-helix	trans	-72.8	-27.2	171.2	-73.3	-7.2	0	0	0	112.3	L2 L8	L2-N4 PolarHBondContact O-N 2.88Å; N4-L8 WeakPolarHBondContact O-CB 3.39Å; N4-L8 WeakPolarHBondContact O-CD1 3.35Å; N4-L8 VanDerWaalsContact O-CG 3.22Å; N4-L8 WeakPolarHBondContact O-CG 3.43Å; N4-L8 PolarHBondContact O-N 3.46Å; N4-L8 VanDerWaalsContact O-N 3.11Å
5	Y	43	Very low	43.2	Very low	85 Å²	85	116.6 Å²	116.6	33%	0.333	61%	0.614	S	S	.	*	H	α-helix	trans	-73.1	-41.1	175.8	-172.8	-97.9	0	0	0	111.7	L2 E3 N7 L8 V9 A14 K17	L2-Y5 WeakPolarHBondContact O-CB 3.36Å; L2-Y5 PolarHBondContact O-N 3.18Å; L2-Y5 VanDerWaalsContact O-N 3.13Å; E3-Y5 VanDerWaalsContact C-N 3.34Å; Y5-N7 VanDerWaalsContact C-N 3.33Å; Y5-N7 PolarHBondContact O-N 3.45Å; Y5-L8 PolarHBondContact O-N 3.3Å; Y5-V9 HydrophobicContact CD1-CG2 4.06Å; Y5-V9 HydrophobicContact CE1-CG2 3.74Å; Y5-V9 WeakPolarHBondContact O-CG2 3.5Å; Y5-V9 PolarHBondContact O-N 3.15Å; Y5-A14 HydrophobicContact CE2-CB 4.33Å; Y5-K17 HydrophobicContact CE2-CG 4.29Å
6	S	44	Very low	43.5	Very low	80 Å²	80	114.1 Å²	114.1	56%	0.559	61%	0.61	S	S	*	*	H	α-helix	trans	-61.1	-40.6	172.3	-91.3	0	0	0	0	112.4	L2 L8 V9 F10	L2-S6 PolarHBondContact O-N 3.28Å; S6-L8 VanDerWaalsContact C-N 3.32Å; S6-L8 PolarHBondContact O-N 3.22Å; S6-V9 PolarHBondContact O-N 3.09Å; S6-F10 VanDerWaalsContact O-CB 3.3Å; S6-F10 WeakPolarHBondContact O-CB 3.25Å; S6-F10 PolarHBondContact O-N 3.37Å
7	N	42.8	Very low	43.6	Very low	94 Å²	94	115.5 Å²	115.5	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-67.2	-31.1	176.4	-72.5	-32.6	0	0	0	112.8	E3 Y5 L11	E3-N7 PolarHBondContact O-N 3.36Å; E3-N7 PolarHBondContact O-ND2 2.97Å; E3-N7 VanDerWaalsContact O-ND2 3.15Å; Y5-N7 VanDerWaalsContact C-N 3.33Å; Y5-N7 PolarHBondContact O-N 3.45Å; N7-L11 WeakPolarHBondContact O-CD1 3.44Å; N7-L11 VanDerWaalsContact O-CG 3.27Å; N7-L11 WeakPolarHBondContact O-CG 3.47Å; N7-L11 PolarHBondContact O-N 2.94Å
8	L	40.9	Very low	43.8	Very low	63 Å²	63	114.7 Å²	114.7	33%	0.33	61%	0.611	S	S	.	*	H	α-helix	trans	-78.4	-32.3	175.7	-73.8	165.8	0	0	0	113.3	N4 Y5 S6 G12 L13	N4-L8 WeakPolarHBondContact O-CB 3.39Å; N4-L8 WeakPolarHBondContact O-CD1 3.35Å; N4-L8 VanDerWaalsContact O-CG 3.22Å; N4-L8 WeakPolarHBondContact O-CG 3.43Å; N4-L8 PolarHBondContact O-N 3.46Å; N4-L8 VanDerWaalsContact O-N 3.11Å; Y5-L8 PolarHBondContact O-N 3.3Å; S6-L8 VanDerWaalsContact C-N 3.32Å; S6-L8 PolarHBondContact O-N 3.22Å; L8-G12 PolarHBondContact O-N 3.34Å; L8-L13 PolarHBondContact O-N 3.19Å
9	V	42.9	Very low	43.7	Very low	79 Å²	79	118.1 Å²	118.1	48%	0.479	62%	0.616	S	S	.	*	H	α-helix	trans	-73.4	-38.6	173.6	172.5	0	0	0	0	111.2	Y5 S6 L11 G12	Y5-V9 HydrophobicContact CD1-CG2 4.06Å; Y5-V9 HydrophobicContact CE1-CG2 3.74Å; Y5-V9 WeakPolarHBondContact O-CG2 3.5Å; Y5-V9 PolarHBondContact O-N 3.15Å; S6-V9 PolarHBondContact O-N 3.09Å; V9-L11 PolarHBondContact O-N 3.44Å; V9-G12 PolarHBondContact O-N 2.9Å
10	F	42.5	Very low	43.8	Very low	186 Å²	186	115.5 Å²	115.5	82%	0.816	60%	0.603	S	S	*	*	H	α-helix	trans	-66.1	-27.1	176.3	-162.3	-95.2	0	0	0	112.9	S6	S6-F10 VanDerWaalsContact O-CB 3.3Å; S6-F10 WeakPolarHBondContact O-CB 3.25Å; S6-F10 PolarHBondContact O-N 3.37Å
11	L	42.3	Very low	44	Very low	125 Å²	125	114.7 Å²	114.7	65%	0.654	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	0.1	172.1	-66.3	171.2	0	0	0	113.5	N7 V9 L13	N7-L11 WeakPolarHBondContact O-CD1 3.44Å; N7-L11 VanDerWaalsContact O-CG 3.27Å; N7-L11 WeakPolarHBondContact O-CG 3.47Å; N7-L11 PolarHBondContact O-N 2.94Å; V9-L11 PolarHBondContact O-N 3.44Å; L11-L13 HydrophobicContact CB-CD1 4.44Å
12	G	38.8	Very low	43.8	Very low	63 Å²	63	109.3 Å²	109.3	65%	0.649	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.8	26.2	175.7	0	0	0	0	0	115.7	L8 V9	L8-G12 PolarHBondContact O-N 3.34Å; V9-G12 PolarHBondContact O-N 2.9Å
13	L	49.2	Very low	44.1	Very low	113 Å²	113	109.9 Å²	109.9	59%	0.592	58%	0.578	S	S	*	*			trans	-121.6	44.9	-167.1	-73.6	169.2	0	0	0	114.8	L8 L11	L8-L13 PolarHBondContact O-N 3.19Å; L11-L13 HydrophobicContact CB-CD1 4.44Å
14	A	39.5	Very low	44.2	Very low	35 Å²	35	108 Å²	108	29%	0.289	57%	0.573	S	S	.	*			trans	-142.7	127.9	167.9	0	0	0	0	0	114.4	Y5	Y5-A14 HydrophobicContact CE2-CB 4.33Å
15	F	48.1	Very low	44.1	Very low	204 Å²	204	110.5 Å²	110.5	90%	0.895	58%	0.581	S	S	*	*			trans	-115.5	103.1	163.4	-77.7	-89.2	0	0	0	108.6
16	S	46.8	Very low	44.1	Very low	77 Å²	77	114.6 Å²	114.6	54%	0.538	60%	0.603	S	S	.	*			trans	60.4	139.5	172	81.4	0	0	0	0	119.8	P18	S16-P18 VanDerWaalsContact C-CD 3.43Å
17	K	45.5	Very low	43.9	Very low	137 Å²	137	116.3 Å²	116.3	60%	0.596	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-30.1	-176.4	-90.2	179.9	174.2	176.5	0	117.8	Y5 Y19 L20	Y5-K17 HydrophobicContact CE2-CG 4.29Å; K17-Y19 VanDerWaalsContact C-N 3.3Å; K17-Y19 PolarHBondContact O-N 3.3Å; K17-L20 PolarHBondContact O-N 3.4Å
18	P	47.6	Very low	43.5	Very low	101 Å²	101	117.3 Å²	117.3	66%	0.656	63%	0.629	S	S	*	*	H	α-helix	trans	-67.9	-27.5	-175.4	-21	33.2	0	0	0	114	S16 L20	S16-P18 VanDerWaalsContact C-CD 3.43Å; P18-L20 VanDerWaalsContact C-N 3.32Å; P18-L20 PolarHBondContact O-N 3.34Å
19	Y	41.5	Very low	43.1	Very low	180 Å²	180	120.6 Å²	120.6	71%	0.706	65%	0.647	S	S	*	*	H	α-helix	trans	-79.9	-13.8	-174.3	-142	-92.4	0	0	0	113.8	K17 T22	K17-Y19 VanDerWaalsContact C-N 3.3Å; K17-Y19 PolarHBondContact O-N 3.3Å; Y19-T22 PolarHBondContact O-OG1 3.33Å
20	L	45.5	Very low	42.9	Very low	66 Å²	66	124.6 Å²	124.6	35%	0.346	67%	0.665	S	S	.	*	H	α-helix	trans	-92.1	-23.9	-175.2	-126.4	149.7	0	0	0	112.1	K17 P18 L24	K17-L20 PolarHBondContact O-N 3.4Å; P18-L20 VanDerWaalsContact C-N 3.32Å; P18-L20 PolarHBondContact O-N 3.34Å; L20-L24 HydrophobicContact CD2-CD1 4.34Å; L20-L24 WeakPolarHBondContact O-CD1 3.24Å; L20-L24 WeakPolarHBondContact O-CG 3.49Å
21	V	48.9	Very low	42.5	Very low	99 Å²	99	126.6 Å²	126.6	60%	0.6	67%	0.667	S	S	*	*	H	α-helix	trans	-75.8	-41.3	177	179.1	0	0	0	0	110.5	F23 L24	V21-F23 VanDerWaalsContact C-N 3.25Å; V21-F23 PolarHBondContact O-N 3.32Å; V21-L24 PolarHBondContact O-N 3.23Å
22	T	44.5	Very low	42.2	Very low	92 Å²	92	124.4 Å²	124.4	56%	0.564	66%	0.662	S	S	*	*	H	α-helix	trans	-68.1	-22.7	175.9	47.6	0	0	0	0	113.6	Y19	Y19-T22 PolarHBondContact O-OG1 3.33Å
23	F	43.3	Very low	42.4	Very low	153 Å²	153	125.1 Å²	125.1	67%	0.671	65%	0.654	S	S	*	*	H	α-helix	trans	-86.9	-17.2	-178.5	-160.2	-96.3	0	0	0	113.6	V21	V21-F23 VanDerWaalsContact C-N 3.25Å; V21-F23 PolarHBondContact O-N 3.32Å
24	L	43.9	Very low	41.5	Very low	122 Å²	122	127.9 Å²	127.9	64%	0.639	66%	0.661	S	S	*	*	H	α-helix	trans	-87.6	-13	-178.4	-75.4	168.1	0	0	0	113.9	L20 V21	L20-L24 HydrophobicContact CD2-CD1 4.34Å; L20-L24 WeakPolarHBondContact O-CD1 3.24Å; L20-L24 WeakPolarHBondContact O-CG 3.49Å; V21-L24 PolarHBondContact O-N 3.23Å
25	E	44	Very low	41.3	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	69%	0.686	S	S	*	*	S	Bend	trans	-90.4	-7.1	-179.7	-69.7	-177.2	158.1	0	0	114.2
26	Q	43.8	Very low	40.6	Very low	172 Å²	172	135.1 Å²	135.1	80%	0.804	68%	0.679	S	S	*	*	S	Bend	trans	-125.6	65.3	-178.2	-69.3	-177.8	-3.4	0	0	111.7	S28	Q26-S28 PolarHBondContact O-N 3.44Å
27	S	39.8	Very low	39.9	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	68%	0.676	S	S	*	*			trans	-82.6	116.2	179.8	58.1	0	0	0	0	112.9
28	S	33.2	Very low	39.1	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	68%	0.683	S	S	*	*			trans	-135.7	108.9	146.7	53.1	0	0	0	0	110.8	Q26	Q26-S28 PolarHBondContact O-N 3.44Å
29	D	34.3	Very low	38.5	Very low	132 Å²	132	134 Å²	134	71%	0.706	69%	0.689	S	S	*	*			trans	61.3	115.9	160	-121.4	-22.4	0	0	0	122.3	W31	D29-W31 VanDerWaalsContact C-N 3.33Å; D29-W31 PolarHBondContact O-N 2.78Å
30	L	37.2	Very low	38.1	Very low	164 Å²	164	129 Å²	129	86%	0.859	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-16.8	-173.3	-160.8	72.8	0	0	0	113.8
31	W	34.9	Very low	37.7	Very low	228 Å²	228	132.1 Å²	132.1	86%	0.864	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-14.7	-176.3	-147.3	49.2	0	0	0	113.9	D29	D29-W31 VanDerWaalsContact C-N 3.33Å; D29-W31 PolarHBondContact O-N 2.78Å
32	S	36.4	Very low	37.1	Very low	78 Å²	78	134.1 Å²	134.1	55%	0.545	70%	0.703	S	S	.	*	S	Bend	trans	-78.2	-25.3	177	180	0	0	0	0	113.1
33	V	42	Very low	36.7	Very low	78 Å²	78	138.6 Å²	138.6	47%	0.473	72%	0.723	S	S	.	*	G	3₁₀ helix	trans	-82.1	-24.7	-170.2	-179.4	0	0	0	0	113.8	R35 K36 A37	V33-R35 PolarHBondContact O-N 3.12Å; V33-K36 PolarHBondContact O-N 3.44Å; V33-K36 VanDerWaalsContact O-N 3.12Å; V33-A37 HydrophobicContact CG1-CB 4.44Å; V33-A37 WeakPolarHBondContact O-CB 3.38Å; V33-A37 PolarHBondContact O-N 3.46Å
34	K	31	Very low	36.6	Very low	171 Å²	171	133.2 Å²	133.2	74%	0.743	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-62	-28.2	177.1	-112.7	178.2	-179.1	175.1	0	113.2	S38	K34-S38 PolarHBondContact O-OG 3.35Å
35	R	34.6	Very low	36.8	Very low	218 Å²	218	132.6 Å²	132.6	82%	0.823	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-80.4	-21	179	-124.7	-175.2	-67.8	-156.7	1.2	113.6	V33	V33-R35 PolarHBondContact O-N 3.12Å
36	K	32.8	Very low	37.2	Very low	173 Å²	173	129.4 Å²	129.4	75%	0.752	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-20.4	176.6	-72	-175.7	178	178.3	0	114	V33 S38	V33-K36 PolarHBondContact O-N 3.44Å; V33-K36 VanDerWaalsContact O-N 3.12Å; K36-S38 PolarHBondContact O-N 3.11Å
37	A	32.8	Very low	37.8	Very low	57 Å²	57	124.9 Å²	124.9	47%	0.471	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-79.5	-10.8	178	0	0	0	0	0	115.1	V33 V39	V33-A37 HydrophobicContact CG1-CB 4.44Å; V33-A37 WeakPolarHBondContact O-CB 3.38Å; V33-A37 PolarHBondContact O-N 3.46Å; A37-V39 PolarHBondContact O-N 3.22Å
38	S	29.3	Very low	38.8	Very low	107 Å²	107	122.5 Å²	122.5	75%	0.748	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-79.2	-2.4	176.7	-57	0	0	0	0	113.6	K34 K36	K34-S38 PolarHBondContact O-OG 3.35Å; K36-S38 PolarHBondContact O-N 3.11Å
39	V	35.1	Very low	40.5	Very low	129 Å²	129	123.5 Å²	123.5	78%	0.782	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-100.6	-6.8	-176.2	179.8	0	0	0	0	112.6	A37	A37-V39 PolarHBondContact O-N 3.22Å
40	A	33.3	Very low	42.1	Very low	74 Å²	74	117.3 Å²	117.3	61%	0.612	63%	0.625	S	S	*	*			trans	-118.7	32.5	-168.3	0	0	0	0	0	115.7
41	I	36.8	Very low	43.5	Very low	132 Å²	132	119.4 Å²	119.4	68%	0.677	63%	0.627	S	S	*	*	S	Bend	trans	-130.8	76	170.4	-50.4	177.4	0	0	0	109.3
42	H	35.2	Very low	44.6	Very low	141 Å²	141	114.9 Å²	114.9	65%	0.653	62%	0.616	S	S	*	*			trans	178.2	68.6	148.3	-91.8	-56.2	0	0	0	107.6	G44	H42-G44 PolarHBondContact O-N 3.44Å
43	L	37.7	Very low	45.9	Very low	185 Å²	185	113.6 Å²	113.6	97%	0.969	61%	0.606	S	S	*	*			trans	-74.8	80.7	156.9	-100.2	89.9	0	0	0	107.7
44	G	39.6	Very low	46.9	Very low	41 Å²	41	111.8 Å²	111.8	42%	0.423	60%	0.603	S	S	.	*	S	Bend	trans	-150.5	84.2	164.1	0	0	0	0	0	104.6	H42 K46	H42-G44 PolarHBondContact O-N 3.44Å; G44-K46 PolarHBondContact O-N 3.08Å
45	S	48.5	Very low	48.4	Very low	108 Å²	108	109.5 Å²	109.5	76%	0.755	59%	0.593	S	S	*	*			trans	20.6	68.3	167	43.2	0	0	0	0	116.9	A47	S45-A47 PolarHBondContact O-N 2.95Å
46	K	52.2	Low	49.7	Very low	99 Å²	99	101.6 Å²	101.6	43%	0.43	57%	0.571	S	S	.	*			trans	-76.2	76.2	165.4	-71.7	-176.1	-179.5	175.6	0	110.3	G44 F57 D58	G44-K46 PolarHBondContact O-N 3.08Å; K46-F57 CarbonylContact C-O 3.32Å; K46-F57 WeakPolarHBondContact CA-O 3.47Å; K46-D58 HydrophobicContact CG-CB 4.37Å
47	A	56.1	Low	51.6	Low	77 Å²	77	94.9 Å²	94.9	64%	0.636	54%	0.542	S	S	*	.			trans	-76.4	-17.7	-174	0	0	0	0	0	114.5	S45	S45-A47 PolarHBondContact O-N 2.95Å
48	H	62.5	Low	53.1	Low	66 Å²	66	96.5 Å²	96.5	31%	0.306	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	104.5	-167.1	-61.5	-71.7	0	0	0	112.1	F57 N60 L63	H48-F57 PolarHBondContact N-O 3.41Å; H48-F57 PolarHBondContact O-N 3.28Å; H48-N60 PolarHBondContact CD2-N 3.07Å; H48-N60 VanDerWaalsContact CD2-N 3.27Å; H48-N60 PolarHBondContact ND1-OD1 2.88Å; H48-L63 HydrophobicContact CB-CB 4.1Å; H48-L63 HydrophobicContact CB-CD2 3.71Å
49	K	67.1	Low	54.9	Low	136 Å²	136	99.5 Å²	99.5	59%	0.591	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.8	-176.4	-162.9	177.5	-163.2	-178.9	0	112.3	K51 G54	K49-K51 PolarHBondContact O-N 3.21Å; K49-G54 VanDerWaalsContact CE-O 3.3Å; K49-G54 WeakPolarHBondContact CE-O 3.09Å
50	C	69.7	Low	56.3	Low	2 Å²	2	96.9 Å²	96.9	1%	0.014	52%	0.52	C	S	.	.			trans	-74.6	121.3	173.3	-174.8	0	0	0	0	110.4	E52 G54 K55 F57 L63	C50-E52 VanDerWaalsContact C-N 3.3Å; C50-E52 PolarHBondContact O-N 3.19Å; C50-G54 VanDerWaalsContact O-CA 3.24Å; C50-G54 WeakPolarHBondContact O-CA 3.39Å; C50-G54 PolarHBondContact O-N 2.8Å; C50-K55 PolarHBondContact N-O 2.91Å; C50-F57 HydrophobicContact CB-CE2 4.21Å; C50-L63 HydrophobicContact CB-CD1 3.49Å; C50-L63 VanDerWaalsContact CB-CD1 3.49Å
51	K	64.9	Low	57.8	Low	207 Å²	207	97.2 Å²	97.2	90%	0.9	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.8	-178.2	-65.3	-174.5	178.7	-178.2	0	113.3	K49	K49-K51 PolarHBondContact O-N 3.21Å
52	E	58.2	Low	59	Low	134 Å²	134	93.4 Å²	93.4	63%	0.626	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-28.1	-175.1	-67	176.3	153.8	0	0	114.1	C50 H70	C50-E52 VanDerWaalsContact C-N 3.3Å; C50-E52 PolarHBondContact O-N 3.19Å; E52-H70 WeakPolarHBondContact OE2-CB 3.36Å; E52-H70 IonicContact OE2-CD2 3.37Å; E52-H70 PolarHBondContact OE2-CD2 3.02Å; E52-H70 IonicContact OE2-CG 3.06Å
53	C	65.5	Low	60.5	Low	50 Å²	50	87.2 Å²	87.2	34%	0.338	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	3.4	-177.7	72.8	0	0	0	0	114.2	K55 H66 H70	C53-K55 PolarHBondContact O-N 3.06Å; C53-K55 VanDerWaalsContact O-N 3.07Å; C53-H66 PolarHBondContact SG-NE2 3.44Å; C53-H70 PolarHBondContact SG-NE2 3.04Å; C53-H70 VanDerWaalsContact SG-NE2 3.42Å
54	G	62.4	Low	61.8	Low	41 Å²	41	82 Å²	82	42%	0.423	44%	0.444	S	S	.	.			trans	69.3	0.8	176.1	0	0	0	0	0	115.9	K49 C50	K49-G54 VanDerWaalsContact CE-O 3.3Å; K49-G54 WeakPolarHBondContact CE-O 3.09Å; C50-G54 VanDerWaalsContact O-CA 3.24Å; C50-G54 WeakPolarHBondContact O-CA 3.39Å; C50-G54 PolarHBondContact O-N 2.8Å
55	K	63	Low	62.9	Low	122 Å²	122	83.3 Å²	83.3	53%	0.53	44%	0.439	S	S	.	.			trans	-72.1	131.6	-177.8	-68.6	-179.6	-179.1	177.7	0	111.5	C50 C53 F57	C50-K55 PolarHBondContact N-O 2.91Å; C53-K55 PolarHBondContact O-N 3.06Å; C53-K55 VanDerWaalsContact O-N 3.07Å; K55-F57 HydrophobicContact CB-CE2 3.73Å; K55-F57 HydrophobicContact CB-CZ 3.78Å; K55-F57 HydrophobicContact CD-CZ 4.5Å; K55-F57 WeakPolarHBondContact O-CD2 3.46Å; K55-F57 WeakPolarHBondContact O-CE2 3.34Å
56	S	61.8	Low	63.6	Low	52 Å²	52	79.1 Å²	79.1	36%	0.364	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.3	177.7	-55.4	0	0	0	0	111.4
57	F	72.9	Confident	64.1	Low	33 Å²	33	77.8 Å²	77.8	15%	0.145	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.9	-179.7	-57.7	-86.8	0	0	0	110.2	K46 H48 C50 K55 V62 L63 H66	K46-F57 CarbonylContact C-O 3.32Å; K46-F57 WeakPolarHBondContact CA-O 3.47Å; H48-F57 PolarHBondContact N-O 3.41Å; H48-F57 PolarHBondContact O-N 3.28Å; C50-F57 HydrophobicContact CB-CE2 4.21Å; K55-F57 HydrophobicContact CB-CE2 3.73Å; K55-F57 HydrophobicContact CB-CZ 3.78Å; K55-F57 HydrophobicContact CD-CZ 4.5Å; K55-F57 WeakPolarHBondContact O-CD2 3.46Å; K55-F57 WeakPolarHBondContact O-CE2 3.34Å; F57-V62 HydrophobicContact CB-CB 4.47Å; F57-V62 HydrophobicContact CD1-CB 4.36Å; F57-V62 HydrophobicContact CD1-CG1 3.61Å; F57-V62 HydrophobicContact CE1-CG1 4.23Å; F57-V62 HydrophobicContact CG-CG1 4.36Å; F57-L63 HydrophobicContact CB-CB 4.23Å; F57-L63 HydrophobicContact CD2-CB 3.87Å; F57-L63 HydrophobicContact CD2-CD1 3.6Å; F57-L63 HydrophobicContact CD2-CG 4.32Å; F57-L63 HydrophobicContact CE2-CD1 3.78Å; F57-L63 HydrophobicContact CG-CB 4.25Å; F57-H66 HydrophobicContact CE1-CB 4.02Å; F57-H66 HydrophobicContact CE2-CB 3.97Å; F57-H66 AromaticContact CE2-CD2 3.49Å; F57-H66 VanDerWaalsContact CE2-CD2 3.49Å; F57-H66 WeakPolarHBondContact CE2-CD2 3.44Å; F57-H66 AromaticContact CE2-CG 3.7Å; F57-H66 HydrophobicContact CZ-CB 3.56Å; F57-H66 AromaticContact CZ-CD2 3.39Å; F57-H66 WeakPolarHBondContact CZ-CD2 3.37Å; F57-H66 AromaticContact CZ-CG 3.19Å; F57-H66 AromaticContact CZ-ND1 3.6Å; F57-H66 AromaticContact CZ-NE2 3.89Å
58	D	62.7	Low	64.8	Low	91 Å²	91	76.7 Å²	76.7	49%	0.487	38%	0.382	S	S	.	.	S	Bend	trans	-75.4	-26.1	178	58.7	-15.7	0	0	0	112.7	K46	K46-D58 HydrophobicContact CG-CB 4.37Å
59	R	67.1	Low	64.6	Low	170 Å²	170	78.7 Å²	78.7	64%	0.642	39%	0.394	S	S	*	.	S	Bend	trans	-133.9	139.3	-179.6	-63.2	179.3	179.5	-176.3	-1.8	111.6	S61 V62 L63	R59-S61 PolarHBondContact O-N 3.31Å; R59-V62 HydrophobicContact CB-CG2 4.14Å; R59-V62 PolarHBondContact O-N 3.38Å; R59-V62 VanDerWaalsContact O-N 3.09Å; R59-L63 PolarHBondContact O-N 3.09Å
60	N	65.8	Low	64	Low	74 Å²	74	76 Å²	76	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-59.8	-34.6	178.7	-162.6	31.5	0	0	0	112.5	H48 V62 L63 I64	H48-N60 PolarHBondContact CD2-N 3.07Å; H48-N60 VanDerWaalsContact CD2-N 3.27Å; H48-N60 PolarHBondContact ND1-OD1 2.88Å; N60-V62 VanDerWaalsContact C-N 3.28Å; N60-V62 PolarHBondContact O-N 3.3Å; N60-L63 WeakPolarHBondContact O-CB 3.21Å; N60-L63 PolarHBondContact O-N 3.13Å; N60-I64 VanDerWaalsContact O-CG1 3.3Å; N60-I64 WeakPolarHBondContact O-CG1 3.45Å; N60-I64 PolarHBondContact O-N 2.93Å
61	S	64.2	Low	63.6	Low	80 Å²	80	79.9 Å²	79.9	56%	0.559	41%	0.407	S	S	*	.	H	α-helix	trans	-61.9	-33.5	176.8	52.9	0	0	0	0	113.3	R59 Q65	R59-S61 PolarHBondContact O-N 3.31Å; S61-Q65 WeakPolarHBondContact O-CB 3.47Å; S61-Q65 PolarHBondContact O-N 3.31Å
62	V	62.6	Low	63.2	Low	53 Å²	53	72.3 Å²	72.3	32%	0.321	39%	0.388	S	S	.	.	H	α-helix	trans	-77.4	-35.6	176	-175.7	0	0	0	0	110.6	F57 R59 N60 Q65 H66	F57-V62 HydrophobicContact CB-CB 4.47Å; F57-V62 HydrophobicContact CD1-CB 4.36Å; F57-V62 HydrophobicContact CD1-CG1 3.61Å; F57-V62 HydrophobicContact CE1-CG1 4.23Å; F57-V62 HydrophobicContact CG-CG1 4.36Å; R59-V62 HydrophobicContact CB-CG2 4.14Å; R59-V62 PolarHBondContact O-N 3.38Å; R59-V62 VanDerWaalsContact O-N 3.09Å; N60-V62 VanDerWaalsContact C-N 3.28Å; N60-V62 PolarHBondContact O-N 3.3Å; V62-Q65 PolarHBondContact O-N 3.26Å; V62-H66 VanDerWaalsContact O-CB 3.24Å; V62-H66 WeakPolarHBondContact O-CB 3.46Å; V62-H66 PolarHBondContact O-N 2.84Å
63	L	65.9	Low	63.4	Low	11 Å²	11	71.2 Å²	71.2	6%	0.058	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-46.9	171.1	173	62.6	0	0	0	111.4	H48 C50 F57 R59 N60 Q65 H66 Q67	H48-L63 HydrophobicContact CB-CB 4.1Å; H48-L63 HydrophobicContact CB-CD2 3.71Å; C50-L63 HydrophobicContact CB-CD1 3.49Å; C50-L63 VanDerWaalsContact CB-CD1 3.49Å; F57-L63 HydrophobicContact CB-CB 4.23Å; F57-L63 HydrophobicContact CD2-CB 3.87Å; F57-L63 HydrophobicContact CD2-CD1 3.6Å; F57-L63 HydrophobicContact CD2-CG 4.32Å; F57-L63 HydrophobicContact CE2-CD1 3.78Å; F57-L63 HydrophobicContact CG-CB 4.25Å; R59-L63 PolarHBondContact O-N 3.09Å; N60-L63 WeakPolarHBondContact O-CB 3.21Å; N60-L63 PolarHBondContact O-N 3.13Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 2.97Å; L63-H66 CarbonylContact O-C 3.51Å; L63-H66 WeakPolarHBondContact O-CA 3.43Å; L63-H66 WeakPolarHBondContact O-CB 3.39Å; L63-H66 PolarHBondContact O-N 3.02Å; L63-H66 VanDerWaalsContact O-N 3.09Å; L63-Q67 HydrophobicContact CD1-CG 4.18Å; L63-Q67 WeakPolarHBondContact O-CG 3.23Å; L63-Q67 PolarHBondContact O-N 3.27Å
64	I	66.1	Low	63.5	Low	75 Å²	75	75.9 Å²	75.9	39%	0.385	39%	0.394	S	S	.	.	H	α-helix	trans	-61.8	-42.7	177.4	-68.1	166.5	0	0	0	110.4	N60 H66 Q67 R68	N60-I64 VanDerWaalsContact O-CG1 3.3Å; N60-I64 WeakPolarHBondContact O-CG1 3.45Å; N60-I64 PolarHBondContact O-N 2.93Å; I64-H66 VanDerWaalsContact C-N 3.3Å; I64-H66 PolarHBondContact O-N 3.09Å; I64-Q67 PolarHBondContact O-N 3.47Å; I64-R68 PolarHBondContact O-N 3.2Å
65	Q	60.8	Low	63.9	Low	68 Å²	68	77.3 Å²	77.3	32%	0.318	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-36	173.7	-173.4	-179.7	12.2	0	0	112.3	S61 V62 L63 R68	S61-Q65 WeakPolarHBondContact O-CB 3.47Å; S61-Q65 PolarHBondContact O-N 3.31Å; V62-Q65 PolarHBondContact O-N 3.26Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 2.97Å; Q65-R68 WeakPolarHBondContact O-CB 3.47Å
66	H	64	Low	64.3	Low	21 Å²	21	74.6 Å²	74.6	10%	0.097	38%	0.382	C	S	.	.	H	α-helix	trans	-70.3	-38.5	177.4	175.8	72.6	0	0	0	112.7	C53 F57 V62 L63 I64 R68 I69 H70	C53-H66 PolarHBondContact SG-NE2 3.44Å; F57-H66 HydrophobicContact CE1-CB 4.02Å; F57-H66 HydrophobicContact CE2-CB 3.97Å; F57-H66 AromaticContact CE2-CD2 3.49Å; F57-H66 VanDerWaalsContact CE2-CD2 3.49Å; F57-H66 WeakPolarHBondContact CE2-CD2 3.44Å; F57-H66 AromaticContact CE2-CG 3.7Å; F57-H66 HydrophobicContact CZ-CB 3.56Å; F57-H66 AromaticContact CZ-CD2 3.39Å; F57-H66 WeakPolarHBondContact CZ-CD2 3.37Å; F57-H66 AromaticContact CZ-CG 3.19Å; F57-H66 AromaticContact CZ-ND1 3.6Å; F57-H66 AromaticContact CZ-NE2 3.89Å; V62-H66 VanDerWaalsContact O-CB 3.24Å; V62-H66 WeakPolarHBondContact O-CB 3.46Å; V62-H66 PolarHBondContact O-N 2.84Å; L63-H66 CarbonylContact O-C 3.51Å; L63-H66 WeakPolarHBondContact O-CA 3.43Å; L63-H66 WeakPolarHBondContact O-CB 3.39Å; L63-H66 PolarHBondContact O-N 3.02Å; L63-H66 VanDerWaalsContact O-N 3.09Å; I64-H66 VanDerWaalsContact C-N 3.3Å; I64-H66 PolarHBondContact O-N 3.09Å; H66-R68 PolarHBondContact O-N 3.29Å; H66-I69 VanDerWaalsContact O-CB 3.22Å; H66-I69 WeakPolarHBondContact O-CB 3.43Å; H66-I69 WeakPolarHBondContact O-CG1 3.29Å; H66-I69 PolarHBondContact O-N 3.4Å; H66-H70 AromaticContact NE2-NE2 3.56Å
67	Q	62.9	Low	64.1	Low	70 Å²	70	78.8 Å²	78.8	33%	0.327	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-27.2	177.2	-76.9	172.8	-33.8	0	0	112.7	L63 I64 I69 H70 T71	L63-Q67 HydrophobicContact CD1-CG 4.18Å; L63-Q67 WeakPolarHBondContact O-CG 3.23Å; L63-Q67 PolarHBondContact O-N 3.27Å; I64-Q67 PolarHBondContact O-N 3.47Å; Q67-I69 PolarHBondContact O-N 3.25Å; Q67-I69 VanDerWaalsContact O-N 3.1Å; Q67-H70 PolarHBondContact O-N 3.44Å; Q67-T71 PolarHBondContact O-N 2.83Å; Q67-T71 PolarHBondContact O-OG1 2.95Å
68	R	69.9	Low	63.6	Low	55 Å²	55	77.2 Å²	77.2	21%	0.208	39%	0.387	C	S	.	.	H	α-helix	trans	-60.6	-17.9	171.9	-63.7	176.7	-176.3	176.3	-1.1	114.3	I64 Q65 H66 T71 G72 E73 T86	I64-R68 PolarHBondContact O-N 3.2Å; Q65-R68 WeakPolarHBondContact O-CB 3.47Å; H66-R68 PolarHBondContact O-N 3.29Å; R68-T71 WeakPolarHBondContact CA-OG1 3.16Å; R68-G72 WeakPolarHBondContact O-CA 3.14Å; R68-G72 PolarHBondContact O-N 2.83Å; R68-G72 VanDerWaalsContact O-N 3.12Å; R68-E73 HydrophobicContact CB-CB 4.34Å; R68-E73 HydrophobicContact CG-CB 4.19Å; R68-E73 PolarHBondContact O-N 2.8Å; R68-T86 HydrophobicContact CB-CG2 4.37Å; R68-T86 PolarHBondContact NH1-O 3.13Å
69	I	58.8	Low	63.7	Low	107 Å²	107	81.3 Å²	81.3	55%	0.549	40%	0.403	S	S	.	.	H	α-helix	trans	-72.7	-33.8	173.6	-59	175.6	0	0	0	110.5	H66 Q67	H66-I69 VanDerWaalsContact O-CB 3.22Å; H66-I69 WeakPolarHBondContact O-CB 3.43Å; H66-I69 WeakPolarHBondContact O-CG1 3.29Å; H66-I69 PolarHBondContact O-N 3.4Å; Q67-I69 PolarHBondContact O-N 3.25Å; Q67-I69 VanDerWaalsContact O-N 3.1Å
70	H	55.6	Low	62.8	Low	79 Å²	79	79.8 Å²	79.8	37%	0.366	40%	0.403	S	S	.	.	H	α-helix	trans	-86.5	-39.8	-179.7	-56.9	-51.1	0	0	0	112	E52 C53 H66 Q67 G72	E52-H70 WeakPolarHBondContact OE2-CB 3.36Å; E52-H70 IonicContact OE2-CD2 3.37Å; E52-H70 PolarHBondContact OE2-CD2 3.02Å; E52-H70 IonicContact OE2-CG 3.06Å; C53-H70 PolarHBondContact SG-NE2 3.04Å; C53-H70 VanDerWaalsContact SG-NE2 3.42Å; H66-H70 AromaticContact NE2-NE2 3.56Å; Q67-H70 PolarHBondContact O-N 3.44Å; H70-G72 VanDerWaalsContact C-N 3.27Å; H70-G72 PolarHBondContact O-N 3.5Å
71	T	60.3	Low	62.3	Low	84 Å²	84	78.8 Å²	78.8	52%	0.515	40%	0.402	S	S	.	.	H	α-helix	trans	-77.9	-12.2	176.8	64	0	0	0	0	113.3	Q67 R68 E73	Q67-T71 PolarHBondContact O-N 2.83Å; Q67-T71 PolarHBondContact O-OG1 2.95Å; R68-T71 WeakPolarHBondContact CA-OG1 3.16Å; T71-E73 PolarHBondContact O-N 2.96Å
72	G	56.7	Low	61.6	Low	49 Å²	49	77.8 Å²	77.8	51%	0.505	40%	0.404	S	S	.	.			trans	73	3.3	-178.9	0	0	0	0	0	114.6	R68 H70 R74	R68-G72 WeakPolarHBondContact O-CA 3.14Å; R68-G72 PolarHBondContact O-N 2.83Å; R68-G72 VanDerWaalsContact O-N 3.12Å; H70-G72 VanDerWaalsContact C-N 3.27Å; H70-G72 PolarHBondContact O-N 3.5Å; G72-R74 PolarHBondContact O-N 3.45Å
73	E	61.8	Low	61.1	Low	110 Å²	110	79.9 Å²	79.9	51%	0.514	41%	0.411	S	S	.	.			trans	-62.1	124.8	180	-74.6	-176.8	177.3	0	0	112	R68 T71 P75	R68-E73 HydrophobicContact CB-CB 4.34Å; R68-E73 HydrophobicContact CG-CB 4.19Å; R68-E73 PolarHBondContact O-N 2.8Å; T71-E73 PolarHBondContact O-N 2.96Å; E73-P75 WeakPolarHBondContact O-CD 3.45Å
74	R	68.8	Low	60.7	Low	149 Å²	149	80.4 Å²	80.4	56%	0.562	42%	0.417	S	S	*	.			trans	-126.7	77.1	179.2	-72.8	171	161.4	-159.9	2	110.4	G72 Y76 A84 F85 T86	G72-R74 PolarHBondContact O-N 3.45Å; R74-Y76 PolarHBondContact O-N 3.03Å; R74-A84 HydrophobicContact CB-CB 3.5Å; R74-A84 VanDerWaalsContact CD-O 3.25Å; R74-A84 WeakPolarHBondContact CD-O 3.28Å; R74-A84 HydrophobicContact CG-CB 4.46Å; R74-A84 PolarHBondContact NH1-O 3.01Å; R74-F85 CarbonylContact C-O 3.58Å; R74-F85 WeakPolarHBondContact CA-O 3.49Å; R74-T86 HydrophobicContact CG-CG2 4.05Å
75	P	71.1	Confident	60.8	Low	70 Å²	70	78 Å²	78	46%	0.455	40%	0.404	S	S	.	.			trans	-69.4	-19.1	-171.1	-21	34.6	0	0	0	114.3	E73	E73-P75 WeakPolarHBondContact O-CD 3.45Å
76	Y	70.3	Confident	60.8	Low	66 Å²	66	76.1 Å²	76.1	26%	0.259	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	101.1	-172.3	-59.1	-77.6	0	0	0	110.3	R74 A84 F85 G87 R88	R74-Y76 PolarHBondContact O-N 3.03Å; Y76-A84 CarbonylContact O-C 3.52Å; Y76-A84 WeakPolarHBondContact O-CA 3.48Å; Y76-F85 PolarHBondContact N-O 2.86Å; Y76-F85 PolarHBondContact O-N 3.21Å; Y76-G87 VanDerWaalsContact CD2-C 3.42Å; Y76-G87 VanDerWaalsContact CD2-CA 3.47Å; Y76-R88 HydrophobicContact CD1-CB 3.99Å; Y76-R88 HydrophobicContact CE1-CB 3.78Å; Y76-R88 HydrophobicContact CE1-CG 4.44Å; Y76-R88 HydrophobicContact CE2-CB 4.46Å; Y76-R88 HydrophobicContact CG-CB 4.42Å
77	K	57.1	Low	61	Low	139 Å²	139	75.2 Å²	75.2	60%	0.604	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	144.2	-179.9	-63.6	-179.5	-178.1	176.6	0	111.4	M83 A84 L91	K77-M83 CarbonylContact C-O 3.56Å; K77-A84 HydrophobicContact CG-CB 3.95Å; K77-L91 WeakPolarHBondContact O-CD2 3.39Å
78	C	64.1	Low	61.2	Low	1 Å²	1	80 Å²	80	1%	0.007	41%	0.408	C	S	.	.			trans	-89.3	117.2	169.3	-179	0	0	0	0	108.8	E80 C81 G82 M83 F85 L91 H98	C78-E80 VanDerWaalsContact C-N 3.26Å; C78-E80 PolarHBondContact O-N 3.02Å; C78-C81 PolarHBondContact O-N 3.13Å; C78-G82 VanDerWaalsContact O-CA 3.23Å; C78-G82 WeakPolarHBondContact O-CA 3.24Å; C78-G82 PolarHBondContact O-N 2.95Å; C78-M83 WeakPolarHBondContact CB-O 3.18Å; C78-M83 PolarHBondContact N-O 3.31Å; C78-F85 HydrophobicContact CB-CE2 4.19Å; C78-L91 HydrophobicContact CB-CD1 3.58Å; C78-H98 PolarHBondContact SG-NE2 3.28Å; C78-H98 VanDerWaalsContact SG-NE2 3.43Å
79	E	63.1	Low	61	Low	177 Å²	177	80.8 Å²	80.8	83%	0.827	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.6	-178.1	-61.2	-57.7	145.5	0	0	113.1
80	E	49	Very low	61.1	Low	137 Å²	137	79.1 Å²	79.1	64%	0.64	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-26.3	-177.1	-68.5	176.1	157.8	0	0	114.3	C78 H98	C78-E80 VanDerWaalsContact C-N 3.26Å; C78-E80 PolarHBondContact O-N 3.02Å; E80-H98 WeakPolarHBondContact OE2-CB 3.12Å; E80-H98 IonicContact OE2-CD2 2.97Å; E80-H98 PolarHBondContact OE2-CD2 3.38Å; E80-H98 IonicContact OE2-CG 3.11Å
81	C	54.2	Low	61.6	Low	54 Å²	54	76.2 Å²	76.2	37%	0.365	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.3	3.1	-176.3	72.4	0	0	0	0	114.5	C78 M83 H94 H98	C78-C81 PolarHBondContact O-N 3.13Å; C81-M83 PolarHBondContact O-N 3.47Å; C81-M83 VanDerWaalsContact O-N 3.09Å; C81-M83 VanDerWaalsContact SG-CB 3.58Å; C81-M83 VanDerWaalsContact SG-CG 3.58Å; C81-H94 PolarHBondContact SG-NE2 3.43Å; C81-H98 PolarHBondContact SG-NE2 2.82Å; C81-H98 VanDerWaalsContact SG-NE2 3.36Å
82	G	51.1	Low	62	Low	58 Å²	58	74.7 Å²	74.7	60%	0.598	39%	0.393	S	S	*	.			trans	69	0.2	179.6	0	0	0	0	0	115.4	C78 A84	C78-G82 VanDerWaalsContact O-CA 3.23Å; C78-G82 WeakPolarHBondContact O-CA 3.24Å; C78-G82 PolarHBondContact O-N 2.95Å; G82-A84 PolarHBondContact O-N 3.21Å
83	M	51.4	Low	62.5	Low	98 Å²	98	77.9 Å²	77.9	48%	0.483	39%	0.393	S	S	.	.			trans	-70.7	130.4	-176.9	-73.5	-96.5	-75.7	0	0	111.6	K77 C78 C81 F85	K77-M83 CarbonylContact C-O 3.56Å; C78-M83 WeakPolarHBondContact CB-O 3.18Å; C78-M83 PolarHBondContact N-O 3.31Å; C81-M83 PolarHBondContact O-N 3.47Å; C81-M83 VanDerWaalsContact O-N 3.09Å; C81-M83 VanDerWaalsContact SG-CB 3.58Å; C81-M83 VanDerWaalsContact SG-CG 3.58Å; M83-F85 HydrophobicContact CB-CE2 3.75Å; M83-F85 HydrophobicContact CB-CZ 3.74Å; M83-F85 HydrophobicContact CE-CZ 4.26Å; M83-F85 WeakPolarHBondContact O-CD2 3.5Å; M83-F85 VanDerWaalsContact O-CE2 3.22Å; M83-F85 WeakPolarHBondContact O-CE2 3.42Å
84	A	57.8	Low	62.7	Low	21 Å²	21	73.9 Å²	73.9	17%	0.174	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	138.9	-178.5	0	0	0	0	0	112.1	R74 Y76 K77 G82	R74-A84 HydrophobicContact CB-CB 3.5Å; R74-A84 VanDerWaalsContact CD-O 3.25Å; R74-A84 WeakPolarHBondContact CD-O 3.28Å; R74-A84 HydrophobicContact CG-CB 4.46Å; R74-A84 PolarHBondContact NH1-O 3.01Å; Y76-A84 CarbonylContact O-C 3.52Å; Y76-A84 WeakPolarHBondContact O-CA 3.48Å; K77-A84 HydrophobicContact CG-CB 3.95Å; G82-A84 PolarHBondContact O-N 3.21Å
85	F	67.2	Low	62.5	Low	26 Å²	26	70.7 Å²	70.7	11%	0.114	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	151.4	-174.6	-57.5	-85.5	0	0	0	112	R74 Y76 C78 M83 G87 I90 L91 H94	R74-F85 CarbonylContact C-O 3.58Å; R74-F85 WeakPolarHBondContact CA-O 3.49Å; Y76-F85 PolarHBondContact N-O 2.86Å; Y76-F85 PolarHBondContact O-N 3.21Å; C78-F85 HydrophobicContact CB-CE2 4.19Å; M83-F85 HydrophobicContact CB-CE2 3.75Å; M83-F85 HydrophobicContact CB-CZ 3.74Å; M83-F85 HydrophobicContact CE-CZ 4.26Å; M83-F85 WeakPolarHBondContact O-CD2 3.5Å; M83-F85 VanDerWaalsContact O-CE2 3.22Å; M83-F85 WeakPolarHBondContact O-CE2 3.42Å; F85-G87 VanDerWaalsContact C-N 3.3Å; F85-G87 PolarHBondContact O-N 3.33Å; F85-I90 HydrophobicContact CB-CB 4.43Å; F85-I90 HydrophobicContact CB-CG2 4.42Å; F85-I90 HydrophobicContact CD1-CB 4.46Å; F85-I90 HydrophobicContact CD1-CG2 3.62Å; F85-I90 HydrophobicContact CE1-CG2 4.34Å; F85-I90 HydrophobicContact CG-CG2 4.3Å; F85-L91 HydrophobicContact CB-CB 4.3Å; F85-L91 HydrophobicContact CD2-CB 3.89Å; F85-L91 HydrophobicContact CD2-CD1 3.61Å; F85-L91 HydrophobicContact CD2-CG 4.33Å; F85-L91 HydrophobicContact CE2-CD1 3.75Å; F85-L91 HydrophobicContact CG-CB 4.27Å; F85-H94 HydrophobicContact CE1-CB 3.98Å; F85-H94 AromaticContact CE1-CG 3.98Å; F85-H94 HydrophobicContact CE2-CB 4.02Å; F85-H94 AromaticContact CE2-CD2 3.47Å; F85-H94 VanDerWaalsContact CE2-CD2 3.47Å; F85-H94 WeakPolarHBondContact CE2-CD2 3.45Å; F85-H94 AromaticContact CE2-CG 3.7Å; F85-H94 HydrophobicContact CZ-CB 3.57Å; F85-H94 AromaticContact CZ-CD2 3.38Å; F85-H94 WeakPolarHBondContact CZ-CD2 3.33Å; F85-H94 AromaticContact CZ-CE1 3.85Å; F85-H94 AromaticContact CZ-CG 3.17Å; F85-H94 AromaticContact CZ-ND1 3.5Å; F85-H94 WeakPolarHBondContact CZ-ND1 3.4Å; F85-H94 AromaticContact CZ-NE2 3.78Å
86	T	61	Low	62.7	Low	28 Å²	28	70.4 Å²	70.4	17%	0.172	36%	0.355	C	S	.	.	S	Bend	trans	-75.1	-18.9	-178.4	53.8	0	0	0	0	113.2	R68 R74	R68-T86 HydrophobicContact CB-CG2 4.37Å; R68-T86 PolarHBondContact NH1-O 3.13Å; R74-T86 HydrophobicContact CG-CG2 4.05Å
87	G	69.8	Low	62.3	Low	1 Å²	1	72.7 Å²	72.7	1%	0.01	37%	0.371	C	S	.	.	S	Bend	trans	-147.7	146.8	-179.2	0	0	0	0	0	113.7	Y76 F85 C89 I90 L91	Y76-G87 VanDerWaalsContact CD2-C 3.42Å; Y76-G87 VanDerWaalsContact CD2-CA 3.47Å; F85-G87 VanDerWaalsContact C-N 3.3Å; F85-G87 PolarHBondContact O-N 3.33Å; G87-C89 VanDerWaalsContact C-N 3.32Å; G87-C89 PolarHBondContact O-N 3.46Å; G87-I90 PolarHBondContact O-N 3.08Å; G87-I90 VanDerWaalsContact O-N 3.12Å; G87-L91 PolarHBondContact O-N 3.26Å
88	R	66.3	Low	62.3	Low	170 Å²	170	69.6 Å²	69.6	64%	0.642	36%	0.359	S	S	*	.	H	α-helix	trans	-57	-40.6	179.2	-173.2	179.5	-74.8	-98.4	2.7	112.7	Y76 I90 L91 S92	Y76-R88 HydrophobicContact CD1-CB 3.99Å; Y76-R88 HydrophobicContact CE1-CB 3.78Å; Y76-R88 HydrophobicContact CE1-CG 4.44Å; Y76-R88 HydrophobicContact CE2-CB 4.46Å; Y76-R88 HydrophobicContact CG-CB 4.42Å; R88-I90 VanDerWaalsContact C-N 3.26Å; R88-I90 PolarHBondContact O-N 3.36Å; R88-L91 WeakPolarHBondContact O-CB 3.46Å; R88-L91 PolarHBondContact O-N 3.33Å; R88-S92 PolarHBondContact O-N 2.85Å; R88-S92 PolarHBondContact O-OG 2.92Å; R88-S92 VanDerWaalsContact O-OG 3.08Å
89	C	64.8	Low	62.4	Low	73 Å²	73	73.4 Å²	73.4	49%	0.493	38%	0.382	S	S	.	.	H	α-helix	trans	-65.2	-27	179.1	64.9	0	0	0	0	113.8	G87 K93	G87-C89 VanDerWaalsContact C-N 3.32Å; G87-C89 PolarHBondContact O-N 3.46Å; C89-K93 WeakPolarHBondContact O-CG 3.43Å; C89-K93 PolarHBondContact O-N 2.97Å
90	I	61.1	Low	62.5	Low	72 Å²	72	67.2 Å²	67.2	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-78.6	-41.9	176.6	-56.5	176.4	0	0	0	109.3	F85 G87 R88 K93 H94	F85-I90 HydrophobicContact CB-CB 4.43Å; F85-I90 HydrophobicContact CB-CG2 4.42Å; F85-I90 HydrophobicContact CD1-CB 4.46Å; F85-I90 HydrophobicContact CD1-CG2 3.62Å; F85-I90 HydrophobicContact CE1-CG2 4.34Å; F85-I90 HydrophobicContact CG-CG2 4.3Å; G87-I90 PolarHBondContact O-N 3.08Å; G87-I90 VanDerWaalsContact O-N 3.12Å; R88-I90 VanDerWaalsContact C-N 3.26Å; R88-I90 PolarHBondContact O-N 3.36Å; I90-K93 PolarHBondContact O-N 2.96Å; I90-H94 WeakPolarHBondContact O-CB 3.41Å; I90-H94 PolarHBondContact O-N 3.47Å
91	L	67.3	Low	63.5	Low	17 Å²	17	65.8 Å²	65.8	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-58.1	-46.5	171.3	173.9	62.3	0	0	0	111.2	K77 C78 F85 G87 R88 K93 H94 Q95	K77-L91 WeakPolarHBondContact O-CD2 3.39Å; C78-L91 HydrophobicContact CB-CD1 3.58Å; F85-L91 HydrophobicContact CB-CB 4.3Å; F85-L91 HydrophobicContact CD2-CB 3.89Å; F85-L91 HydrophobicContact CD2-CD1 3.61Å; F85-L91 HydrophobicContact CD2-CG 4.33Å; F85-L91 HydrophobicContact CE2-CD1 3.75Å; F85-L91 HydrophobicContact CG-CB 4.27Å; G87-L91 PolarHBondContact O-N 3.26Å; R88-L91 WeakPolarHBondContact O-CB 3.46Å; R88-L91 PolarHBondContact O-N 3.33Å; L91-K93 VanDerWaalsContact C-N 3.31Å; L91-K93 PolarHBondContact O-N 3.3Å; L91-H94 CarbonylContact O-C 3.58Å; L91-H94 WeakPolarHBondContact O-CA 3.48Å; L91-H94 WeakPolarHBondContact O-CB 3.44Å; L91-H94 PolarHBondContact O-N 3.37Å; L91-Q95 HydrophobicContact CD1-CG 4.11Å; L91-Q95 HydrophobicContact CG-CG 4.42Å; L91-Q95 WeakPolarHBondContact O-CG 3.44Å; L91-Q95 PolarHBondContact O-N 3.47Å
92	S	68.9	Low	64.6	Low	53 Å²	53	69.2 Å²	69.2	37%	0.371	37%	0.367	S	S	.	.	H	α-helix	trans	-62.7	-34.7	178.1	-56.5	0	0	0	0	113.2	R88	R88-S92 PolarHBondContact O-N 2.85Å; R88-S92 PolarHBondContact O-OG 2.92Å; R88-S92 VanDerWaalsContact O-OG 3.08Å
93	K	67.2	Low	65.9	Low	116 Å²	116	69.8 Å²	69.8	50%	0.504	36%	0.361	S	S	.	.	H	α-helix	trans	-70.5	-34.3	172.1	-73.2	175.1	-175.2	178.2	0	112.1	C89 I90 L91	C89-K93 WeakPolarHBondContact O-CG 3.43Å; C89-K93 PolarHBondContact O-N 2.97Å; I90-K93 PolarHBondContact O-N 2.96Å; L91-K93 VanDerWaalsContact C-N 3.31Å; L91-K93 PolarHBondContact O-N 3.3Å
94	H	64.3	Low	67.1	Low	26 Å²	26	69 Å²	69	12%	0.12	35%	0.353	C	S	.	.	H	α-helix	trans	-69.9	-40.7	176.7	172.3	77.8	0	0	0	112.4	C81 F85 I90 L91 R96 I97 H98	C81-H94 PolarHBondContact SG-NE2 3.43Å; F85-H94 HydrophobicContact CE1-CB 3.98Å; F85-H94 AromaticContact CE1-CG 3.98Å; F85-H94 HydrophobicContact CE2-CB 4.02Å; F85-H94 AromaticContact CE2-CD2 3.47Å; F85-H94 VanDerWaalsContact CE2-CD2 3.47Å; F85-H94 WeakPolarHBondContact CE2-CD2 3.45Å; F85-H94 AromaticContact CE2-CG 3.7Å; F85-H94 HydrophobicContact CZ-CB 3.57Å; F85-H94 AromaticContact CZ-CD2 3.38Å; F85-H94 WeakPolarHBondContact CZ-CD2 3.33Å; F85-H94 AromaticContact CZ-CE1 3.85Å; F85-H94 AromaticContact CZ-CG 3.17Å; F85-H94 AromaticContact CZ-ND1 3.5Å; F85-H94 WeakPolarHBondContact CZ-ND1 3.4Å; F85-H94 AromaticContact CZ-NE2 3.78Å; I90-H94 WeakPolarHBondContact O-CB 3.41Å; I90-H94 PolarHBondContact O-N 3.47Å; L91-H94 CarbonylContact O-C 3.58Å; L91-H94 WeakPolarHBondContact O-CA 3.48Å; L91-H94 WeakPolarHBondContact O-CB 3.44Å; L91-H94 PolarHBondContact O-N 3.37Å; H94-R96 PolarHBondContact O-N 3.3Å; H94-R96 VanDerWaalsContact O-N 3.14Å; H94-I97 WeakPolarHBondContact O-CB 3.43Å; H94-I97 VanDerWaalsContact O-CG1 3.29Å; H94-I97 WeakPolarHBondContact O-CG1 3.34Å; H94-I97 PolarHBondContact O-N 2.73Å; H94-H98 AromaticContact NE2-NE2 3.44Å; H94-H98 PolarHBondContact NE2-NE2 2.89Å
95	Q	66	Low	67.9	Low	81 Å²	81	75.2 Å²	75.2	38%	0.379	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-27.9	178.4	-75.2	173.4	-50.6	0	0	113	L91 I97 H98 T99	L91-Q95 HydrophobicContact CD1-CG 4.11Å; L91-Q95 HydrophobicContact CG-CG 4.42Å; L91-Q95 WeakPolarHBondContact O-CG 3.44Å; L91-Q95 PolarHBondContact O-N 3.47Å; Q95-I97 PolarHBondContact O-N 2.8Å; Q95-I97 VanDerWaalsContact O-N 3.11Å; Q95-H98 PolarHBondContact O-N 3.29Å; Q95-T99 PolarHBondContact O-N 2.57Å; Q95-T99 VanDerWaalsContact O-N 3.14Å
96	R	74.4	Confident	68.5	Low	65 Å²	65	74.1 Å²	74.1	25%	0.245	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15	172.8	-63.6	178.1	-175.9	176.7	-1.4	114.4	H94 T99 G100 E101 S114	H94-R96 PolarHBondContact O-N 3.3Å; H94-R96 VanDerWaalsContact O-N 3.14Å; R96-T99 WeakPolarHBondContact CA-OG1 3.38Å; R96-G100 PolarHBondContact O-N 3.24Å; R96-E101 HydrophobicContact CB-CB 4.41Å; R96-E101 HydrophobicContact CG-CB 4.31Å; R96-E101 PolarHBondContact O-N 2.8Å; R96-S114 PolarHBondContact NH1-O 3.16Å
97	I	62.7	Low	69.1	Low	114 Å²	114	82.7 Å²	82.7	59%	0.585	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-37.9	173.6	-60.9	172.3	0	0	0	110.1	H94 Q95	H94-I97 WeakPolarHBondContact O-CB 3.43Å; H94-I97 VanDerWaalsContact O-CG1 3.29Å; H94-I97 WeakPolarHBondContact O-CG1 3.34Å; H94-I97 PolarHBondContact O-N 2.73Å; Q95-I97 PolarHBondContact O-N 2.8Å; Q95-I97 VanDerWaalsContact O-N 3.11Å
98	H	57.2	Low	69.1	Low	74 Å²	74	89.1 Å²	89.1	34%	0.343	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-42.2	-178.9	-57	-47.5	0	0	0	111.8	C78 E80 C81 H94 Q95 G100	C78-H98 PolarHBondContact SG-NE2 3.28Å; C78-H98 VanDerWaalsContact SG-NE2 3.43Å; E80-H98 WeakPolarHBondContact OE2-CB 3.12Å; E80-H98 IonicContact OE2-CD2 2.97Å; E80-H98 PolarHBondContact OE2-CD2 3.38Å; E80-H98 IonicContact OE2-CG 3.11Å; C81-H98 PolarHBondContact SG-NE2 2.82Å; C81-H98 VanDerWaalsContact SG-NE2 3.36Å; H94-H98 AromaticContact NE2-NE2 3.44Å; H94-H98 PolarHBondContact NE2-NE2 2.89Å; Q95-H98 PolarHBondContact O-N 3.29Å; H98-G100 PolarHBondContact O-N 2.83Å
99	T	65.3	Low	69.4	Low	81 Å²	81	83.6 Å²	83.6	50%	0.497	42%	0.423	S	S	.	.	S	Bend	trans	-75.2	-10.8	177.4	64.7	0	0	0	0	113.4	Q95 R96 E101	Q95-T99 PolarHBondContact O-N 2.57Å; Q95-T99 VanDerWaalsContact O-N 3.14Å; R96-T99 WeakPolarHBondContact CA-OG1 3.38Å; T99-E101 PolarHBondContact O-N 2.78Å; T99-E101 VanDerWaalsContact O-N 3.13Å; T99-E101 WeakPolarHBondContact OG1-CG 3.37Å
100	G	64.6	Low	69.8	Low	46 Å²	46	82.8 Å²	82.8	47%	0.474	43%	0.427	S	S	.	.			trans	67.9	5.5	-176.5	0	0	0	0	0	114.4	R96 H98 K102	R96-G100 PolarHBondContact O-N 3.24Å; H98-G100 PolarHBondContact O-N 2.83Å; G100-K102 PolarHBondContact O-N 3.35Å
101	E	70.3	Confident	70.1	Confident	108 Å²	108	85.5 Å²	85.5	51%	0.505	44%	0.436	S	S	.	.			trans	-61	122.4	-179	-76.8	-178.5	-179.7	0	0	111.6	R96 T99 P103	R96-E101 HydrophobicContact CB-CB 4.41Å; R96-E101 HydrophobicContact CG-CB 4.31Å; R96-E101 PolarHBondContact O-N 2.8Å; T99-E101 PolarHBondContact O-N 2.78Å; T99-E101 VanDerWaalsContact O-N 3.13Å; T99-E101 WeakPolarHBondContact OG1-CG 3.37Å; E101-P103 WeakPolarHBondContact O-CD 3.48Å
102	K	78	Confident	70.6	Confident	125 Å²	125	86.1 Å²	86.1	54%	0.543	44%	0.444	S	S	.	.			trans	-124.7	76.3	177.2	-69.8	168.9	-179.7	-179.8	0	110.3	G100 Y104 A112 F113	G100-K102 PolarHBondContact O-N 3.35Å; K102-Y104 PolarHBondContact O-N 3Å; K102-A112 HydrophobicContact CB-CB 3.47Å; K102-A112 VanDerWaalsContact CB-CB 3.47Å; K102-A112 HydrophobicContact CD-CB 4.11Å; K102-A112 WeakPolarHBondContact CD-O 3.44Å; K102-A112 HydrophobicContact CG-CB 4.39Å; K102-F113 CarbonylContact C-O 3.56Å; K102-F113 VanDerWaalsContact C-O 3.27Å; K102-F113 WeakPolarHBondContact CA-O 3.31Å
103	P	79.4	Confident	71	Confident	71 Å²	71	85.6 Å²	85.6	46%	0.461	44%	0.435	S	S	.	.			trans	-65.2	-22.9	-172.4	-22.4	34.8	0	0	0	113.9	E101	E101-P103 WeakPolarHBondContact O-CD 3.48Å
104	Y	75.8	Confident	71.3	Confident	82 Å²	82	81.5 Å²	81.5	32%	0.322	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	98.7	-171.6	-56.2	-80.3	0	0	0	110.4	K102 A112 F113 S116	K102-Y104 PolarHBondContact O-N 3Å; Y104-A112 CarbonylContact O-C 3.5Å; Y104-A112 WeakPolarHBondContact O-CA 3.31Å; Y104-F113 WeakPolarHBondContact CB-O 3.36Å; Y104-F113 WeakPolarHBondContact CD2-O 3.4Å; Y104-F113 PolarHBondContact N-O 3.49Å; Y104-F113 PolarHBondContact O-N 3.34Å; Y104-S116 VanDerWaalsContact CD2-N 3.32Å
105	K	75	Confident	71.7	Confident	150 Å²	150	81.3 Å²	81.3	65%	0.652	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.5	179.9	-62.9	-178.2	-178.5	177.5	0	111.7	A112	K105-A112 HydrophobicContact CG-CB 3.86Å
106	C	78.4	Confident	72.1	Confident	3 Å²	3	80.6 Å²	80.6	2%	0.02	43%	0.426	C	S	.	.			trans	-75	123.5	170.6	-177.3	0	0	0	0	109.5	E108 C109 G110 K111 F113 L119 H126	C106-E108 VanDerWaalsContact C-N 3.29Å; C106-E108 PolarHBondContact O-N 2.83Å; C106-C109 VanDerWaalsContact SG-SG 3.62Å; C106-G110 WeakPolarHBondContact O-CA 3.35Å; C106-G110 PolarHBondContact O-N 3.48Å; C106-K111 WeakPolarHBondContact CB-O 3.4Å; C106-K111 PolarHBondContact N-O 3.03Å; C106-F113 HydrophobicContact CB-CE2 4.34Å; C106-L119 HydrophobicContact CB-CD1 3.61Å; C106-H126 PolarHBondContact SG-NE2 3.2Å
107	K	73.4	Confident	71.9	Confident	208 Å²	208	81.2 Å²	81.2	90%	0.904	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.6	-179.7	-65.3	-174.9	177.2	-175.9	0	113.2
108	E	70.9	Confident	72.2	Confident	137 Å²	137	79 Å²	79	64%	0.64	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-32.6	-174.9	-69.3	167.6	172.4	0	0	113.5	C106 H126	C106-E108 VanDerWaalsContact C-N 3.29Å; C106-E108 PolarHBondContact O-N 2.83Å; E108-H126 WeakPolarHBondContact OE2-CB 3.43Å; E108-H126 IonicContact OE2-CD2 2.94Å; E108-H126 PolarHBondContact OE2-CD2 3.29Å; E108-H126 IonicContact OE2-CG 3.11Å; E108-H126 IonicContact OE2-NE2 2.94Å
109	C	72.8	Confident	73.1	Confident	54 Å²	54	76.3 Å²	76.3	37%	0.365	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	4.7	-176.4	74.8	0	0	0	0	114.5	C106 K111 H122 H126	C106-C109 VanDerWaalsContact SG-SG 3.62Å; C109-K111 PolarHBondContact O-N 3.29Å; C109-H122 PolarHBondContact SG-NE2 3.21Å; C109-H126 PolarHBondContact SG-NE2 3.37Å; C109-H126 VanDerWaalsContact SG-NE2 3.38Å
110	G	71.9	Confident	73.4	Confident	56 Å²	56	77.5 Å²	77.5	58%	0.577	42%	0.417	S	S	*	.			trans	70	-4.3	179.1	0	0	0	0	0	115.7	C106 A112	C106-G110 WeakPolarHBondContact O-CA 3.35Å; C106-G110 PolarHBondContact O-N 3.48Å; G110-A112 PolarHBondContact O-N 3.08Å
111	K	68.5	Low	73.5	Confident	128 Å²	128	78 Å²	78	56%	0.557	41%	0.408	S	S	*	.			trans	-65.9	132.7	-178.6	-73	-177.3	-179.1	175.9	0	111.6	C106 C109 F113	C106-K111 WeakPolarHBondContact CB-O 3.4Å; C106-K111 PolarHBondContact N-O 3.03Å; C109-K111 PolarHBondContact O-N 3.29Å; K111-F113 HydrophobicContact CB-CE2 3.9Å; K111-F113 HydrophobicContact CB-CZ 3.98Å; K111-F113 VanDerWaalsContact O-CE2 3.29Å; K111-F113 WeakPolarHBondContact O-CE2 3.45Å
112	A	78	Confident	73.6	Confident	31 Å²	31	73.8 Å²	73.8	26%	0.256	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142.8	-177.3	0	0	0	0	0	112.2	K102 Y104 K105 G110	K102-A112 HydrophobicContact CB-CB 3.47Å; K102-A112 VanDerWaalsContact CB-CB 3.47Å; K102-A112 HydrophobicContact CD-CB 4.11Å; K102-A112 WeakPolarHBondContact CD-O 3.44Å; K102-A112 HydrophobicContact CG-CB 4.39Å; Y104-A112 CarbonylContact O-C 3.5Å; Y104-A112 WeakPolarHBondContact O-CA 3.31Å; K105-A112 HydrophobicContact CG-CB 3.86Å; G110-A112 PolarHBondContact O-N 3.08Å
113	F	76.2	Confident	73.2	Confident	41 Å²	41	71 Å²	71	18%	0.18	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.6	-176.6	-57.9	-88.9	0	0	0	111	K102 Y104 C106 K111 C115 N118 L119 H122	K102-F113 CarbonylContact C-O 3.56Å; K102-F113 VanDerWaalsContact C-O 3.27Å; K102-F113 WeakPolarHBondContact CA-O 3.31Å; Y104-F113 WeakPolarHBondContact CB-O 3.36Å; Y104-F113 WeakPolarHBondContact CD2-O 3.4Å; Y104-F113 PolarHBondContact N-O 3.49Å; Y104-F113 PolarHBondContact O-N 3.34Å; C106-F113 HydrophobicContact CB-CE2 4.34Å; K111-F113 HydrophobicContact CB-CE2 3.9Å; K111-F113 HydrophobicContact CB-CZ 3.98Å; K111-F113 VanDerWaalsContact O-CE2 3.29Å; K111-F113 WeakPolarHBondContact O-CE2 3.45Å; F113-C115 VanDerWaalsContact C-N 3.33Å; F113-N118 HydrophobicContact CB-CB 4.3Å; F113-N118 HydrophobicContact CD1-CB 4.06Å; F113-N118 HydrophobicContact CG-CB 4.45Å; F113-L119 HydrophobicContact CB-CB 4.25Å; F113-L119 HydrophobicContact CD2-CB 3.85Å; F113-L119 HydrophobicContact CD2-CD1 3.68Å; F113-L119 HydrophobicContact CD2-CG 4.36Å; F113-L119 HydrophobicContact CE2-CD1 3.86Å; F113-L119 HydrophobicContact CG-CB 4.21Å; F113-H122 HydrophobicContact CE1-CB 3.85Å; F113-H122 HydrophobicContact CE2-CB 3.82Å; F113-H122 AromaticContact CE2-CD2 3.38Å; F113-H122 WeakPolarHBondContact CE2-CD2 3.44Å; F113-H122 AromaticContact CE2-CG 3.6Å; F113-H122 HydrophobicContact CZ-CB 3.37Å; F113-H122 AromaticContact CZ-CD2 3.36Å; F113-H122 WeakPolarHBondContact CZ-CD2 3.39Å; F113-H122 AromaticContact CZ-CG 3.12Å; F113-H122 AromaticContact CZ-ND1 3.63Å; F113-H122 AromaticContact CZ-NE2 3.94Å
114	S	74.1	Confident	72.7	Confident	31 Å²	31	70.2 Å²	70.2	22%	0.217	37%	0.367	C	S	.	.	S	Bend	trans	-76.4	-19.5	178.5	51.7	0	0	0	0	113.6	R96	R96-S114 PolarHBondContact NH1-O 3.16Å
115	C	73.3	Confident	72.1	Confident	22 Å²	22	71.3 Å²	71.3	15%	0.149	38%	0.377	C	S	.	.	S	Bend	trans	-135.6	139.7	-178.3	-70.8	0	0	0	0	111.7	F113 S117 N118 L119	F113-C115 VanDerWaalsContact C-N 3.33Å; C115-S117 VanDerWaalsContact C-N 3.28Å; C115-S117 PolarHBondContact O-N 2.96Å; C115-N118 PolarHBondContact O-N 3.37Å; C115-N118 VanDerWaalsContact O-N 3.1Å; C115-L119 PolarHBondContact O-N 2.85Å
116	S	73.1	Confident	71.7	Confident	65 Å²	65	67.4 Å²	67.4	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-59.4	-35	177.3	-168.7	0	0	0	0	113.4	Y104 N118 L119 H120	Y104-S116 VanDerWaalsContact CD2-N 3.32Å; S116-N118 VanDerWaalsContact C-N 3.27Å; S116-N118 PolarHBondContact O-N 2.91Å; S116-L119 PolarHBondContact O-N 3.42Å; S116-H120 PolarHBondContact O-N 2.8Å
117	S	71.8	Confident	71	Confident	78 Å²	78	75.5 Å²	75.5	55%	0.545	39%	0.391	S	S	.	.	H	α-helix	trans	-61.5	-36.1	176.5	54.8	0	0	0	0	112.4	C115 H120 Q121	C115-S117 VanDerWaalsContact C-N 3.28Å; C115-S117 PolarHBondContact O-N 2.96Å; S117-H120 PolarHBondContact O-N 2.88Å; S117-Q121 WeakPolarHBondContact O-CB 3.12Å; S117-Q121 PolarHBondContact O-N 3.18Å
118	N	69.3	Low	70.2	Confident	67 Å²	67	74.4 Å²	74.4	36%	0.358	39%	0.389	S	S	.	.	H	α-helix	trans	-76.4	-35.7	-180	-63	-3	0	0	0	111	F113 C115 S116 Q121 H122	F113-N118 HydrophobicContact CB-CB 4.3Å; F113-N118 HydrophobicContact CD1-CB 4.06Å; F113-N118 HydrophobicContact CG-CB 4.45Å; C115-N118 PolarHBondContact O-N 3.37Å; C115-N118 VanDerWaalsContact O-N 3.1Å; S116-N118 VanDerWaalsContact C-N 3.27Å; S116-N118 PolarHBondContact O-N 2.91Å; N118-Q121 PolarHBondContact O-N 3.2Å; N118-H122 VanDerWaalsContact O-CB 3.28Å; N118-H122 WeakPolarHBondContact O-CB 3.35Å; N118-H122 PolarHBondContact O-N 3.41Å
119	L	74.8	Confident	69.7	Low	19 Å²	19	74.9 Å²	74.9	10%	0.099	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-45.4	170.4	172.8	61.7	0	0	0	110.8	C106 F113 C115 S116 Q121 H122 Q123	C106-L119 HydrophobicContact CB-CD1 3.61Å; F113-L119 HydrophobicContact CB-CB 4.25Å; F113-L119 HydrophobicContact CD2-CB 3.85Å; F113-L119 HydrophobicContact CD2-CD1 3.68Å; F113-L119 HydrophobicContact CD2-CG 4.36Å; F113-L119 HydrophobicContact CE2-CD1 3.86Å; F113-L119 HydrophobicContact CG-CB 4.21Å; C115-L119 PolarHBondContact O-N 2.85Å; S116-L119 PolarHBondContact O-N 3.42Å; L119-Q121 PolarHBondContact O-N 3.39Å; L119-H122 WeakPolarHBondContact O-CB 3.46Å; L119-H122 PolarHBondContact O-N 3.31Å; L119-H122 VanDerWaalsContact O-N 3.11Å; L119-Q123 HydrophobicContact CD1-CG 4.15Å; L119-Q123 HydrophobicContact CG-CG 4.49Å; L119-Q123 WeakPolarHBondContact O-CG 3.4Å; L119-Q123 PolarHBondContact O-N 3.46Å
120	H	72.1	Confident	69.6	Low	105 Å²	105	77.9 Å²	77.9	49%	0.486	40%	0.399	S	S	.	.	H	α-helix	trans	-61.3	-44.3	177.6	-173.9	73.8	0	0	0	111.9	S116 S117 H122 Q123 Q124	S116-H120 PolarHBondContact O-N 2.8Å; S117-H120 PolarHBondContact O-N 2.88Å; H120-H122 VanDerWaalsContact C-N 3.29Å; H120-H122 PolarHBondContact O-N 3.05Å; H120-Q123 PolarHBondContact O-N 2.98Å; H120-Q124 PolarHBondContact O-N 3.19Å
121	Q	66.4	Low	69.6	Low	57 Å²	57	79.3 Å²	79.3	27%	0.266	40%	0.397	S	S	.	.	H	α-helix	trans	-61.4	-37.6	173.3	-168.9	-179.1	23.8	0	0	112.3	S117 N118 L119 Q124 C143 Y146	S117-Q121 WeakPolarHBondContact O-CB 3.12Å; S117-Q121 PolarHBondContact O-N 3.18Å; N118-Q121 PolarHBondContact O-N 3.2Å; L119-Q121 PolarHBondContact O-N 3.39Å; Q121-Q124 WeakPolarHBondContact O-CB 3.49Å; Q121-Q124 PolarHBondContact O-N 3.22Å; Q121-C143 WeakPolarHBondContact CG-SG 3.45Å; Q121-C143 PolarHBondContact NE2-SG 3.43Å; Q121-Y146 VanDerWaalsContact NE2-CE2 3.34Å; Q121-Y146 PolarHBondContact NE2-OH 3.19Å
122	H	72.1	Confident	69.9	Low	20 Å²	20	77.6 Å²	77.6	9%	0.093	39%	0.388	C	S	.	.	H	α-helix	trans	-69.4	-37.4	177.5	174	67.7	0	0	0	112.8	C109 F113 N118 L119 H120 Q124 I125 H126	C109-H122 PolarHBondContact SG-NE2 3.21Å; F113-H122 HydrophobicContact CE1-CB 3.85Å; F113-H122 HydrophobicContact CE2-CB 3.82Å; F113-H122 AromaticContact CE2-CD2 3.38Å; F113-H122 WeakPolarHBondContact CE2-CD2 3.44Å; F113-H122 AromaticContact CE2-CG 3.6Å; F113-H122 HydrophobicContact CZ-CB 3.37Å; F113-H122 AromaticContact CZ-CD2 3.36Å; F113-H122 WeakPolarHBondContact CZ-CD2 3.39Å; F113-H122 AromaticContact CZ-CG 3.12Å; F113-H122 AromaticContact CZ-ND1 3.63Å; F113-H122 AromaticContact CZ-NE2 3.94Å; N118-H122 VanDerWaalsContact O-CB 3.28Å; N118-H122 WeakPolarHBondContact O-CB 3.35Å; N118-H122 PolarHBondContact O-N 3.41Å; L119-H122 WeakPolarHBondContact O-CB 3.46Å; L119-H122 PolarHBondContact O-N 3.31Å; L119-H122 VanDerWaalsContact O-N 3.11Å; H120-H122 VanDerWaalsContact C-N 3.29Å; H120-H122 PolarHBondContact O-N 3.05Å; H122-Q124 PolarHBondContact O-N 2.93Å; H122-I125 VanDerWaalsContact O-CB 3.22Å; H122-I125 WeakPolarHBondContact O-CB 3.38Å; H122-I125 WeakPolarHBondContact O-CG1 3.29Å; H122-I125 PolarHBondContact O-N 3.32Å; H122-H126 AromaticContact CD2-NE2 3.89Å; H122-H126 AromaticContact CE1-NE2 3.9Å; H122-H126 AromaticContact NE2-CE1 3.92Å; H122-H126 AromaticContact NE2-NE2 3.24Å; H122-H126 PolarHBondContact NE2-NE2 3.1Å
123	Q	70.3	Confident	69.7	Low	67 Å²	67	82.9 Å²	82.9	31%	0.313	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-24.6	176.9	-74.1	171.2	-39.5	0	0	112.7	L119 H120 I125 H126 R127	L119-Q123 HydrophobicContact CD1-CG 4.15Å; L119-Q123 HydrophobicContact CG-CG 4.49Å; L119-Q123 WeakPolarHBondContact O-CG 3.4Å; L119-Q123 PolarHBondContact O-N 3.46Å; H120-Q123 PolarHBondContact O-N 2.98Å; Q123-I125 PolarHBondContact O-N 3.2Å; Q123-I125 VanDerWaalsContact O-N 3.17Å; Q123-H126 PolarHBondContact O-N 3.31Å; Q123-R127 PolarHBondContact O-N 3.13Å
124	Q	69.3	Low	69.9	Low	53 Å²	53	81 Å²	81	25%	0.248	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-7	170.9	-62.7	177.6	-14.6	0	0	113.6	H120 Q121 H122 S142 C143	H120-Q124 PolarHBondContact O-N 3.19Å; Q121-Q124 WeakPolarHBondContact O-CB 3.49Å; Q121-Q124 PolarHBondContact O-N 3.22Å; H122-Q124 PolarHBondContact O-N 2.93Å; Q124-S142 PolarHBondContact OE1-O 3.1Å; Q124-C143 PolarHBondContact OE1-SG 2.81Å
125	I	63.5	Low	69.9	Low	106 Å²	106	86.5 Å²	86.5	54%	0.544	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-30.4	173.5	-58	176.2	0	0	0	111	H122 Q123	H122-I125 VanDerWaalsContact O-CB 3.22Å; H122-I125 WeakPolarHBondContact O-CB 3.38Å; H122-I125 WeakPolarHBondContact O-CG1 3.29Å; H122-I125 PolarHBondContact O-N 3.32Å; Q123-I125 PolarHBondContact O-N 3.2Å; Q123-I125 VanDerWaalsContact O-N 3.17Å
126	H	64.8	Low	69.8	Low	67 Å²	67	90.7 Å²	90.7	31%	0.31	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-27.7	-179.6	-59	-52	0	0	0	112.6	C106 E108 C109 H122 Q123 E128	C106-H126 PolarHBondContact SG-NE2 3.2Å; E108-H126 WeakPolarHBondContact OE2-CB 3.43Å; E108-H126 IonicContact OE2-CD2 2.94Å; E108-H126 PolarHBondContact OE2-CD2 3.29Å; E108-H126 IonicContact OE2-CG 3.11Å; E108-H126 IonicContact OE2-NE2 2.94Å; C109-H126 PolarHBondContact SG-NE2 3.37Å; C109-H126 VanDerWaalsContact SG-NE2 3.38Å; H122-H126 AromaticContact CD2-NE2 3.89Å; H122-H126 AromaticContact CE1-NE2 3.9Å; H122-H126 AromaticContact NE2-CE1 3.92Å; H122-H126 AromaticContact NE2-NE2 3.24Å; H122-H126 PolarHBondContact NE2-NE2 3.1Å; Q123-H126 PolarHBondContact O-N 3.31Å; H126-E128 PolarHBondContact O-N 2.74Å
127	R	63.5	Low	69.8	Low	173 Å²	173	90.1 Å²	90.1	65%	0.653	44%	0.44	S	S	*	.	S	Bend	trans	-73.1	104.7	162.6	-63.3	-177.9	-178.9	173.3	-2.3	106.7	Q123 E129	Q123-R127 PolarHBondContact O-N 3.13Å; R127-E129 PolarHBondContact O-N 3.15Å
128	E	56.6	Low	69.9	Low	185 Å²	185	89.1 Å²	89.1	86%	0.864	44%	0.443	S	S	*	.			trans	-54.5	-13.9	-179.5	-63.9	-176	161.6	0	0	113.7	H126 K130	H126-E128 PolarHBondContact O-N 2.74Å; E128-K130 PolarHBondContact O-N 3.3Å; E128-K130 VanDerWaalsContact O-N 3.07Å
129	E	60.8	Low	70.1	Confident	147 Å²	147	91.8 Å²	91.8	69%	0.687	45%	0.451	S	S	*	.			trans	-61.6	102.9	167.6	-61.5	-175.1	170.2	0	0	111.5	R127 P131	R127-E129 PolarHBondContact O-N 3.15Å; E129-P131 WeakPolarHBondContact O-CD 3.38Å
130	K	70.9	Confident	70.1	Confident	118 Å²	118	92.4 Å²	92.4	51%	0.513	46%	0.459	S	S	.	.			trans	-92.9	92.1	165	-68.1	173.4	-175.9	174.3	0	108.1	E128 Y132 A140 F141	E128-K130 PolarHBondContact O-N 3.3Å; E128-K130 VanDerWaalsContact O-N 3.07Å; K130-Y132 PolarHBondContact O-N 3.12Å; K130-A140 HydrophobicContact CB-CB 3.34Å; K130-A140 HydrophobicContact CD-CB 3.85Å; K130-A140 WeakPolarHBondContact CD-O 3.46Å; K130-A140 HydrophobicContact CG-CB 4.25Å; K130-F141 CarbonylContact C-O 3.54Å
131	P	73	Confident	70.2	Confident	85 Å²	85	89.4 Å²	89.4	55%	0.552	44%	0.444	S	S	*	.			trans	-73.1	-17.6	-163.7	-16.2	34	0	0	0	112.4	E129	E129-P131 WeakPolarHBondContact O-CD 3.38Å
132	Y	74.3	Confident	70.6	Confident	92 Å²	92	87.8 Å²	87.8	36%	0.361	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	93.2	-174.4	-55.5	-76	0	0	0	110	K130 A140 F141 C143 S144	K130-Y132 PolarHBondContact O-N 3.12Å; Y132-A140 CarbonylContact O-C 3.57Å; Y132-A140 WeakPolarHBondContact O-CA 3.17Å; Y132-F141 PolarHBondContact N-O 3.49Å; Y132-F141 PolarHBondContact O-N 3.03Å; Y132-C143 VanDerWaalsContact CD2-CA 3.48Å; Y132-S144 VanDerWaalsContact CD2-N 3.3Å
133	K	73.8	Confident	70.6	Confident	142 Å²	142	87.3 Å²	87.3	62%	0.617	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	143.8	177.6	-62.6	-177.1	-178.4	177.1	0	111.1	A140 L147	K133-A140 HydrophobicContact CG-CB 3.88Å; K133-L147 WeakPolarHBondContact O-CD2 3.39Å
134	C	79.7	Confident	70.8	Confident	1 Å²	1	87.4 Å²	87.4	1%	0.007	45%	0.446	C	S	.	.			trans	-90	119.1	172.2	-175.7	0	0	0	0	109.4	D136 C137 G138 K139 F141 L147 H154	C134-D136 VanDerWaalsContact C-N 3.32Å; C134-D136 PolarHBondContact O-N 3.28Å; C134-C137 PolarHBondContact O-N 2.8Å; C134-C137 VanDerWaalsContact SG-SG 3.69Å; C134-G138 VanDerWaalsContact O-CA 3.28Å; C134-G138 WeakPolarHBondContact O-CA 3.41Å; C134-G138 PolarHBondContact O-N 2.81Å; C134-K139 WeakPolarHBondContact CB-O 3.42Å; C134-K139 PolarHBondContact N-O 3.47Å; C134-F141 HydrophobicContact CB-CE2 4.29Å; C134-L147 HydrophobicContact CB-CD1 3.54Å; C134-H154 PolarHBondContact SG-CD2 3.07Å; C134-H154 PolarHBondContact SG-NE2 3.1Å; C134-H154 VanDerWaalsContact SG-NE2 3.42Å
135	D	75.1	Confident	71	Confident	148 Å²	148	87.6 Å²	87.6	79%	0.791	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-36.1	-177.2	-55.8	-38.2	0	0	0	112	C137	D135-C137 PolarHBondContact O-N 3.26Å
136	D	71.2	Confident	71.5	Confident	110 Å²	110	87.3 Å²	87.3	59%	0.588	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.8	-178	-56.4	-35.6	0	0	0	115.2	C134 H154	C134-D136 VanDerWaalsContact C-N 3.32Å; C134-D136 PolarHBondContact O-N 3.28Å; D136-H154 HydrophobicContact CB-CB 4.27Å; D136-H154 WeakPolarHBondContact OD2-CB 3.29Å; D136-H154 IonicContact OD2-CD2 3.61Å; D136-H154 PolarHBondContact OD2-CD2 3.43Å; D136-H154 IonicContact OD2-CG 3.97Å
137	C	73.6	Confident	72.1	Confident	52 Å²	52	85 Å²	85	35%	0.351	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.7	6.5	-173.1	73.4	0	0	0	0	115.2	C134 D135 K139 H150 H154	C134-C137 PolarHBondContact O-N 2.8Å; C134-C137 VanDerWaalsContact SG-SG 3.69Å; D135-C137 PolarHBondContact O-N 3.26Å; C137-K139 PolarHBondContact O-N 2.85Å; C137-H150 PolarHBondContact SG-NE2 2.77Å; C137-H154 PolarHBondContact SG-NE2 3.43Å
138	G	72.3	Confident	72.7	Confident	58 Å²	58	83 Å²	83	60%	0.598	43%	0.429	S	S	*	.			trans	67	-0.9	179.5	0	0	0	0	0	115.6	C134 A140	C134-G138 VanDerWaalsContact O-CA 3.28Å; C134-G138 WeakPolarHBondContact O-CA 3.41Å; C134-G138 PolarHBondContact O-N 2.81Å; G138-A140 PolarHBondContact O-N 3.07Å
139	K	73.2	Confident	73.5	Confident	123 Å²	123	79 Å²	79	54%	0.535	41%	0.41	S	S	.	.			trans	-69.7	130.4	-178.4	-73.2	-177.9	-179.4	175.9	0	111.1	C134 C137 F141	C134-K139 WeakPolarHBondContact CB-O 3.42Å; C134-K139 PolarHBondContact N-O 3.47Å; C137-K139 PolarHBondContact O-N 2.85Å; K139-F141 HydrophobicContact CB-CE2 3.95Å; K139-F141 HydrophobicContact CB-CZ 3.99Å; K139-F141 VanDerWaalsContact O-CE2 3.32Å; K139-F141 WeakPolarHBondContact O-CE2 3.47Å
140	A	76.1	Confident	74.3	Confident	31 Å²	31	73 Å²	73	26%	0.256	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	144.7	-179.5	0	0	0	0	0	111.8	K130 Y132 K133 G138	K130-A140 HydrophobicContact CB-CB 3.34Å; K130-A140 HydrophobicContact CD-CB 3.85Å; K130-A140 WeakPolarHBondContact CD-O 3.46Å; K130-A140 HydrophobicContact CG-CB 4.25Å; Y132-A140 CarbonylContact O-C 3.57Å; Y132-A140 WeakPolarHBondContact O-CA 3.17Å; K133-A140 HydrophobicContact CG-CB 3.88Å; G138-A140 PolarHBondContact O-N 3.07Å
141	F	74.9	Confident	74.5	Confident	42 Å²	42	70.3 Å²	70.3	18%	0.184	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.1	-177.4	-58.6	-87.3	0	0	0	110.6	K130 Y132 C134 K139 C143 L147 H150	K130-F141 CarbonylContact C-O 3.54Å; Y132-F141 PolarHBondContact N-O 3.49Å; Y132-F141 PolarHBondContact O-N 3.03Å; C134-F141 HydrophobicContact CB-CE2 4.29Å; K139-F141 HydrophobicContact CB-CE2 3.95Å; K139-F141 HydrophobicContact CB-CZ 3.99Å; K139-F141 VanDerWaalsContact O-CE2 3.32Å; K139-F141 WeakPolarHBondContact O-CE2 3.47Å; F141-C143 VanDerWaalsContact C-N 3.27Å; F141-C143 PolarHBondContact O-N 3.34Å; F141-L147 HydrophobicContact CB-CB 4.3Å; F141-L147 HydrophobicContact CD2-CB 3.81Å; F141-L147 HydrophobicContact CD2-CD1 3.67Å; F141-L147 HydrophobicContact CD2-CG 4.34Å; F141-L147 HydrophobicContact CE2-CD1 3.82Å; F141-L147 HydrophobicContact CG-CB 4.23Å; F141-H150 HydrophobicContact CE1-CB 3.92Å; F141-H150 HydrophobicContact CE2-CB 3.83Å; F141-H150 AromaticContact CE2-CD2 3.43Å; F141-H150 VanDerWaalsContact CE2-CD2 3.43Å; F141-H150 WeakPolarHBondContact CE2-CD2 3.16Å; F141-H150 AromaticContact CE2-CG 3.61Å; F141-H150 HydrophobicContact CZ-CB 3.41Å; F141-H150 VanDerWaalsContact CZ-CB 3.41Å; F141-H150 AromaticContact CZ-CD2 3.41Å; F141-H150 VanDerWaalsContact CZ-CD2 3.41Å; F141-H150 WeakPolarHBondContact CZ-CD2 3.2Å; F141-H150 AromaticContact CZ-CG 3.14Å; F141-H150 AromaticContact CZ-ND1 3.58Å; F141-H150 AromaticContact CZ-NE2 3.94Å
142	S	73.3	Confident	74.8	Confident	23 Å²	23	67.8 Å²	67.8	16%	0.161	35%	0.35	C	S	.	.	S	Bend	trans	-72.3	-21.1	175.8	53.9	0	0	0	0	112.8	Q124	Q124-S142 PolarHBondContact OE1-O 3.1Å
143	C	73.5	Confident	74.7	Confident	11 Å²	11	68.3 Å²	68.3	7%	0.074	36%	0.358	C	S	.	.	S	Bend	trans	-138.9	144.4	-178.9	-50.9	0	0	0	0	112.7	Q121 Q124 Y132 F141 S145 Y146 L147	Q121-C143 WeakPolarHBondContact CG-SG 3.45Å; Q121-C143 PolarHBondContact NE2-SG 3.43Å; Q124-C143 PolarHBondContact OE1-SG 2.81Å; Y132-C143 VanDerWaalsContact CD2-CA 3.48Å; F141-C143 VanDerWaalsContact C-N 3.27Å; F141-C143 PolarHBondContact O-N 3.34Å; C143-S145 VanDerWaalsContact C-N 3.28Å; C143-S145 PolarHBondContact O-N 3.13Å; C143-Y146 HydrophobicContact CB-CD2 3.72Å; C143-Y146 HydrophobicContact CB-CE2 4.16Å; C143-Y146 HydrophobicContact CB-CG 4.45Å; C143-Y146 PolarHBondContact O-N 3.5Å; C143-Y146 VanDerWaalsContact O-N 3.07Å; C143-L147 PolarHBondContact O-N 2.86Å
144	S	73.4	Confident	74.7	Confident	68 Å²	68	65.1 Å²	65.1	48%	0.476	35%	0.345	S	S	.	.	H	α-helix	trans	-58	-36.8	177.2	59.3	0	0	0	0	113.3	Y132 Y146 L147 Y148	Y132-S144 VanDerWaalsContact CD2-N 3.3Å; S144-Y146 VanDerWaalsContact C-N 3.28Å; S144-Y146 PolarHBondContact O-N 3Å; S144-L147 PolarHBondContact O-N 3.2Å; S144-Y148 WeakPolarHBondContact O-CB 3.45Å; S144-Y148 PolarHBondContact O-N 3.32Å
145	S	73.8	Confident	74.2	Confident	57 Å²	57	69.2 Å²	69.2	40%	0.399	37%	0.37	S	S	.	.	H	α-helix	trans	-65.9	-28.6	178	61.5	0	0	0	0	113.3	C143 K149	C143-S145 VanDerWaalsContact C-N 3.28Å; C143-S145 PolarHBondContact O-N 3.13Å; S145-K149 WeakPolarHBondContact O-CG 3.45Å; S145-K149 PolarHBondContact O-N 3.19Å
146	Y	74.3	Confident	74.1	Confident	100 Å²	100	64.4 Å²	64.4	39%	0.392	36%	0.356	S	S	.	.	H	α-helix	trans	-78.6	-40.2	173.7	-63.9	-43.1	0	0	0	111.7	Q121 C143 S144 K149 H150	Q121-Y146 VanDerWaalsContact NE2-CE2 3.34Å; Q121-Y146 PolarHBondContact NE2-OH 3.19Å; C143-Y146 HydrophobicContact CB-CD2 3.72Å; C143-Y146 HydrophobicContact CB-CE2 4.16Å; C143-Y146 HydrophobicContact CB-CG 4.45Å; C143-Y146 PolarHBondContact O-N 3.5Å; C143-Y146 VanDerWaalsContact O-N 3.07Å; S144-Y146 VanDerWaalsContact C-N 3.28Å; S144-Y146 PolarHBondContact O-N 3Å; Y146-K149 PolarHBondContact O-N 3.39Å; Y146-H150 WeakPolarHBondContact O-CB 3.49Å; Y146-H150 PolarHBondContact O-N 3.05Å
147	L	76.1	Confident	74.1	Confident	20 Å²	20	64.5 Å²	64.5	11%	0.105	35%	0.354	C	S	.	.	H	α-helix	trans	-58.1	-47.6	171.6	173.2	62.1	0	0	0	111	K133 C134 F141 C143 S144 K149 H150 Q151	K133-L147 WeakPolarHBondContact O-CD2 3.39Å; C134-L147 HydrophobicContact CB-CD1 3.54Å; F141-L147 HydrophobicContact CB-CB 4.3Å; F141-L147 HydrophobicContact CD2-CB 3.81Å; F141-L147 HydrophobicContact CD2-CD1 3.67Å; F141-L147 HydrophobicContact CD2-CG 4.34Å; F141-L147 HydrophobicContact CE2-CD1 3.82Å; F141-L147 HydrophobicContact CG-CB 4.23Å; C143-L147 PolarHBondContact O-N 2.86Å; S144-L147 PolarHBondContact O-N 3.2Å; L147-K149 VanDerWaalsContact C-N 3.34Å; L147-K149 PolarHBondContact O-N 3.41Å; L147-H150 CarbonylContact O-C 3.41Å; L147-H150 WeakPolarHBondContact O-CA 3.33Å; L147-H150 WeakPolarHBondContact O-CB 3.27Å; L147-H150 PolarHBondContact O-N 3.06Å; L147-Q151 HydrophobicContact CD1-CG 4.07Å; L147-Q151 HydrophobicContact CG-CG 4.39Å; L147-Q151 WeakPolarHBondContact O-CG 3.44Å; L147-Q151 PolarHBondContact O-N 3.28Å
148	Y	76.4	Confident	74.3	Confident	129 Å²	129	67.7 Å²	67.7	51%	0.506	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-40.8	178.3	176.9	-105.8	0	0	0	112.6	S144 H150 R152	S144-Y148 WeakPolarHBondContact O-CB 3.45Å; S144-Y148 PolarHBondContact O-N 3.32Å; Y148-H150 VanDerWaalsContact C-N 3.31Å; Y148-H150 PolarHBondContact O-N 2.82Å; Y148-R152 VanDerWaalsContact CE1-NH2 3.26Å; Y148-R152 PolarHBondContact OH-NH2 3.4Å
149	K	74.6	Confident	74.6	Confident	103 Å²	103	68.3 Å²	68.3	45%	0.448	36%	0.355	S	S	.	.	H	α-helix	trans	-64.9	-36.1	172.7	-74.9	176.3	-175.3	176.5	0	112.1	S145 Y146 L147 R152	S145-K149 WeakPolarHBondContact O-CG 3.45Å; S145-K149 PolarHBondContact O-N 3.19Å; Y146-K149 PolarHBondContact O-N 3.39Å; L147-K149 VanDerWaalsContact C-N 3.34Å; L147-K149 PolarHBondContact O-N 3.41Å; K149-R152 WeakPolarHBondContact O-CB 3.47Å
150	H	77.2	Confident	74.9	Confident	21 Å²	21	66.3 Å²	66.3	10%	0.097	35%	0.345	C	S	.	.	H	α-helix	trans	-69.7	-42.1	178.1	173	72.7	0	0	0	112.5	C137 F141 Y146 L147 Y148 R152 I153 H154	C137-H150 PolarHBondContact SG-NE2 2.77Å; F141-H150 HydrophobicContact CE1-CB 3.92Å; F141-H150 HydrophobicContact CE2-CB 3.83Å; F141-H150 AromaticContact CE2-CD2 3.43Å; F141-H150 VanDerWaalsContact CE2-CD2 3.43Å; F141-H150 WeakPolarHBondContact CE2-CD2 3.16Å; F141-H150 AromaticContact CE2-CG 3.61Å; F141-H150 HydrophobicContact CZ-CB 3.41Å; F141-H150 VanDerWaalsContact CZ-CB 3.41Å; F141-H150 AromaticContact CZ-CD2 3.41Å; F141-H150 VanDerWaalsContact CZ-CD2 3.41Å; F141-H150 WeakPolarHBondContact CZ-CD2 3.2Å; F141-H150 AromaticContact CZ-CG 3.14Å; F141-H150 AromaticContact CZ-ND1 3.58Å; F141-H150 AromaticContact CZ-NE2 3.94Å; Y146-H150 WeakPolarHBondContact O-CB 3.49Å; Y146-H150 PolarHBondContact O-N 3.05Å; L147-H150 CarbonylContact O-C 3.41Å; L147-H150 WeakPolarHBondContact O-CA 3.33Å; L147-H150 WeakPolarHBondContact O-CB 3.27Å; L147-H150 PolarHBondContact O-N 3.06Å; Y148-H150 VanDerWaalsContact C-N 3.31Å; Y148-H150 PolarHBondContact O-N 2.82Å; H150-R152 PolarHBondContact O-N 3.32Å; H150-R152 VanDerWaalsContact O-N 3.11Å; H150-I153 WeakPolarHBondContact O-CB 3.42Å; H150-I153 VanDerWaalsContact O-CG1 3.3Å; H150-I153 WeakPolarHBondContact O-CG1 3.34Å; H150-I153 PolarHBondContact O-N 3.2Å; H150-H154 AromaticContact CD2-NE2 3.89Å; H150-H154 AromaticContact CE1-NE2 3.84Å; H150-H154 AromaticContact NE2-CE1 4Å; H150-H154 AromaticContact NE2-NE2 3.17Å; H150-H154 PolarHBondContact NE2-NE2 3.12Å; H150-H154 VanDerWaalsContact NE2-NE2 3.17Å
151	Q	74.7	Confident	75	Confident	61 Å²	61	71.9 Å²	71.9	29%	0.285	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-24.5	177.6	-75.7	172.6	-35.7	0	0	113.1	L147 I153 H154 T155	L147-Q151 HydrophobicContact CD1-CG 4.07Å; L147-Q151 HydrophobicContact CG-CG 4.39Å; L147-Q151 WeakPolarHBondContact O-CG 3.44Å; L147-Q151 PolarHBondContact O-N 3.28Å; Q151-I153 PolarHBondContact O-N 3.47Å; Q151-I153 VanDerWaalsContact O-N 3.15Å; Q151-H154 PolarHBondContact O-N 3.47Å; Q151-H154 VanDerWaalsContact O-N 3.12Å; Q151-T155 PolarHBondContact O-N 2.94Å; Q151-T155 VanDerWaalsContact O-N 3.1Å; Q151-T155 PolarHBondContact O-OG1 3.29Å
152	R	79.9	Confident	75.5	Confident	31 Å²	31	70 Å²	70	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-61	-19.3	171.7	-65	177	177.4	-167.4	-7.9	113.8	Y148 K149 H150 T155 G156 M157 N170	Y148-R152 VanDerWaalsContact CE1-NH2 3.26Å; Y148-R152 PolarHBondContact OH-NH2 3.4Å; K149-R152 WeakPolarHBondContact O-CB 3.47Å; H150-R152 PolarHBondContact O-N 3.32Å; H150-R152 VanDerWaalsContact O-N 3.11Å; R152-T155 WeakPolarHBondContact CA-OG1 3.42Å; R152-G156 CarbonylContact O-C 3.54Å; R152-G156 PolarHBondContact O-N 2.91Å; R152-M157 HydrophobicContact CB-CB 4.33Å; R152-M157 HydrophobicContact CG-CB 4.27Å; R152-M157 PolarHBondContact O-N 3.14Å; R152-N170 HydrophobicContact CB-CB 4.5Å; R152-N170 PolarHBondContact NH1-O 3.08Å; R152-N170 VanDerWaalsContact NH1-O 3.12Å
153	I	72.3	Confident	75.9	Confident	103 Å²	103	78.7 Å²	78.7	53%	0.528	39%	0.39	S	S	.	.	H	α-helix	trans	-72.4	-42.3	175.6	-59.9	173.7	0	0	0	110	H150 Q151	H150-I153 WeakPolarHBondContact O-CB 3.42Å; H150-I153 VanDerWaalsContact O-CG1 3.3Å; H150-I153 WeakPolarHBondContact O-CG1 3.34Å; H150-I153 PolarHBondContact O-N 3.2Å; Q151-I153 PolarHBondContact O-N 3.47Å; Q151-I153 VanDerWaalsContact O-N 3.15Å
154	H	72.3	Confident	76.1	Confident	75 Å²	75	84.2 Å²	84.2	35%	0.347	42%	0.415	S	S	.	.	H	α-helix	trans	-76.1	-41.6	-178.4	-56	-48.8	0	0	0	111.9	C134 D136 C137 H150 Q151 G156	C134-H154 PolarHBondContact SG-CD2 3.07Å; C134-H154 PolarHBondContact SG-NE2 3.1Å; C134-H154 VanDerWaalsContact SG-NE2 3.42Å; D136-H154 HydrophobicContact CB-CB 4.27Å; D136-H154 WeakPolarHBondContact OD2-CB 3.29Å; D136-H154 IonicContact OD2-CD2 3.61Å; D136-H154 PolarHBondContact OD2-CD2 3.43Å; D136-H154 IonicContact OD2-CG 3.97Å; C137-H154 PolarHBondContact SG-NE2 3.43Å; H150-H154 AromaticContact CD2-NE2 3.89Å; H150-H154 AromaticContact CE1-NE2 3.84Å; H150-H154 AromaticContact NE2-CE1 4Å; H150-H154 AromaticContact NE2-NE2 3.17Å; H150-H154 PolarHBondContact NE2-NE2 3.12Å; H150-H154 VanDerWaalsContact NE2-NE2 3.17Å; Q151-H154 PolarHBondContact O-N 3.47Å; Q151-H154 VanDerWaalsContact O-N 3.12Å; H154-G156 PolarHBondContact O-N 3.12Å
155	T	70.7	Confident	76.5	Confident	87 Å²	87	83.5 Å²	83.5	53%	0.534	41%	0.409	S	S	.	.	S	Bend	trans	-76.7	-5.9	177.7	58.5	0	0	0	0	113.6	Q151 R152 M157	Q151-T155 PolarHBondContact O-N 2.94Å; Q151-T155 VanDerWaalsContact O-N 3.1Å; Q151-T155 PolarHBondContact O-OG1 3.29Å; R152-T155 WeakPolarHBondContact CA-OG1 3.42Å; T155-M157 PolarHBondContact O-N 2.84Å; T155-M157 WeakPolarHBondContact OG1-CG 3.41Å
156	G	71.8	Confident	76.8	Confident	47 Å²	47	83.4 Å²	83.4	49%	0.485	42%	0.417	S	S	.	.			trans	63.6	7.3	-174.5	0	0	0	0	0	114.4	R152 H154 K158	R152-G156 CarbonylContact O-C 3.54Å; R152-G156 PolarHBondContact O-N 2.91Å; H154-G156 PolarHBondContact O-N 3.12Å; G156-K158 PolarHBondContact O-N 2.98Å; G156-K158 VanDerWaalsContact O-N 3.16Å
157	M	71.2	Confident	77	Confident	112 Å²	112	84.8 Å²	84.8	55%	0.552	43%	0.425	S	S	*	.			trans	-61.5	117.5	-177.7	-80.7	-168.4	149.7	0	0	111	R152 T155 P159	R152-M157 HydrophobicContact CB-CB 4.33Å; R152-M157 HydrophobicContact CG-CB 4.27Å; R152-M157 PolarHBondContact O-N 3.14Å; T155-M157 PolarHBondContact O-N 2.84Å; T155-M157 WeakPolarHBondContact OG1-CG 3.41Å; M157-P159 WeakPolarHBondContact O-CD 3.44Å
158	K	79.4	Confident	77.3	Confident	120 Å²	120	85.1 Å²	85.1	52%	0.522	43%	0.431	S	S	.	.			trans	-122.2	77.5	178	-71.8	166.4	173.8	-175.4	0	110.3	G156 Y160 A168 F169	G156-K158 PolarHBondContact O-N 2.98Å; G156-K158 VanDerWaalsContact O-N 3.16Å; K158-Y160 PolarHBondContact O-N 3.48Å; K158-A168 HydrophobicContact CB-CB 3.46Å; K158-A168 VanDerWaalsContact CB-CB 3.46Å; K158-A168 HydrophobicContact CD-CB 4.07Å; K158-A168 WeakPolarHBondContact CD-O 3.41Å; K158-A168 HydrophobicContact CG-CB 4.35Å; K158-F169 CarbonylContact C-O 3.26Å; K158-F169 VanDerWaalsContact CA-O 3.25Å; K158-F169 WeakPolarHBondContact CA-O 3.38Å
159	P	78.1	Confident	77.5	Confident	70 Å²	70	81 Å²	81	46%	0.455	42%	0.416	S	S	.	.			trans	-66.7	-20.2	-171.6	-20.9	34.4	0	0	0	113.9	M157	M157-P159 WeakPolarHBondContact O-CD 3.44Å
160	Y	79.7	Confident	77.5	Confident	82 Å²	82	78.3 Å²	78.3	32%	0.322	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	98.7	-172.3	-55.4	-77.6	0	0	0	109.9	K158 A168 F169 N170	K158-Y160 PolarHBondContact O-N 3.48Å; Y160-A168 CarbonylContact O-C 3.56Å; Y160-A168 WeakPolarHBondContact O-CA 3.22Å; Y160-F169 PolarHBondContact N-O 2.94Å; Y160-F169 VanDerWaalsContact N-O 3.1Å; Y160-F169 PolarHBondContact O-N 3.12Å; Y160-N170 WeakPolarHBondContact CE2-O 3.29Å
161	K	78.5	Confident	77.5	Confident	148 Å²	148	79 Å²	79	64%	0.643	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.3	179.6	-65.9	-178.4	-179.7	179.5	0	111.4	A168	K161-A168 HydrophobicContact CG-CB 3.82Å
162	C	84.2	Confident	77.7	Confident	2 Å²	2	79 Å²	79	1%	0.014	42%	0.42	C	S	.	.			trans	-72	124.9	168.8	-179.1	0	0	0	0	109.1	E164 C165 G166 K167 F169 L175 H182	C162-E164 VanDerWaalsContact C-N 3.3Å; C162-E164 PolarHBondContact O-N 3Å; C162-C165 VanDerWaalsContact SG-SG 3.63Å; C162-G166 WeakPolarHBondContact O-CA 3.34Å; C162-G166 PolarHBondContact O-N 3.27Å; C162-K167 WeakPolarHBondContact CB-O 3.35Å; C162-K167 PolarHBondContact N-O 3.42Å; C162-F169 HydrophobicContact CB-CE2 4.39Å; C162-L175 HydrophobicContact CB-CD1 3.64Å; C162-H182 PolarHBondContact SG-NE2 3.15Å
163	K	81	Confident	77.6	Confident	205 Å²	205	79.5 Å²	79.5	89%	0.891	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-27	-179.7	-63.4	-172.8	177.9	-176.5	0	112.9
164	E	78.8	Confident	77.9	Confident	128 Å²	128	78 Å²	78	60%	0.598	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-37	-174.1	-66.7	168.3	165.3	0	0	113.3	C162 H182	C162-E164 VanDerWaalsContact C-N 3.3Å; C162-E164 PolarHBondContact O-N 3Å; E164-H182 WeakPolarHBondContact OE2-CB 3.35Å; E164-H182 IonicContact OE2-CD2 3.6Å; E164-H182 PolarHBondContact OE2-CD2 3.02Å; E164-H182 IonicContact OE2-CG 3.12Å; E164-H182 IonicContact OE2-NE2 3.43Å
165	C	82.3	Confident	78.4	Confident	52 Å²	52	75.4 Å²	75.4	35%	0.351	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	4.8	-176.7	75.2	0	0	0	0	114.2	C162 K167 H178 H182	C162-C165 VanDerWaalsContact SG-SG 3.63Å; C165-K167 PolarHBondContact O-N 3.38Å; C165-K167 VanDerWaalsContact SG-CB 3.6Å; C165-H178 PolarHBondContact SG-NE2 3.13Å; C165-H182 PolarHBondContact SG-NE2 3.02Å; C165-H182 VanDerWaalsContact SG-NE2 3.43Å
166	G	79.4	Confident	78.9	Confident	55 Å²	55	75.2 Å²	75.2	57%	0.567	41%	0.407	S	S	*	.			trans	69.7	-5.2	179.9	0	0	0	0	0	115.6	C162 A168	C162-G166 WeakPolarHBondContact O-CA 3.34Å; C162-G166 PolarHBondContact O-N 3.27Å; G166-A168 PolarHBondContact O-N 3.09Å
167	K	79.3	Confident	79.2	Confident	129 Å²	129	77.1 Å²	77.1	56%	0.561	40%	0.4	S	S	*	.			trans	-64.8	133.7	-177.8	-74	-178.8	179.2	174.2	0	111.6	C162 C165 F169	C162-K167 WeakPolarHBondContact CB-O 3.35Å; C162-K167 PolarHBondContact N-O 3.42Å; C165-K167 PolarHBondContact O-N 3.38Å; C165-K167 VanDerWaalsContact SG-CB 3.6Å; K167-F169 HydrophobicContact CB-CE2 3.99Å; K167-F169 HydrophobicContact CB-CZ 4.1Å; K167-F169 WeakPolarHBondContact O-CE2 3.47Å
168	A	82	Confident	79.7	Confident	28 Å²	28	72.7 Å²	72.7	23%	0.231	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142.5	-176.3	0	0	0	0	0	112.4	K158 Y160 K161 G166	K158-A168 HydrophobicContact CB-CB 3.46Å; K158-A168 VanDerWaalsContact CB-CB 3.46Å; K158-A168 HydrophobicContact CD-CB 4.07Å; K158-A168 WeakPolarHBondContact CD-O 3.41Å; K158-A168 HydrophobicContact CG-CB 4.35Å; Y160-A168 CarbonylContact O-C 3.56Å; Y160-A168 WeakPolarHBondContact O-CA 3.22Å; K161-A168 HydrophobicContact CG-CB 3.82Å; G166-A168 PolarHBondContact O-N 3.09Å
169	F	79.3	Confident	79.7	Confident	41 Å²	41	70.4 Å²	70.4	18%	0.18	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150	-177	-58.2	-88.6	0	0	0	111.5	K158 Y160 C162 K167 N174 L175 H178	K158-F169 CarbonylContact C-O 3.26Å; K158-F169 VanDerWaalsContact CA-O 3.25Å; K158-F169 WeakPolarHBondContact CA-O 3.38Å; Y160-F169 PolarHBondContact N-O 2.94Å; Y160-F169 VanDerWaalsContact N-O 3.1Å; Y160-F169 PolarHBondContact O-N 3.12Å; C162-F169 HydrophobicContact CB-CE2 4.39Å; K167-F169 HydrophobicContact CB-CE2 3.99Å; K167-F169 HydrophobicContact CB-CZ 4.1Å; K167-F169 WeakPolarHBondContact O-CE2 3.47Å; F169-N174 HydrophobicContact CB-CB 4.23Å; F169-N174 HydrophobicContact CD1-CB 3.95Å; F169-N174 HydrophobicContact CG-CB 4.35Å; F169-L175 HydrophobicContact CB-CB 4.29Å; F169-L175 HydrophobicContact CD2-CB 3.87Å; F169-L175 HydrophobicContact CD2-CD1 3.7Å; F169-L175 HydrophobicContact CD2-CG 4.38Å; F169-L175 HydrophobicContact CE2-CD1 3.87Å; F169-L175 HydrophobicContact CG-CB 4.23Å; F169-H178 HydrophobicContact CE1-CB 3.87Å; F169-H178 HydrophobicContact CE2-CB 3.78Å; F169-H178 AromaticContact CE2-CD2 3.42Å; F169-H178 VanDerWaalsContact CE2-CD2 3.42Å; F169-H178 WeakPolarHBondContact CE2-CD2 3.22Å; F169-H178 AromaticContact CE2-CG 3.58Å; F169-H178 HydrophobicContact CZ-CB 3.34Å; F169-H178 AromaticContact CZ-CD2 3.44Å; F169-H178 VanDerWaalsContact CZ-CD2 3.44Å; F169-H178 WeakPolarHBondContact CZ-CD2 3.43Å; F169-H178 AromaticContact CZ-CG 3.13Å; F169-H178 AromaticContact CZ-ND1 3.64Å
170	N	75.8	Confident	79.9	Confident	47 Å²	47	69.3 Å²	69.3	25%	0.251	36%	0.356	S	S	.	.	S	Bend	trans	-78	-22.2	179	58.9	6.1	0	0	0	113.6	R152 Y160 N174	R152-N170 HydrophobicContact CB-CB 4.5Å; R152-N170 PolarHBondContact NH1-O 3.08Å; R152-N170 VanDerWaalsContact NH1-O 3.12Å; Y160-N170 WeakPolarHBondContact CE2-O 3.29Å; N170-N174 PolarHBondContact OD1-ND2 2.81Å
171	C	77.1	Confident	79.8	Confident	37 Å²	37	70.8 Å²	70.8	25%	0.25	37%	0.369	C	S	.	.	S	Bend	trans	-134.2	142.3	-176.3	-70.5	0	0	0	0	110.7	A173 N174 L175	C171-A173 PolarHBondContact O-N 2.9Å; C171-N174 PolarHBondContact O-N 3.46Å; C171-L175 PolarHBondContact O-N 3.39Å
172	S	78.8	Confident	79.9	Confident	59 Å²	59	67.4 Å²	67.4	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-39.5	178.9	55.5	0	0	0	0	113	N174 L175 I176	S172-N174 VanDerWaalsContact C-N 3.27Å; S172-N174 PolarHBondContact O-N 3.43Å; S172-L175 WeakPolarHBondContact O-CB 3.4Å; S172-L175 PolarHBondContact O-N 3.18Å; S172-L175 VanDerWaalsContact O-N 3.12Å; S172-I176 WeakPolarHBondContact O-CG1 3.46Å; S172-I176 PolarHBondContact O-N 3.04Å
173	A	76.9	Confident	79.6	Confident	43 Å²	43	71 Å²	71	36%	0.355	38%	0.377	S	S	.	.	H	α-helix	trans	-58.6	-38.8	177.1	0	0	0	0	0	112.5	C171 I176 Y177	C171-A173 PolarHBondContact O-N 2.9Å; A173-I176 PolarHBondContact O-N 3.12Å; A173-Y177 HydrophobicContact CB-CE2 4.34Å; A173-Y177 WeakPolarHBondContact O-CD2 3.44Å; A173-Y177 PolarHBondContact O-N 3.49Å
174	N	79.9	Confident	79.5	Confident	70 Å²	70	63.5 Å²	63.5	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-68.4	-36.3	177.6	-68.3	-18.7	0	0	0	111.8	F169 N170 C171 S172 H178	F169-N174 HydrophobicContact CB-CB 4.23Å; F169-N174 HydrophobicContact CD1-CB 3.95Å; F169-N174 HydrophobicContact CG-CB 4.35Å; N170-N174 PolarHBondContact OD1-ND2 2.81Å; C171-N174 PolarHBondContact O-N 3.46Å; S172-N174 VanDerWaalsContact C-N 3.27Å; S172-N174 PolarHBondContact O-N 3.43Å; N174-H178 VanDerWaalsContact O-CB 3.32Å; N174-H178 WeakPolarHBondContact O-CB 3.29Å; N174-H178 PolarHBondContact O-N 2.86Å
175	L	81.6	Confident	79.5	Confident	21 Å²	21	62.8 Å²	62.8	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-63.7	-44.2	172.2	173.3	62.1	0	0	0	111.1	C162 F169 C171 S172 Y177 H178 Q179	C162-L175 HydrophobicContact CB-CD1 3.64Å; F169-L175 HydrophobicContact CB-CB 4.29Å; F169-L175 HydrophobicContact CD2-CB 3.87Å; F169-L175 HydrophobicContact CD2-CD1 3.7Å; F169-L175 HydrophobicContact CD2-CG 4.38Å; F169-L175 HydrophobicContact CE2-CD1 3.87Å; F169-L175 HydrophobicContact CG-CB 4.23Å; C171-L175 PolarHBondContact O-N 3.39Å; S172-L175 WeakPolarHBondContact O-CB 3.4Å; S172-L175 PolarHBondContact O-N 3.18Å; S172-L175 VanDerWaalsContact O-N 3.12Å; L175-Y177 PolarHBondContact O-N 3.35Å; L175-H178 CarbonylContact O-C 3.52Å; L175-H178 WeakPolarHBondContact O-CB 3.39Å; L175-H178 PolarHBondContact O-N 2.94Å; L175-H178 VanDerWaalsContact O-N 3.13Å; L175-Q179 HydrophobicContact CD1-CG 4.08Å; L175-Q179 HydrophobicContact CG-CG 4.41Å; L175-Q179 WeakPolarHBondContact O-CG 3.5Å; L175-Q179 PolarHBondContact O-N 3.05Å
176	I	81	Confident	79.5	Confident	83 Å²	83	65.6 Å²	65.6	43%	0.426	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-45.8	177.6	-66.8	167.8	0	0	0	110.8	S172 A173 H178 Q179 R180	S172-I176 WeakPolarHBondContact O-CG1 3.46Å; S172-I176 PolarHBondContact O-N 3.04Å; A173-I176 PolarHBondContact O-N 3.12Å; I176-H178 VanDerWaalsContact C-N 3.27Å; I176-H178 PolarHBondContact O-N 3.2Å; I176-Q179 PolarHBondContact O-N 3.17Å; I176-R180 PolarHBondContact O-N 3.1Å
177	Y	78.8	Confident	79.6	Confident	87 Å²	87	66.3 Å²	66.3	34%	0.341	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-35.3	175.4	-62.9	-42.7	0	0	0	112.7	A173 L175 I199	A173-Y177 HydrophobicContact CB-CE2 4.34Å; A173-Y177 WeakPolarHBondContact O-CD2 3.44Å; A173-Y177 PolarHBondContact O-N 3.49Å; L175-Y177 PolarHBondContact O-N 3.35Å; Y177-I199 HydrophobicContact CD1-CG1 4.09Å; Y177-I199 HydrophobicContact CG-CD1 4.41Å; Y177-I199 HydrophobicContact CG-CG1 4.17Å
178	H	81.1	Confident	79.8	Confident	19 Å²	19	63.5 Å²	63.5	9%	0.088	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-41	176.1	174.9	67.7	0	0	0	112.6	C165 F169 N174 L175 I176 R180 I181 H182	C165-H178 PolarHBondContact SG-NE2 3.13Å; F169-H178 HydrophobicContact CE1-CB 3.87Å; F169-H178 HydrophobicContact CE2-CB 3.78Å; F169-H178 AromaticContact CE2-CD2 3.42Å; F169-H178 VanDerWaalsContact CE2-CD2 3.42Å; F169-H178 WeakPolarHBondContact CE2-CD2 3.22Å; F169-H178 AromaticContact CE2-CG 3.58Å; F169-H178 HydrophobicContact CZ-CB 3.34Å; F169-H178 AromaticContact CZ-CD2 3.44Å; F169-H178 VanDerWaalsContact CZ-CD2 3.44Å; F169-H178 WeakPolarHBondContact CZ-CD2 3.43Å; F169-H178 AromaticContact CZ-CG 3.13Å; F169-H178 AromaticContact CZ-ND1 3.64Å; N174-H178 VanDerWaalsContact O-CB 3.32Å; N174-H178 WeakPolarHBondContact O-CB 3.29Å; N174-H178 PolarHBondContact O-N 2.86Å; L175-H178 CarbonylContact O-C 3.52Å; L175-H178 WeakPolarHBondContact O-CB 3.39Å; L175-H178 PolarHBondContact O-N 2.94Å; L175-H178 VanDerWaalsContact O-N 3.13Å; I176-H178 VanDerWaalsContact C-N 3.27Å; I176-H178 PolarHBondContact O-N 3.2Å; H178-R180 PolarHBondContact O-N 2.93Å; H178-I181 VanDerWaalsContact O-CB 3.23Å; H178-I181 WeakPolarHBondContact O-CB 3.43Å; H178-I181 WeakPolarHBondContact O-CG1 2.93Å; H178-I181 PolarHBondContact O-N 2.85Å; H178-H182 AromaticContact CD2-NE2 3.87Å; H178-H182 AromaticContact CE1-NE2 3.77Å; H178-H182 AromaticContact NE2-CE1 3.93Å; H178-H182 AromaticContact NE2-NE2 3.16Å; H178-H182 PolarHBondContact NE2-NE2 3.17Å; H178-H182 VanDerWaalsContact NE2-NE2 3.16Å
179	Q	79.8	Confident	79.8	Confident	72 Å²	72	69.6 Å²	69.6	34%	0.336	36%	0.363	S	S	.	.	H	α-helix	trans	-59.5	-30.9	178.1	-76.4	173.8	-46.4	0	0	112.3	L175 I176 I181 H182 T183	L175-Q179 HydrophobicContact CD1-CG 4.08Å; L175-Q179 HydrophobicContact CG-CG 4.41Å; L175-Q179 WeakPolarHBondContact O-CG 3.5Å; L175-Q179 PolarHBondContact O-N 3.05Å; I176-Q179 PolarHBondContact O-N 3.17Å; Q179-I181 PolarHBondContact O-N 3.29Å; Q179-I181 VanDerWaalsContact O-N 3.11Å; Q179-H182 PolarHBondContact O-N 3.13Å; Q179-T183 PolarHBondContact O-N 3.28Å; Q179-T183 VanDerWaalsContact O-N 3.16Å
180	R	82.3	Confident	80.1	Confident	47 Å²	47	67.8 Å²	67.8	18%	0.177	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-16.8	173.3	-67	177.8	-176.4	173.2	-0.7	114.5	I176 H178 T183 G184 E185 T198	I176-R180 PolarHBondContact O-N 3.1Å; H178-R180 PolarHBondContact O-N 2.93Å; R180-T183 WeakPolarHBondContact CA-OG1 3.4Å; R180-G184 WeakPolarHBondContact O-CA 3.41Å; R180-G184 PolarHBondContact O-N 3.18Å; R180-G184 VanDerWaalsContact O-N 3.12Å; R180-E185 HydrophobicContact CG-CB 4.38Å; R180-E185 PolarHBondContact O-N 3.04Å; R180-T198 HydrophobicContact CB-CG2 4.27Å; R180-T198 PolarHBondContact NH1-O 3.36Å
181	I	78.8	Confident	80.4	Confident	114 Å²	114	69.5 Å²	69.5	59%	0.585	38%	0.384	S	S	*	.	H	α-helix	trans	-71.8	-38.2	173.4	-59.2	175.9	0	0	0	110.2	H178 Q179	H178-I181 VanDerWaalsContact O-CB 3.23Å; H178-I181 WeakPolarHBondContact O-CB 3.43Å; H178-I181 WeakPolarHBondContact O-CG1 2.93Å; H178-I181 PolarHBondContact O-N 2.85Å; Q179-I181 PolarHBondContact O-N 3.29Å; Q179-I181 VanDerWaalsContact O-N 3.11Å
182	H	79.4	Confident	80.5	Confident	77 Å²	77	74.3 Å²	74.3	36%	0.356	40%	0.403	S	S	.	.	H	α-helix	trans	-78.9	-40.4	-178.5	-56.9	-53.4	0	0	0	111.7	C162 E164 C165 H178 Q179 G184	C162-H182 PolarHBondContact SG-NE2 3.15Å; E164-H182 WeakPolarHBondContact OE2-CB 3.35Å; E164-H182 IonicContact OE2-CD2 3.6Å; E164-H182 PolarHBondContact OE2-CD2 3.02Å; E164-H182 IonicContact OE2-CG 3.12Å; E164-H182 IonicContact OE2-NE2 3.43Å; C165-H182 PolarHBondContact SG-NE2 3.02Å; C165-H182 VanDerWaalsContact SG-NE2 3.43Å; H178-H182 AromaticContact CD2-NE2 3.87Å; H178-H182 AromaticContact CE1-NE2 3.77Å; H178-H182 AromaticContact NE2-CE1 3.93Å; H178-H182 AromaticContact NE2-NE2 3.16Å; H178-H182 PolarHBondContact NE2-NE2 3.17Å; H178-H182 VanDerWaalsContact NE2-NE2 3.16Å; Q179-H182 PolarHBondContact O-N 3.13Å; H182-G184 VanDerWaalsContact C-N 3.25Å; H182-G184 PolarHBondContact O-N 2.89Å
183	T	79.1	Confident	80.8	Confident	77 Å²	77	74 Å²	74	47%	0.472	40%	0.4	S	S	.	.	H	α-helix	trans	-76.5	-14	176.3	64.4	0	0	0	0	113.1	Q179 R180 E185	Q179-T183 PolarHBondContact O-N 3.28Å; Q179-T183 VanDerWaalsContact O-N 3.16Å; R180-T183 WeakPolarHBondContact CA-OG1 3.4Å; T183-E185 PolarHBondContact O-N 3.37Å; T183-E185 VanDerWaalsContact O-N 3.14Å; T183-E185 WeakPolarHBondContact OG1-CB 3.36Å; T183-E185 WeakPolarHBondContact OG1-CG 3.38Å; T183-E185 PolarHBondContact OG1-N 2.99Å
184	G	77.7	Confident	81	Confident	47 Å²	47	74.9 Å²	74.9	49%	0.485	41%	0.413	S	S	.	.			trans	67.9	4.6	-174.3	0	0	0	0	0	114.2	R180 H182 K186	R180-G184 WeakPolarHBondContact O-CA 3.41Å; R180-G184 PolarHBondContact O-N 3.18Å; R180-G184 VanDerWaalsContact O-N 3.12Å; H182-G184 VanDerWaalsContact C-N 3.25Å; H182-G184 PolarHBondContact O-N 2.89Å; G184-K186 PolarHBondContact O-N 3.43Å
185	E	79.8	Confident	81.1	Confident	114 Å²	114	77.7 Å²	77.7	53%	0.533	42%	0.422	S	S	.	.			trans	-62.7	119.5	-178.4	-75.9	-179.5	-178.8	0	0	111.3	R180 T183 P187	R180-E185 HydrophobicContact CG-CB 4.38Å; R180-E185 PolarHBondContact O-N 3.04Å; T183-E185 PolarHBondContact O-N 3.37Å; T183-E185 VanDerWaalsContact O-N 3.14Å; T183-E185 WeakPolarHBondContact OG1-CB 3.36Å; T183-E185 WeakPolarHBondContact OG1-CG 3.38Å; T183-E185 PolarHBondContact OG1-N 2.99Å; E185-P187 WeakPolarHBondContact O-CD 3.46Å
186	K	80.9	Confident	81.3	Confident	111 Å²	111	78.2 Å²	78.2	48%	0.483	43%	0.429	S	S	.	.			trans	-121.9	81.7	174.4	-66.5	172.3	-178.9	-179.3	0	109.3	G184 Y188 A196 F197 T198	G184-K186 PolarHBondContact O-N 3.43Å; K186-Y188 PolarHBondContact O-N 3.5Å; K186-A196 HydrophobicContact CB-CB 3.47Å; K186-A196 VanDerWaalsContact CB-CB 3.47Å; K186-A196 HydrophobicContact CD-CB 3.81Å; K186-A196 HydrophobicContact CG-CB 4.26Å; K186-F197 CarbonylContact C-O 3.57Å; K186-F197 WeakPolarHBondContact CA-O 3.41Å; K186-T198 HydrophobicContact CG-CG2 3.98Å
187	P	82	Confident	81.2	Confident	70 Å²	70	76.3 Å²	76.3	46%	0.455	42%	0.418	S	S	.	.			trans	-63.4	-24.4	-171.9	-23.5	34.8	0	0	0	113.7	E185	E185-P187 WeakPolarHBondContact O-CD 3.46Å
188	Y	83.4	Confident	81.1	Confident	69 Å²	69	74 Å²	74	27%	0.271	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	96.8	-173.6	-52.1	-73.6	0	0	0	110.1	K186 A196 F197 Y200 F203	K186-Y188 PolarHBondContact O-N 3.5Å; Y188-A196 CarbonylContact O-C 3.54Å; Y188-A196 WeakPolarHBondContact O-CA 3.49Å; Y188-F197 PolarHBondContact N-O 3.07Å; Y188-F197 PolarHBondContact O-N 2.81Å; Y188-Y200 AromaticContact CD1-CD2 3.8Å; Y188-Y200 HydrophobicContact CD1-CD2 3.8Å; Y188-Y200 AromaticContact CE1-CD2 3.64Å; Y188-Y200 HydrophobicContact CE1-CD2 3.64Å; Y188-Y200 HydrophobicContact CE1-CG 4.24Å; Y188-F203 HydrophobicContact CG-CB 4.39Å
189	K	81.8	Confident	81	Confident	157 Å²	157	75.5 Å²	75.5	68%	0.683	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.4	179.5	-63.5	-176.4	179.8	177.1	0	110.8	A196 F203	K189-A196 HydrophobicContact CG-CB 3.81Å; K189-F203 WeakPolarHBondContact O-CE2 3.41Å
190	C	86.1	Confident	80.9	Confident	3 Å²	3	78.1 Å²	78.1	2%	0.02	43%	0.429	C	S	.	.			trans	-82.1	119.8	172.2	-178.4	0	0	0	0	109.9	E192 G194 K195 F203 H210	C190-E192 VanDerWaalsContact C-N 3.26Å; C190-E192 PolarHBondContact O-N 3.14Å; C190-G194 VanDerWaalsContact O-CA 3.23Å; C190-G194 WeakPolarHBondContact O-CA 3.49Å; C190-G194 PolarHBondContact O-N 2.98Å; C190-K195 WeakPolarHBondContact CB-O 3.5Å; C190-K195 PolarHBondContact N-O 3.41Å; C190-F203 HydrophobicContact CB-CE2 4.02Å; C190-H210 PolarHBondContact SG-NE2 2.87Å
191	G	82	Confident	80.6	Confident	83 Å²	83	79.1 Å²	79.1	86%	0.856	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-27.1	177.5	0	0	0	0	0	113.9
192	E	80.4	Confident	80.7	Confident	138 Å²	138	76.5 Å²	76.5	65%	0.645	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-33	-173.6	-64.5	174.3	-145	0	0	114	C190 H210	C190-E192 VanDerWaalsContact C-N 3.26Å; C190-E192 PolarHBondContact O-N 3.14Å; E192-H210 WeakPolarHBondContact OE2-CB 3.32Å; E192-H210 IonicContact OE2-CD2 3.88Å; E192-H210 PolarHBondContact OE2-CD2 3.16Å; E192-H210 VanDerWaalsContact OE2-CD2 3.29Å; E192-H210 IonicContact OE2-CG 3.99Å; E192-H210 IonicContact OE2-ND1 3.42Å
193	C	84.4	Confident	80.8	Confident	53 Å²	53	73.9 Å²	73.9	36%	0.358	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	4.4	-177.1	76.9	0	0	0	0	114.1	K195 H206	C193-K195 PolarHBondContact O-N 3.06Å; C193-K195 VanDerWaalsContact SG-CB 3.57Å; C193-K195 VanDerWaalsContact SG-CG 3.52Å; C193-H206 VanDerWaalsContact SG-CE1 3.56Å; C193-H206 PolarHBondContact SG-NE2 3.16Å
194	G	81.3	Confident	80.8	Confident	60 Å²	60	72.9 Å²	72.9	62%	0.619	41%	0.411	S	S	*	.			trans	69	-2.3	-179.9	0	0	0	0	0	115.4	C190 A196	C190-G194 VanDerWaalsContact O-CA 3.23Å; C190-G194 WeakPolarHBondContact O-CA 3.49Å; C190-G194 PolarHBondContact O-N 2.98Å; G194-A196 PolarHBondContact O-N 3.27Å
195	K	82.4	Confident	81	Confident	130 Å²	130	73 Å²	73	57%	0.565	40%	0.4	S	S	*	.			trans	-67.5	134.9	-179.5	-71.3	179.7	-177.5	174.8	0	111.1	C190 C193 F197	C190-K195 WeakPolarHBondContact CB-O 3.5Å; C190-K195 PolarHBondContact N-O 3.41Å; C193-K195 PolarHBondContact O-N 3.06Å; C193-K195 VanDerWaalsContact SG-CB 3.57Å; C193-K195 VanDerWaalsContact SG-CG 3.52Å; K195-F197 HydrophobicContact CB-CE2 3.87Å; K195-F197 HydrophobicContact CB-CZ 4.07Å
196	A	84.4	Confident	81.2	Confident	31 Å²	31	68.6 Å²	68.6	26%	0.256	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	143.2	-178.3	0	0	0	0	0	111.8	K186 Y188 K189 G194	K186-A196 HydrophobicContact CB-CB 3.47Å; K186-A196 VanDerWaalsContact CB-CB 3.47Å; K186-A196 HydrophobicContact CD-CB 3.81Å; K186-A196 HydrophobicContact CG-CB 4.26Å; Y188-A196 CarbonylContact O-C 3.54Å; Y188-A196 WeakPolarHBondContact O-CA 3.49Å; K189-A196 HydrophobicContact CG-CB 3.81Å; G194-A196 PolarHBondContact O-N 3.27Å
197	F	79.4	Confident	81.1	Confident	44 Å²	44	66.4 Å²	66.4	19%	0.193	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.1	-174	-57.5	-96.7	0	0	0	111	K186 Y188 K195 F203 H206	K186-F197 CarbonylContact C-O 3.57Å; K186-F197 WeakPolarHBondContact CA-O 3.41Å; Y188-F197 PolarHBondContact N-O 3.07Å; Y188-F197 PolarHBondContact O-N 2.81Å; K195-F197 HydrophobicContact CB-CE2 3.87Å; K195-F197 HydrophobicContact CB-CZ 4.07Å; F197-F203 HydrophobicContact CB-CB 3.97Å; F197-F203 HydrophobicContact CD2-CB 3.98Å; F197-F203 AromaticContact CD2-CD2 3.73Å; F197-F203 HydrophobicContact CD2-CD2 3.73Å; F197-F203 HydrophobicContact CD2-CG 4.36Å; F197-F203 HydrophobicContact CE2-CD2 4.18Å; F197-F203 HydrophobicContact CG-CB 4.05Å; F197-H206 HydrophobicContact CE1-CB 3.88Å; F197-H206 HydrophobicContact CE2-CB 3.89Å; F197-H206 AromaticContact CE2-CD2 3.24Å; F197-H206 WeakPolarHBondContact CE2-CD2 3.45Å; F197-H206 AromaticContact CE2-CG 3.64Å; F197-H206 HydrophobicContact CZ-CB 3.37Å; F197-H206 AromaticContact CZ-CD2 3.33Å; F197-H206 WeakPolarHBondContact CZ-CD2 3.36Å; F197-H206 AromaticContact CZ-CG 3.22Å; F197-H206 AromaticContact CZ-ND1 3.97Å
198	T	76.9	Confident	81.3	Confident	39 Å²	39	65.2 Å²	65.2	24%	0.239	36%	0.358	C	S	.	.	S	Bend	trans	-84.8	-21.7	178.7	54.2	0	0	0	0	112.8	R180 K186	R180-T198 HydrophobicContact CB-CG2 4.27Å; R180-T198 PolarHBondContact NH1-O 3.36Å; K186-T198 HydrophobicContact CG-CG2 3.98Å
199	I	79.3	Confident	81.3	Confident	49 Å²	49	65.9 Å²	65.9	25%	0.251	37%	0.369	S	S	.	.	S	Bend	trans	-126.4	136.8	-174.5	-55.7	173.3	0	0	0	109.5	Y177 S201 T202 F203	Y177-I199 HydrophobicContact CD1-CG1 4.09Å; Y177-I199 HydrophobicContact CG-CD1 4.41Å; Y177-I199 HydrophobicContact CG-CG1 4.17Å; I199-S201 WeakPolarHBondContact CG2-OG 3.27Å; I199-S201 PolarHBondContact O-N 2.7Å; I199-T202 HydrophobicContact CB-CG2 4.48Å; I199-T202 PolarHBondContact O-N 3.48Å; I199-T202 PolarHBondContact O-OG1 3.01Å; I199-F203 PolarHBondContact O-N 3.39Å
200	Y	76.6	Confident	81.4	Confident	127 Å²	127	61.7 Å²	61.7	50%	0.498	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-40.6	-178.4	-179.4	-104.7	0	0	0	113.3	Y188 T202 F203 M204	Y188-Y200 AromaticContact CD1-CD2 3.8Å; Y188-Y200 HydrophobicContact CD1-CD2 3.8Å; Y188-Y200 AromaticContact CE1-CD2 3.64Å; Y188-Y200 HydrophobicContact CE1-CD2 3.64Å; Y188-Y200 HydrophobicContact CE1-CG 4.24Å; Y200-T202 VanDerWaalsContact C-N 3.32Å; Y200-T202 PolarHBondContact O-N 3.35Å; Y200-F203 HydrophobicContact CD2-CD1 4.27Å; Y200-F203 HydrophobicContact CE2-CD1 4.34Å; Y200-F203 WeakPolarHBondContact O-CB 3.37Å; Y200-F203 PolarHBondContact O-N 3.36Å; Y200-M204 HydrophobicContact CD1-CG 3.97Å; Y200-M204 HydrophobicContact CD2-CG 4.41Å; Y200-M204 HydrophobicContact CE1-CG 3.46Å; Y200-M204 VanDerWaalsContact CE1-CG 3.46Å; Y200-M204 HydrophobicContact CE1-SD 4.22Å; Y200-M204 HydrophobicContact CE2-CG 3.96Å; Y200-M204 HydrophobicContact CE2-SD 4.02Å; Y200-M204 HydrophobicContact CG-CG 4.43Å; Y200-M204 VanDerWaalsContact CZ-CG 3.47Å; Y200-M204 WeakPolarHBondContact O-CG 3.49Å; Y200-M204 PolarHBondContact O-N 3.01Å; Y200-M204 PolarHBondContact OH-SD 3.48Å; Y200-M204 VanDerWaalsContact OH-SD 3.37Å
201	S	76.1	Confident	81.2	Confident	69 Å²	69	65.4 Å²	65.4	48%	0.483	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-34.6	-179	57.7	0	0	0	0	113.1	I199 N205	I199-S201 WeakPolarHBondContact CG2-OG 3.27Å; I199-S201 PolarHBondContact O-N 2.7Å; S201-N205 WeakPolarHBondContact O-CB 3.38Å; S201-N205 VanDerWaalsContact O-CG 3.26Å; S201-N205 PolarHBondContact O-N 3.47Å; S201-N205 VanDerWaalsContact O-N 3.07Å; S201-N205 PolarHBondContact O-ND2 2.99Å
202	T	80.2	Confident	81.3	Confident	59 Å²	59	63.6 Å²	63.6	36%	0.362	36%	0.359	S	S	.	.	H	α-helix	trans	-73.8	-35.9	175.8	56.4	0	0	0	0	111.4	I199 Y200 H206	I199-T202 HydrophobicContact CB-CG2 4.48Å; I199-T202 PolarHBondContact O-N 3.48Å; I199-T202 PolarHBondContact O-OG1 3.01Å; Y200-T202 VanDerWaalsContact C-N 3.32Å; Y200-T202 PolarHBondContact O-N 3.35Å; T202-H206 WeakPolarHBondContact O-CB 3.49Å; T202-H206 PolarHBondContact O-N 3.17Å
203	F	83.2	Confident	81.4	Confident	22 Å²	22	62.1 Å²	62.1	10%	0.096	35%	0.352	C	S	.	.	H	α-helix	trans	-60.3	-50.1	169.8	170.4	-111.3	0	0	0	112.4	Y188 K189 C190 F197 I199 Y200 N205 H206 Q207	Y188-F203 HydrophobicContact CG-CB 4.39Å; K189-F203 WeakPolarHBondContact O-CE2 3.41Å; C190-F203 HydrophobicContact CB-CE2 4.02Å; F197-F203 HydrophobicContact CB-CB 3.97Å; F197-F203 HydrophobicContact CD2-CB 3.98Å; F197-F203 AromaticContact CD2-CD2 3.73Å; F197-F203 HydrophobicContact CD2-CD2 3.73Å; F197-F203 HydrophobicContact CD2-CG 4.36Å; F197-F203 HydrophobicContact CE2-CD2 4.18Å; F197-F203 HydrophobicContact CG-CB 4.05Å; I199-F203 PolarHBondContact O-N 3.39Å; Y200-F203 HydrophobicContact CD2-CD1 4.27Å; Y200-F203 HydrophobicContact CE2-CD1 4.34Å; Y200-F203 WeakPolarHBondContact O-CB 3.37Å; Y200-F203 PolarHBondContact O-N 3.36Å; F203-N205 PolarHBondContact O-N 3.39Å; F203-H206 CarbonylContact O-C 3.57Å; F203-H206 WeakPolarHBondContact O-CA 3.36Å; F203-H206 WeakPolarHBondContact O-CB 3.38Å; F203-H206 PolarHBondContact O-N 2.77Å; F203-Q207 HydrophobicContact CD2-CG 4.33Å; F203-Q207 HydrophobicContact CE1-CG 4.14Å; F203-Q207 HydrophobicContact CE2-CG 3.82Å; F203-Q207 HydrophobicContact CZ-CG 3.72Å; F203-Q207 PolarHBondContact O-N 2.85Å
204	M	79.1	Confident	81.5	Confident	56 Å²	56	65 Å²	65	28%	0.276	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-42.5	177.9	-73.1	-58.1	-61.4	0	0	112.3	Y200 H206 Q207 R208	Y200-M204 HydrophobicContact CD1-CG 3.97Å; Y200-M204 HydrophobicContact CD2-CG 4.41Å; Y200-M204 HydrophobicContact CE1-CG 3.46Å; Y200-M204 VanDerWaalsContact CE1-CG 3.46Å; Y200-M204 HydrophobicContact CE1-SD 4.22Å; Y200-M204 HydrophobicContact CE2-CG 3.96Å; Y200-M204 HydrophobicContact CE2-SD 4.02Å; Y200-M204 HydrophobicContact CG-CG 4.43Å; Y200-M204 VanDerWaalsContact CZ-CG 3.47Å; Y200-M204 WeakPolarHBondContact O-CG 3.49Å; Y200-M204 PolarHBondContact O-N 3.01Å; Y200-M204 PolarHBondContact OH-SD 3.48Å; Y200-M204 VanDerWaalsContact OH-SD 3.37Å; M204-H206 PolarHBondContact O-N 3.15Å; M204-Q207 PolarHBondContact O-N 3.09Å; M204-Q207 PolarHBondContact SD-OE1 3.43Å; M204-R208 PolarHBondContact O-N 3.12Å
205	N	80.4	Confident	81.5	Confident	50 Å²	50	65.1 Å²	65.1	27%	0.267	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-32.3	174.4	-74.8	-21.1	0	0	0	112.3	S201 F203 R208	S201-N205 WeakPolarHBondContact O-CB 3.38Å; S201-N205 VanDerWaalsContact O-CG 3.26Å; S201-N205 PolarHBondContact O-N 3.47Å; S201-N205 VanDerWaalsContact O-N 3.07Å; S201-N205 PolarHBondContact O-ND2 2.99Å; F203-N205 PolarHBondContact O-N 3.39Å; N205-R208 PolarHBondContact OD1-NH1 2.95Å
206	H	85.1	Confident	81.6	Confident	21 Å²	21	62.7 Å²	62.7	10%	0.097	34%	0.336	C	S	.	.	H	α-helix	trans	-72	-42.1	173	169.5	59.4	0	0	0	112.2	C193 F197 T202 F203 M204 R208 T209 H210	C193-H206 VanDerWaalsContact SG-CE1 3.56Å; C193-H206 PolarHBondContact SG-NE2 3.16Å; F197-H206 HydrophobicContact CE1-CB 3.88Å; F197-H206 HydrophobicContact CE2-CB 3.89Å; F197-H206 AromaticContact CE2-CD2 3.24Å; F197-H206 WeakPolarHBondContact CE2-CD2 3.45Å; F197-H206 AromaticContact CE2-CG 3.64Å; F197-H206 HydrophobicContact CZ-CB 3.37Å; F197-H206 AromaticContact CZ-CD2 3.33Å; F197-H206 WeakPolarHBondContact CZ-CD2 3.36Å; F197-H206 AromaticContact CZ-CG 3.22Å; F197-H206 AromaticContact CZ-ND1 3.97Å; T202-H206 WeakPolarHBondContact O-CB 3.49Å; T202-H206 PolarHBondContact O-N 3.17Å; F203-H206 CarbonylContact O-C 3.57Å; F203-H206 WeakPolarHBondContact O-CA 3.36Å; F203-H206 WeakPolarHBondContact O-CB 3.38Å; F203-H206 PolarHBondContact O-N 2.77Å; M204-H206 PolarHBondContact O-N 3.15Å; H206-R208 PolarHBondContact O-N 2.83Å; H206-T209 PolarHBondContact ND1-OG1 3.12Å; H206-T209 WeakPolarHBondContact O-CB 3.33Å; H206-T209 PolarHBondContact O-N 3.38Å; H206-T209 PolarHBondContact O-OG1 3.29Å; H206-H210 AromaticContact CE1-CE1 3.75Å; H206-H210 AromaticContact CE1-NE2 3.44Å; H206-H210 PolarHBondContact CE1-NE2 3.11Å; H206-H210 AromaticContact NE2-NE2 3.27Å; H206-H210 PolarHBondContact NE2-NE2 3.42Å
207	Q	79.1	Confident	81.6	Confident	65 Å²	65	67.1 Å²	67.1	30%	0.304	35%	0.351	S	S	.	.	H	α-helix	trans	-57.6	-35.9	176.4	-73.8	-168.9	-69.5	0	0	112.1	F203 M204 T209 H210 S211	F203-Q207 HydrophobicContact CD2-CG 4.33Å; F203-Q207 HydrophobicContact CE1-CG 4.14Å; F203-Q207 HydrophobicContact CE2-CG 3.82Å; F203-Q207 HydrophobicContact CZ-CG 3.72Å; F203-Q207 PolarHBondContact O-N 2.85Å; M204-Q207 PolarHBondContact O-N 3.09Å; M204-Q207 PolarHBondContact SD-OE1 3.43Å; Q207-T209 PolarHBondContact O-N 3.29Å; Q207-T209 VanDerWaalsContact O-N 3.11Å; Q207-H210 PolarHBondContact O-N 3.31Å; Q207-S211 PolarHBondContact O-N 3.41Å
208	R	84.9	Confident	82	Confident	45 Å²	45	65 Å²	65	17%	0.17	34%	0.342	C	S	.	.	H	α-helix	trans	-59.3	-20.9	172.6	-69.1	-177.2	-170.4	143.8	6.9	114.5	M204 N205 H206 H210 S211 G212 E213 T226	M204-R208 PolarHBondContact O-N 3.12Å; N205-R208 PolarHBondContact OD1-NH1 2.95Å; H206-R208 PolarHBondContact O-N 2.83Å; R208-H210 VanDerWaalsContact C-N 3.28Å; R208-S211 WeakPolarHBondContact CA-OG 3.21Å; R208-G212 PolarHBondContact O-N 3.36Å; R208-G212 VanDerWaalsContact O-N 3.14Å; R208-E213 HydrophobicContact CG-CB 4.37Å; R208-E213 PolarHBondContact O-N 3.49Å; R208-T226 HydrophobicContact CB-CG2 4.16Å; R208-T226 PolarHBondContact NH1-O 3.39Å
209	T	84.5	Confident	82.5	Confident	82 Å²	82	72.6 Å²	72.6	50%	0.503	37%	0.372	S	S	.	.	H	α-helix	trans	-73	-24.3	175.6	68.6	0	0	0	0	112.6	H206 Q207	H206-T209 PolarHBondContact ND1-OG1 3.12Å; H206-T209 WeakPolarHBondContact O-CB 3.33Å; H206-T209 PolarHBondContact O-N 3.38Å; H206-T209 PolarHBondContact O-OG1 3.29Å; Q207-T209 PolarHBondContact O-N 3.29Å; Q207-T209 VanDerWaalsContact O-N 3.11Å
210	H	83.4	Confident	82.7	Confident	69 Å²	69	75.3 Å²	75.3	32%	0.319	39%	0.387	S	S	.	.	H	α-helix	trans	-90.5	-42.9	177.3	-54.7	-51.7	0	0	0	112.3	C190 E192 H206 Q207 R208 G212	C190-H210 PolarHBondContact SG-NE2 2.87Å; E192-H210 WeakPolarHBondContact OE2-CB 3.32Å; E192-H210 IonicContact OE2-CD2 3.88Å; E192-H210 PolarHBondContact OE2-CD2 3.16Å; E192-H210 VanDerWaalsContact OE2-CD2 3.29Å; E192-H210 IonicContact OE2-CG 3.99Å; E192-H210 IonicContact OE2-ND1 3.42Å; H206-H210 AromaticContact CE1-CE1 3.75Å; H206-H210 AromaticContact CE1-NE2 3.44Å; H206-H210 PolarHBondContact CE1-NE2 3.11Å; H206-H210 AromaticContact NE2-NE2 3.27Å; H206-H210 PolarHBondContact NE2-NE2 3.42Å; Q207-H210 PolarHBondContact O-N 3.31Å; R208-H210 VanDerWaalsContact C-N 3.28Å; H210-G212 PolarHBondContact O-N 3.07Å
211	S	82.1	Confident	83.2	Confident	81 Å²	81	72.3 Å²	72.3	57%	0.566	38%	0.384	S	S	*	.	H	α-helix	trans	-69.2	-16.3	176	67.1	0	0	0	0	113.3	Q207 R208 E213	Q207-S211 PolarHBondContact O-N 3.41Å; R208-S211 WeakPolarHBondContact CA-OG 3.21Å; S211-E213 PolarHBondContact O-N 2.79Å; S211-E213 WeakPolarHBondContact OG-CB 3.47Å; S211-E213 PolarHBondContact OG-N 3.43Å
212	G	83.3	Confident	83.6	Confident	45 Å²	45	71 Å²	71	46%	0.464	38%	0.38	S	S	.	.			trans	72.5	1.6	-174	0	0	0	0	0	114	R208 H210 K214	R208-G212 PolarHBondContact O-N 3.36Å; R208-G212 VanDerWaalsContact O-N 3.14Å; H210-G212 PolarHBondContact O-N 3.07Å; G212-K214 PolarHBondContact O-N 2.94Å
213	E	82.6	Confident	84	Confident	107 Å²	107	73.8 Å²	73.8	50%	0.5	39%	0.388	S	S	.	.			trans	-62.8	120.7	-178.5	-167.5	-164	163.8	0	0	110.6	R208 S211 P215	R208-E213 HydrophobicContact CG-CB 4.37Å; R208-E213 PolarHBondContact O-N 3.49Å; S211-E213 PolarHBondContact O-N 2.79Å; S211-E213 WeakPolarHBondContact OG-CB 3.47Å; S211-E213 PolarHBondContact OG-N 3.43Å; E213-P215 HydrophobicContact CG-CG 4.04Å; E213-P215 WeakPolarHBondContact O-CD 3.36Å; E213-P215 WeakPolarHBondContact OE1-CG 3.35Å
214	K	86.6	Confident	84.1	Confident	115 Å²	115	74.1 Å²	74.1	50%	0.5	40%	0.395	S	S	.	.			trans	-126	79.6	-179.9	-71.8	165.1	178.4	-179.4	0	109.8	G212 Y216 A224 F225 T226	G212-K214 PolarHBondContact O-N 2.94Å; K214-Y216 PolarHBondContact O-N 3.03Å; K214-A224 HydrophobicContact CB-CB 3.45Å; K214-A224 VanDerWaalsContact CB-CB 3.45Å; K214-A224 HydrophobicContact CD-CB 4.1Å; K214-A224 WeakPolarHBondContact CD-O 3.45Å; K214-A224 HydrophobicContact CG-CB 4.39Å; K214-F225 CarbonylContact C-O 3.27Å; K214-F225 VanDerWaalsContact C-O 3.28Å; K214-F225 VanDerWaalsContact CA-O 3.31Å; K214-F225 WeakPolarHBondContact CA-O 3.41Å; K214-T226 HydrophobicContact CG-CG2 4.01Å
215	P	82.3	Confident	84.4	Confident	62 Å²	62	73 Å²	73	40%	0.403	39%	0.388	S	S	.	.			trans	-66	-13.6	-172.2	-22.1	34.1	0	0	0	114.8	E213	E213-P215 HydrophobicContact CG-CG 4.04Å; E213-P215 WeakPolarHBondContact O-CD 3.36Å; E213-P215 WeakPolarHBondContact OE1-CG 3.35Å
216	Y	83.8	Confident	84.4	Confident	79 Å²	79	71.9 Å²	71.9	31%	0.31	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	94.8	-171.3	-57	-79.3	0	0	0	110.3	K214 A224 F225 N227 C228	K214-Y216 PolarHBondContact O-N 3.03Å; Y216-A224 CarbonylContact O-C 3.53Å; Y216-A224 WeakPolarHBondContact O-CA 3.23Å; Y216-F225 PolarHBondContact N-O 2.87Å; Y216-F225 PolarHBondContact O-N 2.84Å; Y216-N227 VanDerWaalsContact CD2-CA 3.43Å; Y216-C228 HydrophobicContact CD1-CB 3.78Å; Y216-C228 HydrophobicContact CE1-CB 3.66Å; Y216-C228 HydrophobicContact CG-CB 4.34Å
217	E	85.1	Confident	84.1	Confident	123 Å²	123	72.6 Å²	72.6	58%	0.575	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	137.5	-178.6	-166.1	178.2	163.9	0	0	112.8	G222 A224	E217-G222 WeakPolarHBondContact OE1-CA 3.31Å; E217-A224 HydrophobicContact CB-CB 4.46Å; E217-A224 HydrophobicContact CG-CB 4.44Å
218	C	88.5	Confident	84	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.394	C	S	.	.			trans	-81.2	116.7	170.9	-179.1	0	0	0	0	110.3	D220 C221 G222 K223 F225 L231 H238	C218-D220 PolarHBondContact O-N 3.33Å; C218-C221 PolarHBondContact O-N 2.76Å; C218-C221 VanDerWaalsContact SG-SG 3.64Å; C218-G222 VanDerWaalsContact O-CA 3.28Å; C218-G222 WeakPolarHBondContact O-CA 3.32Å; C218-G222 PolarHBondContact O-N 2.83Å; C218-K223 VanDerWaalsContact CB-O 3.32Å; C218-K223 WeakPolarHBondContact CB-O 3.3Å; C218-K223 PolarHBondContact N-O 3.39Å; C218-F225 HydrophobicContact CB-CE2 4.33Å; C218-L231 HydrophobicContact CB-CD1 3.59Å; C218-H238 VanDerWaalsContact SG-CD2 3.54Å; C218-H238 PolarHBondContact SG-NE2 3.17Å; C218-H238 VanDerWaalsContact SG-NE2 3.37Å
219	K	86.4	Confident	83.7	Confident	199 Å²	199	76.8 Å²	76.8	87%	0.865	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.6	179.7	-63.6	-173.4	177	-174.8	0	113.8
220	D	83.8	Confident	83.7	Confident	106 Å²	106	75.9 Å²	75.9	57%	0.567	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-25.2	-174.5	-50	-45.6	0	0	0	113.4	C218 H238	C218-D220 PolarHBondContact O-N 3.33Å; D220-H238 IonicContact OD2-CD2 3.1Å; D220-H238 PolarHBondContact OD2-CD2 3.24Å; D220-H238 IonicContact OD2-CG 3.74Å
221	C	87.7	Confident	83.7	Confident	64 Å²	64	73.7 Å²	73.7	43%	0.432	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	5.3	-174.5	71.4	0	0	0	0	114.8	C218 K223 H234 H238	C218-C221 PolarHBondContact O-N 2.76Å; C218-C221 VanDerWaalsContact SG-SG 3.64Å; C221-K223 PolarHBondContact O-N 2.81Å; C221-K223 VanDerWaalsContact O-N 3.08Å; C221-K223 WeakPolarHBondContact SG-CB 3.41Å; C221-H234 PolarHBondContact SG-NE2 3.33Å; C221-H238 PolarHBondContact SG-NE2 2.82Å; C221-H238 VanDerWaalsContact SG-NE2 3.38Å
222	G	84.4	Confident	83.6	Confident	40 Å²	40	74 Å²	74	41%	0.412	39%	0.388	S	S	.	.			trans	66.1	5.2	-177.9	0	0	0	0	0	114.6	E217 C218 A224	E217-G222 WeakPolarHBondContact OE1-CA 3.31Å; C218-G222 VanDerWaalsContact O-CA 3.28Å; C218-G222 WeakPolarHBondContact O-CA 3.32Å; C218-G222 PolarHBondContact O-N 2.83Å; G222-A224 PolarHBondContact O-N 3.37Å
223	K	87	Confident	83.5	Confident	118 Å²	118	72.1 Å²	72.1	51%	0.513	37%	0.367	S	S	.	.			trans	-76.2	122	-176	-166.6	169.9	-175.9	172.5	0	110.4	C218 C221 F225	C218-K223 VanDerWaalsContact CB-O 3.32Å; C218-K223 WeakPolarHBondContact CB-O 3.3Å; C218-K223 PolarHBondContact N-O 3.39Å; C221-K223 PolarHBondContact O-N 2.81Å; C221-K223 VanDerWaalsContact O-N 3.08Å; C221-K223 WeakPolarHBondContact SG-CB 3.41Å; K223-F225 HydrophobicContact CB-CE2 4.18Å; K223-F225 HydrophobicContact CB-CZ 4.34Å; K223-F225 HydrophobicContact CD-CZ 3.93Å; K223-F225 HydrophobicContact CG-CE2 4.1Å; K223-F225 HydrophobicContact CG-CZ 3.88Å; K223-F225 WeakPolarHBondContact O-CD2 3.29Å; K223-F225 WeakPolarHBondContact O-CE2 3.36Å
224	A	87.3	Confident	83.8	Confident	30 Å²	30	68 Å²	68	25%	0.248	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	146.9	-179.1	0	0	0	0	0	113.6	K214 Y216 E217 G222	K214-A224 HydrophobicContact CB-CB 3.45Å; K214-A224 VanDerWaalsContact CB-CB 3.45Å; K214-A224 HydrophobicContact CD-CB 4.1Å; K214-A224 WeakPolarHBondContact CD-O 3.45Å; K214-A224 HydrophobicContact CG-CB 4.39Å; Y216-A224 CarbonylContact O-C 3.53Å; Y216-A224 WeakPolarHBondContact O-CA 3.23Å; E217-A224 HydrophobicContact CB-CB 4.46Å; E217-A224 HydrophobicContact CG-CB 4.44Å; G222-A224 PolarHBondContact O-N 3.37Å
225	F	83.8	Confident	83.6	Confident	31 Å²	31	65.9 Å²	65.9	14%	0.136	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152	-176.7	-60.2	-88.8	0	0	0	111.7	K214 Y216 C218 K223 N227 N230 L231 H234	K214-F225 CarbonylContact C-O 3.27Å; K214-F225 VanDerWaalsContact C-O 3.28Å; K214-F225 VanDerWaalsContact CA-O 3.31Å; K214-F225 WeakPolarHBondContact CA-O 3.41Å; Y216-F225 PolarHBondContact N-O 2.87Å; Y216-F225 PolarHBondContact O-N 2.84Å; C218-F225 HydrophobicContact CB-CE2 4.33Å; K223-F225 HydrophobicContact CB-CE2 4.18Å; K223-F225 HydrophobicContact CB-CZ 4.34Å; K223-F225 HydrophobicContact CD-CZ 3.93Å; K223-F225 HydrophobicContact CG-CE2 4.1Å; K223-F225 HydrophobicContact CG-CZ 3.88Å; K223-F225 WeakPolarHBondContact O-CD2 3.29Å; K223-F225 WeakPolarHBondContact O-CE2 3.36Å; F225-N227 VanDerWaalsContact C-N 3.34Å; F225-N230 HydrophobicContact CB-CB 4.28Å; F225-N230 HydrophobicContact CD1-CB 3.83Å; F225-N230 HydrophobicContact CG-CB 4.28Å; F225-L231 HydrophobicContact CB-CB 4.4Å; F225-L231 HydrophobicContact CD2-CB 3.93Å; F225-L231 HydrophobicContact CD2-CD1 3.84Å; F225-L231 HydrophobicContact CD2-CG 4.5Å; F225-L231 HydrophobicContact CE2-CD1 4.02Å; F225-L231 HydrophobicContact CG-CB 4.33Å; F225-H234 HydrophobicContact CE1-CB 3.94Å; F225-H234 HydrophobicContact CE2-CB 3.76Å; F225-H234 AromaticContact CE2-CD2 3.5Å; F225-H234 VanDerWaalsContact CE2-CD2 3.5Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.38Å; F225-H234 AromaticContact CE2-CG 3.62Å; F225-H234 HydrophobicContact CZ-CB 3.33Å; F225-H234 AromaticContact CZ-CD2 3.51Å; F225-H234 AromaticContact CZ-CG 3.19Å; F225-H234 AromaticContact CZ-ND1 3.68Å
226	T	80.6	Confident	83.8	Confident	28 Å²	28	64.8 Å²	64.8	17%	0.172	33%	0.328	C	S	.	.	S	Bend	trans	-78.7	-16.8	179.7	54.9	0	0	0	0	113.5	R208 K214	R208-T226 HydrophobicContact CB-CG2 4.16Å; R208-T226 PolarHBondContact NH1-O 3.39Å; K214-T226 HydrophobicContact CG-CG2 4.01Å
227	N	79.4	Confident	83.9	Confident	35 Å²	35	65.9 Å²	65.9	19%	0.187	34%	0.338	C	S	.	.	S	Bend	trans	-140.9	156.3	177.6	73.4	27.3	0	0	0	111.5	Y216 F225 Y229 N230 L231	Y216-N227 VanDerWaalsContact CD2-CA 3.43Å; F225-N227 VanDerWaalsContact C-N 3.34Å; N227-Y229 PolarHBondContact OD1-N 3.44Å; N227-N230 PolarHBondContact ND2-ND2 3.05Å; N227-N230 WeakPolarHBondContact OD1-CA 3.39Å; N227-N230 WeakPolarHBondContact OD1-CB 3.49Å; N227-N230 PolarHBondContact OD1-N 3.29Å; N227-N230 PolarHBondContact OD1-ND2 3.21Å; N227-N230 VanDerWaalsContact OD1-ND2 3.14Å; N227-N230 PolarHBondContact OD1-OD1 3.02Å; N227-L231 PolarHBondContact O-N 3.27Å
228	C	77.5	Confident	83.9	Confident	65 Å²	65	63.8 Å²	63.8	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-69.2	-32.8	-179.6	59.7	0	0	0	0	113.2	Y216 N230 L231 I232	Y216-C228 HydrophobicContact CD1-CB 3.78Å; Y216-C228 HydrophobicContact CE1-CB 3.66Å; Y216-C228 HydrophobicContact CG-CB 4.34Å; C228-N230 PolarHBondContact O-N 2.95Å; C228-L231 WeakPolarHBondContact O-CB 3.47Å; C228-L231 PolarHBondContact O-N 3.42Å; C228-I232 WeakPolarHBondContact O-CG1 3.2Å; C228-I232 PolarHBondContact O-N 3.29Å
229	Y	78.8	Confident	83.7	Confident	133 Å²	133	67.7 Å²	67.7	52%	0.522	35%	0.352	S	S	.	.	H	α-helix	trans	-60.9	-46.1	-180	175.8	-100.1	0	0	0	111.5	N227 L231 I232 Q233	N227-Y229 PolarHBondContact OD1-N 3.44Å; Y229-L231 VanDerWaalsContact C-N 3.3Å; Y229-L231 PolarHBondContact O-N 3.08Å; Y229-I232 PolarHBondContact O-N 3.42Å; Y229-Q233 HydrophobicContact CD1-CG 4.14Å; Y229-Q233 HydrophobicContact CE1-CG 3.7Å; Y229-Q233 HydrophobicContact CE2-CG 4.15Å; Y229-Q233 WeakPolarHBondContact O-CG 3.27Å; Y229-Q233 PolarHBondContact O-N 3.34Å
230	N	84	Confident	83.6	Confident	64 Å²	64	60.5 Å²	60.5	34%	0.342	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-35.7	178.3	-67.3	-13.1	0	0	0	111.5	F225 N227 C228 Q233 H234	F225-N230 HydrophobicContact CB-CB 4.28Å; F225-N230 HydrophobicContact CD1-CB 3.83Å; F225-N230 HydrophobicContact CG-CB 4.28Å; N227-N230 PolarHBondContact ND2-ND2 3.05Å; N227-N230 WeakPolarHBondContact OD1-CA 3.39Å; N227-N230 WeakPolarHBondContact OD1-CB 3.49Å; N227-N230 PolarHBondContact OD1-N 3.29Å; N227-N230 PolarHBondContact OD1-ND2 3.21Å; N227-N230 VanDerWaalsContact OD1-ND2 3.14Å; N227-N230 PolarHBondContact OD1-OD1 3.02Å; C228-N230 PolarHBondContact O-N 2.95Å; N230-Q233 PolarHBondContact O-N 3.1Å; N230-H234 VanDerWaalsContact O-CB 3.26Å; N230-H234 WeakPolarHBondContact O-CB 3.43Å; N230-H234 PolarHBondContact O-N 3.04Å
231	L	83.9	Confident	83.6	Confident	22 Å²	22	60.9 Å²	60.9	12%	0.115	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-49.2	172.6	172.3	62	0	0	0	111	C218 F225 N227 C228 Y229 Q233 H234 Q235	C218-L231 HydrophobicContact CB-CD1 3.59Å; F225-L231 HydrophobicContact CB-CB 4.4Å; F225-L231 HydrophobicContact CD2-CB 3.93Å; F225-L231 HydrophobicContact CD2-CD1 3.84Å; F225-L231 HydrophobicContact CD2-CG 4.5Å; F225-L231 HydrophobicContact CE2-CD1 4.02Å; F225-L231 HydrophobicContact CG-CB 4.33Å; N227-L231 PolarHBondContact O-N 3.27Å; C228-L231 WeakPolarHBondContact O-CB 3.47Å; C228-L231 PolarHBondContact O-N 3.42Å; Y229-L231 VanDerWaalsContact C-N 3.3Å; Y229-L231 PolarHBondContact O-N 3.08Å; L231-Q233 VanDerWaalsContact C-N 3.3Å; L231-Q233 PolarHBondContact O-N 3.49Å; L231-H234 WeakPolarHBondContact O-CB 3.4Å; L231-H234 PolarHBondContact O-N 3.43Å; L231-H234 VanDerWaalsContact O-N 3.08Å; L231-Q235 HydrophobicContact CD1-CG 4.23Å; L231-Q235 WeakPolarHBondContact O-CG 3.25Å; L231-Q235 PolarHBondContact O-N 2.87Å
232	I	79.8	Confident	83.6	Confident	88 Å²	88	63.8 Å²	63.8	45%	0.451	34%	0.338	S	S	.	.	H	α-helix	trans	-60	-42.1	177.5	-66.5	166.4	0	0	0	110.8	C228 Y229 H234 Q235	C228-I232 WeakPolarHBondContact O-CG1 3.2Å; C228-I232 PolarHBondContact O-N 3.29Å; Y229-I232 PolarHBondContact O-N 3.42Å; I232-H234 VanDerWaalsContact C-N 3.32Å; I232-H234 PolarHBondContact O-N 3.13Å; I232-Q235 PolarHBondContact O-N 3Å
233	Q	81.2	Confident	83.7	Confident	6 Å²	6	65.4 Å²	65.4	3%	0.028	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-37.2	175.6	-66	-48.1	-62.7	0	0	112.2	Y229 N230 L231 R236 Y255	Y229-Q233 HydrophobicContact CD1-CG 4.14Å; Y229-Q233 HydrophobicContact CE1-CG 3.7Å; Y229-Q233 HydrophobicContact CE2-CG 4.15Å; Y229-Q233 WeakPolarHBondContact O-CG 3.27Å; Y229-Q233 PolarHBondContact O-N 3.34Å; N230-Q233 PolarHBondContact O-N 3.1Å; L231-Q233 VanDerWaalsContact C-N 3.3Å; L231-Q233 PolarHBondContact O-N 3.49Å; Q233-R236 WeakPolarHBondContact O-CB 3.5Å; Q233-R236 PolarHBondContact O-N 3.09Å; Q233-Y255 HydrophobicContact CB-CE1 3.93Å; Q233-Y255 HydrophobicContact CG-CE1 3.92Å
234	H	87	Confident	83.8	Confident	21 Å²	21	63.1 Å²	63.1	10%	0.097	33%	0.33	C	S	.	.	H	α-helix	trans	-67.5	-40.8	176.9	174.2	68.3	0	0	0	112.3	C221 F225 N230 L231 I232 R236 I237 H238	C221-H234 PolarHBondContact SG-NE2 3.33Å; F225-H234 HydrophobicContact CE1-CB 3.94Å; F225-H234 HydrophobicContact CE2-CB 3.76Å; F225-H234 AromaticContact CE2-CD2 3.5Å; F225-H234 VanDerWaalsContact CE2-CD2 3.5Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.38Å; F225-H234 AromaticContact CE2-CG 3.62Å; F225-H234 HydrophobicContact CZ-CB 3.33Å; F225-H234 AromaticContact CZ-CD2 3.51Å; F225-H234 AromaticContact CZ-CG 3.19Å; F225-H234 AromaticContact CZ-ND1 3.68Å; N230-H234 VanDerWaalsContact O-CB 3.26Å; N230-H234 WeakPolarHBondContact O-CB 3.43Å; N230-H234 PolarHBondContact O-N 3.04Å; L231-H234 WeakPolarHBondContact O-CB 3.4Å; L231-H234 PolarHBondContact O-N 3.43Å; L231-H234 VanDerWaalsContact O-N 3.08Å; I232-H234 VanDerWaalsContact C-N 3.32Å; I232-H234 PolarHBondContact O-N 3.13Å; H234-R236 PolarHBondContact O-N 3.13Å; H234-R236 VanDerWaalsContact O-N 3.12Å; H234-I237 VanDerWaalsContact O-CB 3.24Å; H234-I237 WeakPolarHBondContact O-CB 3.39Å; H234-I237 WeakPolarHBondContact O-CG1 3.47Å; H234-I237 PolarHBondContact O-N 2.97Å; H234-H238 AromaticContact CD2-NE2 3.96Å; H234-H238 AromaticContact CE1-NE2 3.96Å; H234-H238 AromaticContact NE2-NE2 3.26Å; H234-H238 PolarHBondContact NE2-NE2 3.39Å
235	Q	83.3	Confident	83.9	Confident	69 Å²	69	64.2 Å²	64.2	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-57	-28.4	178.8	-76.6	175.9	-44.6	0	0	112.8	L231 I232 I237 H238 T239	L231-Q235 HydrophobicContact CD1-CG 4.23Å; L231-Q235 WeakPolarHBondContact O-CG 3.25Å; L231-Q235 PolarHBondContact O-N 2.87Å; I232-Q235 PolarHBondContact O-N 3Å; Q235-I237 PolarHBondContact O-N 3.3Å; Q235-I237 VanDerWaalsContact O-N 3.09Å; Q235-H238 PolarHBondContact O-N 3.04Å; Q235-T239 PolarHBondContact O-N 3.33Å; Q235-T239 PolarHBondContact O-OG1 3.2Å
236	R	86.6	Confident	84.3	Confident	40 Å²	40	62.9 Å²	62.9	15%	0.151	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-19.9	173.3	-62.7	179.7	180	176.5	-2.3	114	Q233 H234 T239 G240 E241 N254	Q233-R236 WeakPolarHBondContact O-CB 3.5Å; Q233-R236 PolarHBondContact O-N 3.09Å; H234-R236 PolarHBondContact O-N 3.13Å; H234-R236 VanDerWaalsContact O-N 3.12Å; R236-T239 WeakPolarHBondContact CA-OG1 3.41Å; R236-G240 WeakPolarHBondContact O-CA 3.41Å; R236-G240 PolarHBondContact O-N 3.2Å; R236-G240 VanDerWaalsContact O-N 3.1Å; R236-E241 HydrophobicContact CG-CB 4.49Å; R236-E241 PolarHBondContact O-N 3.39Å; R236-N254 PolarHBondContact NH1-O 3.21Å
237	I	85.9	Confident	84.8	Confident	102 Å²	102	70 Å²	70	52%	0.523	36%	0.364	S	S	.	.	H	α-helix	trans	-72.3	-37.1	174.8	-62.3	168.9	0	0	0	110.3	H234 Q235	H234-I237 VanDerWaalsContact O-CB 3.24Å; H234-I237 WeakPolarHBondContact O-CB 3.39Å; H234-I237 WeakPolarHBondContact O-CG1 3.47Å; H234-I237 PolarHBondContact O-N 2.97Å; Q235-I237 PolarHBondContact O-N 3.3Å; Q235-I237 VanDerWaalsContact O-N 3.09Å
238	H	85.5	Confident	85.3	Confident	78 Å²	78	74 Å²	74	36%	0.361	38%	0.382	S	S	.	.	H	α-helix	trans	-80.2	-43	-179.5	-58.5	-48.9	0	0	0	111.7	C218 D220 C221 H234 Q235 G240	C218-H238 VanDerWaalsContact SG-CD2 3.54Å; C218-H238 PolarHBondContact SG-NE2 3.17Å; C218-H238 VanDerWaalsContact SG-NE2 3.37Å; D220-H238 IonicContact OD2-CD2 3.1Å; D220-H238 PolarHBondContact OD2-CD2 3.24Å; D220-H238 IonicContact OD2-CG 3.74Å; C221-H238 PolarHBondContact SG-NE2 2.82Å; C221-H238 VanDerWaalsContact SG-NE2 3.38Å; H234-H238 AromaticContact CD2-NE2 3.96Å; H234-H238 AromaticContact CE1-NE2 3.96Å; H234-H238 AromaticContact NE2-NE2 3.26Å; H234-H238 PolarHBondContact NE2-NE2 3.39Å; Q235-H238 PolarHBondContact O-N 3.04Å; H238-G240 PolarHBondContact O-N 3.29Å
239	T	83.8	Confident	85.9	Confident	83 Å²	83	73.5 Å²	73.5	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-75.4	-16.3	178.2	63.2	0	0	0	0	113	Q235 R236 E241	Q235-T239 PolarHBondContact O-N 3.33Å; Q235-T239 PolarHBondContact O-OG1 3.2Å; R236-T239 WeakPolarHBondContact CA-OG1 3.41Å; T239-E241 PolarHBondContact O-N 3.47Å; T239-E241 WeakPolarHBondContact OG1-CB 3.44Å; T239-E241 WeakPolarHBondContact OG1-CG 3.24Å; T239-E241 PolarHBondContact OG1-N 2.77Å
240	G	84.8	Confident	86.4	Confident	47 Å²	47	69.9 Å²	69.9	49%	0.485	38%	0.382	S	S	.	.			trans	69.1	4.9	-173.5	0	0	0	0	0	113.9	R236 H238 K242	R236-G240 WeakPolarHBondContact O-CA 3.41Å; R236-G240 PolarHBondContact O-N 3.2Å; R236-G240 VanDerWaalsContact O-N 3.1Å; H238-G240 PolarHBondContact O-N 3.29Å; G240-K242 PolarHBondContact O-N 3.12Å
241	E	83.6	Confident	86.7	Confident	114 Å²	114	72.8 Å²	72.8	53%	0.533	39%	0.391	S	S	.	.			trans	-59.6	125.7	-179.9	-77.5	-177.7	-175.7	0	0	111.3	R236 T239	R236-E241 HydrophobicContact CG-CB 4.49Å; R236-E241 PolarHBondContact O-N 3.39Å; T239-E241 PolarHBondContact O-N 3.47Å; T239-E241 WeakPolarHBondContact OG1-CB 3.44Å; T239-E241 WeakPolarHBondContact OG1-CG 3.24Å; T239-E241 PolarHBondContact OG1-N 2.77Å
242	K	87.9	Confident	87	Confident	126 Å²	126	73.9 Å²	73.9	55%	0.548	40%	0.401	S	S	.	.			trans	-127	79.8	177.2	-71	166.3	175.2	-174.4	0	109.3	G240 Y244 S252 F253	G240-K242 PolarHBondContact O-N 3.12Å; K242-Y244 PolarHBondContact O-N 3.22Å; K242-S252 VanDerWaalsContact CB-CB 3.43Å; K242-S252 WeakPolarHBondContact CD-O 2.91Å; K242-S252 WeakPolarHBondContact O-CB 3.14Å; K242-F253 CarbonylContact C-O 3.48Å; K242-F253 VanDerWaalsContact C-O 3.29Å; K242-F253 WeakPolarHBondContact CA-O 3.2Å
243	P	86	Confident	87.5	Confident	74 Å²	74	71.8 Å²	71.8	48%	0.481	39%	0.389	S	S	.	.			trans	-65.2	-15.5	-171.6	-22.6	34.5	0	0	0	114.4
244	Y	89.2	Confident	87.7	Confident	70 Å²	70	73.5 Å²	73.5	28%	0.275	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	88.9	-172.9	-53.4	-71.7	0	0	0	110.1	K242 S252 F253 N254 S256	K242-Y244 PolarHBondContact O-N 3.22Å; Y244-S252 CarbonylContact O-C 3.35Å; Y244-S252 WeakPolarHBondContact O-CA 3.49Å; Y244-F253 WeakPolarHBondContact CD2-O 3.23Å; Y244-F253 PolarHBondContact N-O 2.72Å; Y244-F253 VanDerWaalsContact N-O 3.17Å; Y244-F253 PolarHBondContact O-N 2.86Å; Y244-N254 WeakPolarHBondContact CE2-O 3.46Å; Y244-S256 VanDerWaalsContact CD2-N 3.33Å
245	A	89.8	Confident	87.5	Confident	53 Å²	53	76 Å²	76	44%	0.438	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	143.2	177.1	0	0	0	0	0	112.3	L259	A245-L259 WeakPolarHBondContact O-CD2 3.33Å
246	C	92.3	Very high	87.7	Confident	2 Å²	2	76 Å²	76	1%	0.014	42%	0.415	C	S	.	.			trans	-87.5	119.1	167.3	-179.2	0	0	0	0	109.3	E248 G250 K251 L259	C246-E248 VanDerWaalsContact C-N 3.26Å; C246-E248 PolarHBondContact O-N 3.25Å; C246-G250 WeakPolarHBondContact O-CA 3.4Å; C246-G250 PolarHBondContact O-N 3.14Å; C246-K251 VanDerWaalsContact CB-O 3.3Å; C246-K251 WeakPolarHBondContact CB-O 3.44Å; C246-K251 PolarHBondContact N-O 3Å; C246-L259 HydrophobicContact CB-CD1 3.65Å
247	E	91.3	Very high	87.7	Confident	177 Å²	177	77.5 Å²	77.5	83%	0.827	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-28.9	-180	-67.9	166	177.6	0	0	112.6
248	E	89.3	Confident	87.9	Confident	119 Å²	119	76.2 Å²	76.2	56%	0.556	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-28.9	-175.7	-63.5	178.9	-135.2	0	0	114.2	C246 H266	C246-E248 VanDerWaalsContact C-N 3.26Å; C246-E248 PolarHBondContact O-N 3.25Å; E248-H266 WeakPolarHBondContact OE2-CB 3.32Å; E248-H266 IonicContact OE2-CD2 3.42Å; E248-H266 IonicContact OE2-CG 3.94Å; E248-H266 IonicContact OE2-ND1 3.15Å; E248-H266 PolarHBondContact OE2-ND1 3.35Å
249	C	90.5	Very high	88.1	Confident	55 Å²	55	73.6 Å²	73.6	37%	0.372	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	6.8	-178.3	69.9	0	0	0	0	115	K251 H262 H266	C249-K251 PolarHBondContact O-N 3.22Å; C249-H262 PolarHBondContact SG-NE2 3.23Å; C249-H266 PolarHBondContact SG-NE2 3.22Å
250	G	88.4	Confident	88.4	Confident	57 Å²	57	76.7 Å²	76.7	59%	0.588	42%	0.418	S	S	*	.			trans	67.5	1.3	-179.7	0	0	0	0	0	115.1	C246 S252	C246-G250 WeakPolarHBondContact O-CA 3.4Å; C246-G250 PolarHBondContact O-N 3.14Å; G250-S252 PolarHBondContact O-N 3.11Å
251	K	90.9	Very high	88.6	Confident	125 Å²	125	76.8 Å²	76.8	54%	0.543	41%	0.406	S	S	.	.			trans	-72.3	127.5	-179	-73.5	-180	-178.1	170.6	0	111.1	C246 C249 F253	C246-K251 VanDerWaalsContact CB-O 3.3Å; C246-K251 WeakPolarHBondContact CB-O 3.44Å; C246-K251 PolarHBondContact N-O 3Å; C249-K251 PolarHBondContact O-N 3.22Å; K251-F253 HydrophobicContact CB-CE2 4.08Å; K251-F253 HydrophobicContact CB-CZ 4.17Å; K251-F253 WeakPolarHBondContact O-CE2 2.81Å
252	S	91.1	Very high	89	Confident	46 Å²	46	72.4 Å²	72.4	32%	0.322	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.9	-179.5	-52.5	0	0	0	0	113.3	K242 Y244 G250	K242-S252 VanDerWaalsContact CB-CB 3.43Å; K242-S252 WeakPolarHBondContact CD-O 2.91Å; K242-S252 WeakPolarHBondContact O-CB 3.14Å; Y244-S252 CarbonylContact O-C 3.35Å; Y244-S252 WeakPolarHBondContact O-CA 3.49Å; G250-S252 PolarHBondContact O-N 3.11Å
253	F	88.8	Confident	89.1	Confident	44 Å²	44	70.2 Å²	70.2	19%	0.193	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153	-177.2	-57.3	-89	0	0	0	111.4	K242 Y244 K251 H258 L259 H262	K242-F253 CarbonylContact C-O 3.48Å; K242-F253 VanDerWaalsContact C-O 3.29Å; K242-F253 WeakPolarHBondContact CA-O 3.2Å; Y244-F253 WeakPolarHBondContact CD2-O 3.23Å; Y244-F253 PolarHBondContact N-O 2.72Å; Y244-F253 VanDerWaalsContact N-O 3.17Å; Y244-F253 PolarHBondContact O-N 2.86Å; K251-F253 HydrophobicContact CB-CE2 4.08Å; K251-F253 HydrophobicContact CB-CZ 4.17Å; K251-F253 WeakPolarHBondContact O-CE2 2.81Å; F253-H258 HydrophobicContact CB-CB 4.14Å; F253-H258 HydrophobicContact CD1-CB 3.93Å; F253-H258 HydrophobicContact CG-CB 4.23Å; F253-L259 HydrophobicContact CB-CB 4.42Å; F253-L259 HydrophobicContact CD2-CB 3.93Å; F253-L259 HydrophobicContact CD2-CD1 3.84Å; F253-L259 HydrophobicContact CE2-CD1 4.02Å; F253-L259 HydrophobicContact CG-CB 4.4Å; F253-H262 HydrophobicContact CE1-CB 4.05Å; F253-H262 HydrophobicContact CE2-CB 3.72Å; F253-H262 AromaticContact CE2-CD2 3.4Å; F253-H262 WeakPolarHBondContact CE2-CD2 3.45Å; F253-H262 AromaticContact CE2-CG 3.53Å; F253-H262 HydrophobicContact CZ-CB 3.42Å; F253-H262 VanDerWaalsContact CZ-CB 3.42Å; F253-H262 AromaticContact CZ-CD2 3.51Å; F253-H262 AromaticContact CZ-CG 3.19Å; F253-H262 AromaticContact CZ-ND1 3.6Å
254	N	86.2	Confident	89.3	Confident	42 Å²	42	68.7 Å²	68.7	23%	0.225	36%	0.36	C	S	.	.	S	Bend	trans	-82.5	-19.2	176.4	55.3	-11	0	0	0	113.5	R236 Y244	R236-N254 PolarHBondContact NH1-O 3.21Å; Y244-N254 WeakPolarHBondContact CE2-O 3.46Å
255	Y	83.3	Confident	89.4	Confident	74 Å²	74	70.4 Å²	70.4	29%	0.29	37%	0.373	S	S	.	.	S	Bend	trans	-125.3	140.7	176.8	-62.2	-82.8	0	0	0	111.5	Q233 S257 H258 L259	Q233-Y255 HydrophobicContact CB-CE1 3.93Å; Q233-Y255 HydrophobicContact CG-CE1 3.92Å; Y255-S257 VanDerWaalsContact C-N 3.3Å; Y255-S257 PolarHBondContact O-N 2.79Å; Y255-H258 AromaticContact CD2-CE1 3.47Å; Y255-H258 VanDerWaalsContact CD2-CE1 3.47Å; Y255-H258 WeakPolarHBondContact CD2-CE1 3.36Å; Y255-H258 AromaticContact CD2-ND1 3.55Å; Y255-H258 PolarHBondContact O-N 3.43Å; Y255-L259 PolarHBondContact O-N 2.94Å
256	S	86.3	Confident	89.4	Confident	69 Å²	69	71.2 Å²	71.2	48%	0.483	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-33.4	176.5	59.6	0	0	0	0	112.6	Y244 H258 L259 K260	Y244-S256 VanDerWaalsContact CD2-N 3.33Å; S256-H258 VanDerWaalsContact C-N 3.32Å; S256-H258 PolarHBondContact O-N 3.22Å; S256-L259 PolarHBondContact O-N 3.18Å; S256-K260 PolarHBondContact O-N 3.43Å
257	S	86.8	Confident	89.2	Confident	70 Å²	70	75.8 Å²	75.8	49%	0.49	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-39.7	174.4	53.4	0	0	0	0	112	Y255 K260 Q261	Y255-S257 VanDerWaalsContact C-N 3.3Å; Y255-S257 PolarHBondContact O-N 2.79Å; S257-K260 PolarHBondContact O-N 2.8Å; S257-Q261 WeakPolarHBondContact O-CB 3.41Å; S257-Q261 PolarHBondContact O-N 3.42Å
258	H	89.8	Confident	89.1	Confident	76 Å²	76	69.6 Å²	69.6	35%	0.352	38%	0.379	S	S	.	.	H	α-helix	trans	-68.2	-40.3	176.2	-65.6	171.5	0	0	0	111.7	F253 Y255 S256 Q261 H262	F253-H258 HydrophobicContact CB-CB 4.14Å; F253-H258 HydrophobicContact CD1-CB 3.93Å; F253-H258 HydrophobicContact CG-CB 4.23Å; Y255-H258 AromaticContact CD2-CE1 3.47Å; Y255-H258 VanDerWaalsContact CD2-CE1 3.47Å; Y255-H258 WeakPolarHBondContact CD2-CE1 3.36Å; Y255-H258 AromaticContact CD2-ND1 3.55Å; Y255-H258 PolarHBondContact O-N 3.43Å; S256-H258 VanDerWaalsContact C-N 3.32Å; S256-H258 PolarHBondContact O-N 3.22Å; H258-Q261 PolarHBondContact O-N 3.12Å; H258-H262 VanDerWaalsContact O-CB 3.26Å; H258-H262 WeakPolarHBondContact O-CB 3.49Å; H258-H262 PolarHBondContact O-N 2.97Å
259	L	91.3	Very high	89.1	Confident	23 Å²	23	68.6 Å²	68.6	12%	0.12	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-46.3	172.1	174.2	62.6	0	0	0	111	A245 C246 F253 Y255 S256 Q261 H262 K263	A245-L259 WeakPolarHBondContact O-CD2 3.33Å; C246-L259 HydrophobicContact CB-CD1 3.65Å; F253-L259 HydrophobicContact CB-CB 4.42Å; F253-L259 HydrophobicContact CD2-CB 3.93Å; F253-L259 HydrophobicContact CD2-CD1 3.84Å; F253-L259 HydrophobicContact CE2-CD1 4.02Å; F253-L259 HydrophobicContact CG-CB 4.4Å; Y255-L259 PolarHBondContact O-N 2.94Å; S256-L259 PolarHBondContact O-N 3.18Å; L259-Q261 VanDerWaalsContact C-N 3.33Å; L259-Q261 PolarHBondContact O-N 3.14Å; L259-H262 WeakPolarHBondContact O-CB 3.48Å; L259-H262 PolarHBondContact O-N 3.25Å; L259-H262 VanDerWaalsContact O-N 3.12Å; L259-K263 HydrophobicContact CD1-CG 4.33Å; L259-K263 WeakPolarHBondContact O-CG 3.36Å; L259-K263 PolarHBondContact O-N 3.14Å
260	K	88.6	Confident	89.2	Confident	147 Å²	147	71.7 Å²	71.7	64%	0.639	38%	0.382	S	S	*	.	H	α-helix	trans	-59.7	-44.1	177.7	-175.2	175.6	-178.5	176	0	111.8	S256 S257 H262 K263	S256-K260 PolarHBondContact O-N 3.43Å; S257-K260 PolarHBondContact O-N 2.8Å; K260-H262 VanDerWaalsContact C-N 3.33Å; K260-K263 PolarHBondContact O-N 3.38Å
261	Q	89.6	Confident	89.3	Confident	50 Å²	50	71.8 Å²	71.8	23%	0.234	37%	0.372	C	S	.	.	H	α-helix	trans	-62.9	-40.7	174.6	-178.8	-173.5	11.4	0	0	111.7	S257 H258 L259 R264 C283	S257-Q261 WeakPolarHBondContact O-CB 3.41Å; S257-Q261 PolarHBondContact O-N 3.42Å; H258-Q261 PolarHBondContact O-N 3.12Å; L259-Q261 VanDerWaalsContact C-N 3.33Å; L259-Q261 PolarHBondContact O-N 3.14Å; Q261-R264 VanDerWaalsContact O-CB 3.26Å; Q261-R264 WeakPolarHBondContact O-CB 3.45Å; Q261-R264 PolarHBondContact O-N 3.34Å; Q261-C283 PolarHBondContact NE2-SG 2.92Å
262	H	91.7	Very high	89.4	Confident	21 Å²	21	69.5 Å²	69.5	10%	0.097	36%	0.36	C	S	.	.	H	α-helix	trans	-64.7	-40.4	178.6	174.1	68.2	0	0	0	112.5	C249 F253 H258 L259 K260 R264 I265 H266	C249-H262 PolarHBondContact SG-NE2 3.23Å; F253-H262 HydrophobicContact CE1-CB 4.05Å; F253-H262 HydrophobicContact CE2-CB 3.72Å; F253-H262 AromaticContact CE2-CD2 3.4Å; F253-H262 WeakPolarHBondContact CE2-CD2 3.45Å; F253-H262 AromaticContact CE2-CG 3.53Å; F253-H262 HydrophobicContact CZ-CB 3.42Å; F253-H262 VanDerWaalsContact CZ-CB 3.42Å; F253-H262 AromaticContact CZ-CD2 3.51Å; F253-H262 AromaticContact CZ-CG 3.19Å; F253-H262 AromaticContact CZ-ND1 3.6Å; H258-H262 VanDerWaalsContact O-CB 3.26Å; H258-H262 WeakPolarHBondContact O-CB 3.49Å; H258-H262 PolarHBondContact O-N 2.97Å; L259-H262 WeakPolarHBondContact O-CB 3.48Å; L259-H262 PolarHBondContact O-N 3.25Å; L259-H262 VanDerWaalsContact O-N 3.12Å; K260-H262 VanDerWaalsContact C-N 3.33Å; H262-R264 PolarHBondContact O-N 3.32Å; H262-I265 VanDerWaalsContact O-CB 3.27Å; H262-I265 WeakPolarHBondContact O-CB 3.39Å; H262-I265 WeakPolarHBondContact O-CG1 3.3Å; H262-I265 PolarHBondContact O-N 3.23Å; H262-H266 AromaticContact CE1-NE2 3.96Å; H262-H266 AromaticContact NE2-NE2 3.4Å; H262-H266 PolarHBondContact NE2-NE2 3.33Å
263	K	90.1	Very high	89.4	Confident	80 Å²	80	73.8 Å²	73.8	35%	0.348	37%	0.373	S	S	.	.	H	α-helix	trans	-56.3	-23	174.9	-73	-169.3	175.6	-160	0	113.3	L259 K260 I265 H266 T267	L259-K263 HydrophobicContact CD1-CG 4.33Å; L259-K263 WeakPolarHBondContact O-CG 3.36Å; L259-K263 PolarHBondContact O-N 3.14Å; K260-K263 PolarHBondContact O-N 3.38Å; K263-I265 PolarHBondContact O-N 2.84Å; K263-H266 PolarHBondContact O-N 3.46Å; K263-T267 PolarHBondContact O-N 3.26Å; K263-T267 PolarHBondContact O-OG1 3.02Å
264	R	91.4	Very high	89.6	Confident	43 Å²	43	71.7 Å²	71.7	16%	0.162	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-21.1	172.8	-61.3	-176.8	168.1	157.9	-1.6	114.2	Q261 H262 H266 T267 G268 E269 N282	Q261-R264 VanDerWaalsContact O-CB 3.26Å; Q261-R264 WeakPolarHBondContact O-CB 3.45Å; Q261-R264 PolarHBondContact O-N 3.34Å; H262-R264 PolarHBondContact O-N 3.32Å; R264-H266 VanDerWaalsContact C-N 3.34Å; R264-T267 WeakPolarHBondContact CA-OG1 3.38Å; R264-G268 CarbonylContact O-C 3.2Å; R264-G268 WeakPolarHBondContact O-CA 3.33Å; R264-G268 PolarHBondContact O-N 3.18Å; R264-E269 HydrophobicContact CB-CB 4.34Å; R264-E269 HydrophobicContact CG-CB 4.33Å; R264-E269 IonicContact NE-OE2 3.29Å; R264-E269 PolarHBondContact NE-OE2 3.23Å; R264-E269 PolarHBondContact O-N 3.41Å; R264-N282 HydrophobicContact CB-CB 4.07Å; R264-N282 WeakPolarHBondContact CD-O 3.49Å; R264-N282 PolarHBondContact NH1-O 2.94Å
265	I	89.8	Confident	89.9	Confident	105 Å²	105	77.8 Å²	77.8	54%	0.538	39%	0.391	S	S	.	.	H	α-helix	trans	-69.3	-39.3	175.6	-60.4	177.7	0	0	0	110	H262 K263	H262-I265 VanDerWaalsContact O-CB 3.27Å; H262-I265 WeakPolarHBondContact O-CB 3.39Å; H262-I265 WeakPolarHBondContact O-CG1 3.3Å; H262-I265 PolarHBondContact O-N 3.23Å; K263-I265 PolarHBondContact O-N 2.84Å
266	H	89.9	Confident	90.2	Very high	71 Å²	71	79.3 Å²	79.3	33%	0.329	41%	0.408	S	S	.	.	H	α-helix	trans	-73.2	-44.4	-180	-65.2	-67.3	0	0	0	112.7	E248 C249 H262 K263 R264 G268	E248-H266 WeakPolarHBondContact OE2-CB 3.32Å; E248-H266 IonicContact OE2-CD2 3.42Å; E248-H266 IonicContact OE2-CG 3.94Å; E248-H266 IonicContact OE2-ND1 3.15Å; E248-H266 PolarHBondContact OE2-ND1 3.35Å; C249-H266 PolarHBondContact SG-NE2 3.22Å; H262-H266 AromaticContact CE1-NE2 3.96Å; H262-H266 AromaticContact NE2-NE2 3.4Å; H262-H266 PolarHBondContact NE2-NE2 3.33Å; K263-H266 PolarHBondContact O-N 3.46Å; R264-H266 VanDerWaalsContact C-N 3.34Å; H266-G268 VanDerWaalsContact C-N 3.25Å; H266-G268 PolarHBondContact O-N 2.99Å
267	T	88.6	Confident	90.4	Very high	97 Å²	97	78.6 Å²	78.6	60%	0.595	40%	0.402	S	S	*	.	H	α-helix	trans	-76.2	-12.8	178.2	53.9	0	0	0	0	113.4	K263 R264 E269	K263-T267 PolarHBondContact O-N 3.26Å; K263-T267 PolarHBondContact O-OG1 3.02Å; R264-T267 WeakPolarHBondContact CA-OG1 3.38Å; T267-E269 PolarHBondContact O-N 3.07Å
268	G	88.4	Confident	90.5	Very high	47 Å²	47	78 Å²	78	49%	0.485	41%	0.408	S	S	.	.			trans	69.9	5.5	-173.2	0	0	0	0	0	114.5	R264 H266 K270	R264-G268 CarbonylContact O-C 3.2Å; R264-G268 WeakPolarHBondContact O-CA 3.33Å; R264-G268 PolarHBondContact O-N 3.18Å; H266-G268 VanDerWaalsContact C-N 3.25Å; H266-G268 PolarHBondContact O-N 2.99Å; G268-K270 PolarHBondContact O-N 2.87Å
269	E	90.6	Very high	90.6	Very high	98 Å²	98	80.6 Å²	80.6	46%	0.458	42%	0.418	S	S	.	.			trans	-61	121.5	-178.2	-164.7	-160.6	175	0	0	110.8	R264 T267 P271	R264-E269 HydrophobicContact CB-CB 4.34Å; R264-E269 HydrophobicContact CG-CB 4.33Å; R264-E269 IonicContact NE-OE2 3.29Å; R264-E269 PolarHBondContact NE-OE2 3.23Å; R264-E269 PolarHBondContact O-N 3.41Å; T267-E269 PolarHBondContact O-N 3.07Å; E269-P271 HydrophobicContact CG-CG 3.92Å; E269-P271 WeakPolarHBondContact OE1-CG 3.24Å
270	K	91.7	Very high	90.6	Very high	121 Å²	121	80.9 Å²	80.9	53%	0.526	42%	0.423	S	S	.	.			trans	-126.4	78.8	177.4	-70.6	169.1	175.8	-179.4	0	110.4	G268 Y272 A280 F281	G268-K270 PolarHBondContact O-N 2.87Å; K270-Y272 PolarHBondContact O-N 3.23Å; K270-A280 HydrophobicContact CB-CB 3.53Å; K270-A280 HydrophobicContact CD-CB 4.12Å; K270-A280 WeakPolarHBondContact CD-O 3.46Å; K270-A280 HydrophobicContact CG-CB 4.42Å; K270-F281 CarbonylContact C-O 3.37Å; K270-F281 VanDerWaalsContact C-O 3.28Å; K270-F281 VanDerWaalsContact CA-O 3.3Å; K270-F281 WeakPolarHBondContact CA-O 3.41Å
271	P	90.6	Very high	90.7	Very high	58 Å²	58	76 Å²	76	38%	0.377	40%	0.402	S	S	.	.			trans	-66.3	-22.8	-173	-22.6	35.1	0	0	0	114	E269	E269-P271 HydrophobicContact CG-CG 3.92Å; E269-P271 WeakPolarHBondContact OE1-CG 3.24Å
272	Y	92.6	Very high	90.6	Very high	77 Å²	77	75.1 Å²	75.1	30%	0.302	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	97.1	-170.1	-53.9	-79.9	0	0	0	109.9	K270 A280 F281	K270-Y272 PolarHBondContact O-N 3.23Å; Y272-A280 CarbonylContact O-C 3.59Å; Y272-A280 WeakPolarHBondContact O-CA 3.33Å; Y272-F281 WeakPolarHBondContact CD2-O 3.44Å; Y272-F281 PolarHBondContact N-O 3.11Å; Y272-F281 VanDerWaalsContact N-O 3.12Å; Y272-F281 PolarHBondContact O-N 3.21Å
273	K	91.3	Very high	90.5	Very high	136 Å²	136	74.8 Å²	74.8	59%	0.591	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	143.4	179.7	-62.7	-175.4	-178.7	177.9	0	111.2	A280 L287	K273-A280 HydrophobicContact CG-CB 3.87Å; K273-L287 WeakPolarHBondContact O-CD2 3.44Å
274	C	93.6	Very high	90.5	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.007	40%	0.399	C	S	.	.			trans	-89.7	115.9	171.8	-177.7	0	0	0	0	109.1	V276 C277 G278 K279 F281 L287 H294	C274-V276 PolarHBondContact O-N 2.88Å; C274-C277 PolarHBondContact O-N 3.29Å; C274-C277 VanDerWaalsContact SG-SG 3.68Å; C274-G278 WeakPolarHBondContact O-CA 3.46Å; C274-G278 PolarHBondContact O-N 3.27Å; C274-K279 VanDerWaalsContact CB-O 3.24Å; C274-K279 WeakPolarHBondContact CB-O 3.33Å; C274-K279 PolarHBondContact N-O 3.14Å; C274-F281 HydrophobicContact CB-CE2 4.4Å; C274-L287 HydrophobicContact CB-CD1 3.63Å; C274-H294 PolarHBondContact SG-NE2 3.43Å
275	E	91.7	Very high	90.3	Very high	170 Å²	170	75.9 Å²	75.9	79%	0.794	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.1	-179	-57.5	-51.9	136.5	0	0	113.2
276	V	90.2	Very high	90.2	Very high	106 Å²	106	76.6 Å²	76.6	64%	0.642	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-35.5	-176.6	-177.6	0	0	0	0	112.8	C274 H294	C274-V276 PolarHBondContact O-N 2.88Å; V276-H294 HydrophobicContact CG1-CB 4.21Å
277	C	90.7	Very high	90.3	Very high	54 Å²	54	74.2 Å²	74.2	37%	0.365	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	7.2	-173.1	72.1	0	0	0	0	114.4	C274 K279 H290 H294	C274-C277 PolarHBondContact O-N 3.29Å; C274-C277 VanDerWaalsContact SG-SG 3.68Å; C277-K279 PolarHBondContact O-N 3.16Å; C277-H290 PolarHBondContact SG-NE2 3.2Å; C277-H294 PolarHBondContact SG-NE2 2.86Å; C277-H294 VanDerWaalsContact SG-NE2 3.41Å
278	G	88.9	Confident	90.3	Very high	58 Å²	58	73.1 Å²	73.1	60%	0.598	40%	0.395	S	S	*	.			trans	68.3	-4.5	-179.2	0	0	0	0	0	115.6	C274 A280	C274-G278 WeakPolarHBondContact O-CA 3.46Å; C274-G278 PolarHBondContact O-N 3.27Å; G278-A280 PolarHBondContact O-N 3Å
279	K	91	Very high	90.4	Very high	130 Å²	130	75.2 Å²	75.2	57%	0.565	39%	0.391	S	S	*	.			trans	-66.6	130.1	-177.7	-74.6	-176.7	178.9	176.9	0	111.3	C274 C277 F281	C274-K279 VanDerWaalsContact CB-O 3.24Å; C274-K279 WeakPolarHBondContact CB-O 3.33Å; C274-K279 PolarHBondContact N-O 3.14Å; C277-K279 PolarHBondContact O-N 3.16Å; K279-F281 HydrophobicContact CB-CE2 4.11Å; K279-F281 HydrophobicContact CB-CZ 4.18Å; K279-F281 WeakPolarHBondContact O-CE2 3.43Å
280	A	92	Very high	90.3	Very high	29 Å²	29	71.6 Å²	71.6	24%	0.24	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	144.9	-178.6	0	0	0	0	0	112.7	K270 Y272 K273 G278	K270-A280 HydrophobicContact CB-CB 3.53Å; K270-A280 HydrophobicContact CD-CB 4.12Å; K270-A280 WeakPolarHBondContact CD-O 3.46Å; K270-A280 HydrophobicContact CG-CB 4.42Å; Y272-A280 CarbonylContact O-C 3.59Å; Y272-A280 WeakPolarHBondContact O-CA 3.33Å; K273-A280 HydrophobicContact CG-CB 3.87Å; G278-A280 PolarHBondContact O-N 3Å
281	F	90.6	Very high	90.2	Very high	43 Å²	43	69.5 Å²	69.5	19%	0.189	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.5	-177.4	-57.4	-87.8	0	0	0	111.1	K270 Y272 C274 K279 C283 L287 H290	K270-F281 CarbonylContact C-O 3.37Å; K270-F281 VanDerWaalsContact C-O 3.28Å; K270-F281 VanDerWaalsContact CA-O 3.3Å; K270-F281 WeakPolarHBondContact CA-O 3.41Å; Y272-F281 WeakPolarHBondContact CD2-O 3.44Å; Y272-F281 PolarHBondContact N-O 3.11Å; Y272-F281 VanDerWaalsContact N-O 3.12Å; Y272-F281 PolarHBondContact O-N 3.21Å; C274-F281 HydrophobicContact CB-CE2 4.4Å; K279-F281 HydrophobicContact CB-CE2 4.11Å; K279-F281 HydrophobicContact CB-CZ 4.18Å; K279-F281 WeakPolarHBondContact O-CE2 3.43Å; F281-C283 VanDerWaalsContact C-N 3.3Å; F281-L287 HydrophobicContact CD2-CB 3.97Å; F281-L287 HydrophobicContact CD2-CD1 3.87Å; F281-L287 HydrophobicContact CE2-CD1 4.01Å; F281-L287 HydrophobicContact CG-CB 4.47Å; F281-H290 HydrophobicContact CE1-CB 4.06Å; F281-H290 HydrophobicContact CE2-CB 3.78Å; F281-H290 AromaticContact CE2-CD2 3.55Å; F281-H290 AromaticContact CE2-CG 3.62Å; F281-H290 HydrophobicContact CZ-CB 3.42Å; F281-H290 VanDerWaalsContact CZ-CB 3.42Å; F281-H290 AromaticContact CZ-CD2 3.6Å; F281-H290 AromaticContact CZ-CG 3.23Å; F281-H290 AromaticContact CZ-ND1 3.66Å
282	N	88.2	Confident	90.2	Very high	33 Å²	33	69 Å²	69	18%	0.176	36%	0.357	C	S	.	.	S	Bend	trans	-83.7	-5.7	177	62.6	24	0	0	0	113.6	R264	R264-N282 HydrophobicContact CB-CB 4.07Å; R264-N282 WeakPolarHBondContact CD-O 3.49Å; R264-N282 PolarHBondContact NH1-O 2.94Å
283	C	88.3	Confident	90	Very high	14 Å²	14	70.8 Å²	70.8	10%	0.095	37%	0.37	C	S	.	.	S	Bend	trans	-141.2	139.4	-176.1	-169.9	0	0	0	0	111.4	Q261 F281 D285 Y286 L287	Q261-C283 PolarHBondContact NE2-SG 2.92Å; F281-C283 VanDerWaalsContact C-N 3.3Å; C283-D285 VanDerWaalsContact C-N 3.34Å; C283-D285 PolarHBondContact O-N 3.42Å; C283-Y286 HydrophobicContact CB-CD2 3.55Å; C283-Y286 HydrophobicContact CB-CE2 4.09Å; C283-Y286 HydrophobicContact CB-CG 4Å; C283-Y286 PolarHBondContact O-N 3.37Å; C283-L287 PolarHBondContact O-N 2.83Å
284	S	89.8	Confident	89.9	Confident	49 Å²	49	67.9 Å²	67.9	34%	0.343	36%	0.359	S	S	.	.	H	α-helix	trans	-60.1	-42.2	174.1	52.2	0	0	0	0	112	Y286 L287 V288	S284-Y286 PolarHBondContact O-N 3.36Å; S284-L287 WeakPolarHBondContact O-CB 3.34Å; S284-L287 PolarHBondContact O-N 3.12Å; S284-V288 WeakPolarHBondContact O-CG2 3.38Å; S284-V288 PolarHBondContact O-N 3.37Å
285	D	87.1	Confident	89.6	Confident	97 Å²	97	71.9 Å²	71.9	52%	0.519	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-31.3	-177.4	-65.7	-6.5	0	0	0	112	C283 K289	C283-D285 VanDerWaalsContact C-N 3.34Å; C283-D285 PolarHBondContact O-N 3.42Å; D285-K289 VanDerWaalsContact O-CB 3.27Å; D285-K289 WeakPolarHBondContact O-CB 3.42Å; D285-K289 WeakPolarHBondContact O-CD 3.44Å; D285-K289 WeakPolarHBondContact O-CG 3.46Å; D285-K289 PolarHBondContact O-N 3.05Å
286	Y	89.3	Confident	89.3	Confident	119 Å²	119	66 Å²	66	47%	0.467	37%	0.368	S	S	.	.	H	α-helix	trans	-73.6	-36.6	174.6	-65.8	-27.6	0	0	0	112.2	C283 S284 K289 H290	C283-Y286 HydrophobicContact CB-CD2 3.55Å; C283-Y286 HydrophobicContact CB-CE2 4.09Å; C283-Y286 HydrophobicContact CB-CG 4Å; C283-Y286 PolarHBondContact O-N 3.37Å; S284-Y286 PolarHBondContact O-N 3.36Å; Y286-K289 PolarHBondContact O-N 3.23Å; Y286-H290 VanDerWaalsContact O-CB 3.25Å; Y286-H290 WeakPolarHBondContact O-CB 3.43Å; Y286-H290 PolarHBondContact O-N 3.32Å
287	L	91.9	Very high	89.2	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.115	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-49.2	172.2	174	62.2	0	0	0	111.1	K273 C274 F281 C283 S284 K289 H290 Q291	K273-L287 WeakPolarHBondContact O-CD2 3.44Å; C274-L287 HydrophobicContact CB-CD1 3.63Å; F281-L287 HydrophobicContact CD2-CB 3.97Å; F281-L287 HydrophobicContact CD2-CD1 3.87Å; F281-L287 HydrophobicContact CE2-CD1 4.01Å; F281-L287 HydrophobicContact CG-CB 4.47Å; C283-L287 PolarHBondContact O-N 2.83Å; S284-L287 WeakPolarHBondContact O-CB 3.34Å; S284-L287 PolarHBondContact O-N 3.12Å; L287-K289 VanDerWaalsContact C-N 3.3Å; L287-K289 PolarHBondContact O-N 2.86Å; L287-H290 CarbonylContact O-C 3.29Å; L287-H290 WeakPolarHBondContact O-CA 3.49Å; L287-H290 WeakPolarHBondContact O-CB 3.44Å; L287-H290 PolarHBondContact O-N 2.94Å; L287-Q291 HydrophobicContact CD1-CG 4.18Å; L287-Q291 HydrophobicContact CG-CG 4.48Å; L287-Q291 WeakPolarHBondContact O-CG 3.31Å; L287-Q291 PolarHBondContact O-N 3.05Å
288	V	88.8	Confident	89.2	Confident	74 Å²	74	69.5 Å²	69.5	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-58.6	-44.4	178.1	173.5	0	0	0	0	111.1	S284 H290 Q291	S284-V288 WeakPolarHBondContact O-CG2 3.38Å; S284-V288 PolarHBondContact O-N 3.37Å; V288-H290 VanDerWaalsContact C-N 3.31Å; V288-H290 PolarHBondContact O-N 3.45Å; V288-Q291 PolarHBondContact O-N 3.25Å
289	K	88.7	Confident	89.2	Confident	90 Å²	90	70.3 Å²	70.3	39%	0.391	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-38.5	174.7	-82.7	175.9	-173.1	169.9	0	112.8	D285 Y286 L287 F311	D285-K289 VanDerWaalsContact O-CB 3.27Å; D285-K289 WeakPolarHBondContact O-CB 3.42Å; D285-K289 WeakPolarHBondContact O-CD 3.44Å; D285-K289 WeakPolarHBondContact O-CG 3.46Å; D285-K289 PolarHBondContact O-N 3.05Å; Y286-K289 PolarHBondContact O-N 3.23Å; L287-K289 VanDerWaalsContact C-N 3.3Å; L287-K289 PolarHBondContact O-N 2.86Å; K289-F311 HydrophobicContact CB-CE1 3.7Å; K289-F311 HydrophobicContact CB-CZ 4.24Å; K289-F311 HydrophobicContact CD-CE1 4.03Å; K289-F311 HydrophobicContact CG-CD1 4.47Å; K289-F311 HydrophobicContact CG-CE1 3.75Å
290	H	90.3	Very high	89.2	Confident	22 Å²	22	68 Å²	68	10%	0.102	35%	0.353	C	S	.	.	H	α-helix	trans	-69.6	-39.7	177.4	172.1	71	0	0	0	112.3	C277 F281 Y286 L287 V288 R292 I293 H294	C277-H290 PolarHBondContact SG-NE2 3.2Å; F281-H290 HydrophobicContact CE1-CB 4.06Å; F281-H290 HydrophobicContact CE2-CB 3.78Å; F281-H290 AromaticContact CE2-CD2 3.55Å; F281-H290 AromaticContact CE2-CG 3.62Å; F281-H290 HydrophobicContact CZ-CB 3.42Å; F281-H290 VanDerWaalsContact CZ-CB 3.42Å; F281-H290 AromaticContact CZ-CD2 3.6Å; F281-H290 AromaticContact CZ-CG 3.23Å; F281-H290 AromaticContact CZ-ND1 3.66Å; Y286-H290 VanDerWaalsContact O-CB 3.25Å; Y286-H290 WeakPolarHBondContact O-CB 3.43Å; Y286-H290 PolarHBondContact O-N 3.32Å; L287-H290 CarbonylContact O-C 3.29Å; L287-H290 WeakPolarHBondContact O-CA 3.49Å; L287-H290 WeakPolarHBondContact O-CB 3.44Å; L287-H290 PolarHBondContact O-N 2.94Å; V288-H290 VanDerWaalsContact C-N 3.31Å; V288-H290 PolarHBondContact O-N 3.45Å; H290-R292 PolarHBondContact O-N 3.39Å; H290-R292 VanDerWaalsContact O-N 3.13Å; H290-I293 VanDerWaalsContact O-CB 3.27Å; H290-I293 WeakPolarHBondContact O-CB 3.48Å; H290-I293 WeakPolarHBondContact O-CG1 3.38Å; H290-I293 PolarHBondContact O-N 3.06Å; H290-H294 AromaticContact CD2-NE2 3.84Å; H290-H294 AromaticContact CE1-NE2 3.75Å; H290-H294 AromaticContact NE2-CD2 3.9Å; H290-H294 AromaticContact NE2-CE1 3.98Å; H290-H294 AromaticContact NE2-NE2 3.07Å; H290-H294 PolarHBondContact NE2-NE2 3.08Å
291	Q	89.4	Confident	89.1	Confident	78 Å²	78	73 Å²	73	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-57.6	-28.2	179.5	-76.7	172.4	-34.1	0	0	112.9	L287 V288 I293 H294 T295	L287-Q291 HydrophobicContact CD1-CG 4.18Å; L287-Q291 HydrophobicContact CG-CG 4.48Å; L287-Q291 WeakPolarHBondContact O-CG 3.31Å; L287-Q291 PolarHBondContact O-N 3.05Å; V288-Q291 PolarHBondContact O-N 3.25Å; Q291-I293 PolarHBondContact O-N 3.25Å; Q291-I293 VanDerWaalsContact O-N 3.1Å; Q291-H294 PolarHBondContact O-N 3.18Å; Q291-T295 PolarHBondContact O-N 2.83Å; Q291-T295 PolarHBondContact O-OG1 3.12Å
292	R	90.5	Very high	89.2	Confident	48 Å²	48	71 Å²	71	18%	0.181	36%	0.361	C	S	.	.	H	α-helix	trans	-58.8	-21.4	173.2	-62.1	179.5	-175.8	177.7	-1.3	114.3	H290 H294 T295 G296 E297 S310	H290-R292 PolarHBondContact O-N 3.39Å; H290-R292 VanDerWaalsContact O-N 3.13Å; R292-H294 VanDerWaalsContact C-N 3.34Å; R292-T295 WeakPolarHBondContact CA-OG1 3.46Å; R292-G296 WeakPolarHBondContact O-CA 3.38Å; R292-G296 PolarHBondContact O-N 3.38Å; R292-G296 VanDerWaalsContact O-N 3.1Å; R292-E297 HydrophobicContact CG-CB 4.47Å; R292-E297 PolarHBondContact O-N 3.24Å; R292-S310 PolarHBondContact NH1-O 3.43Å
293	I	87.9	Confident	89.2	Confident	113 Å²	113	77.5 Å²	77.5	58%	0.579	39%	0.39	S	S	*	.	H	α-helix	trans	-70.5	-36.7	174.9	-59.4	175.2	0	0	0	110.2	H290 Q291	H290-I293 VanDerWaalsContact O-CB 3.27Å; H290-I293 WeakPolarHBondContact O-CB 3.48Å; H290-I293 WeakPolarHBondContact O-CG1 3.38Å; H290-I293 PolarHBondContact O-N 3.06Å; Q291-I293 PolarHBondContact O-N 3.25Å; Q291-I293 VanDerWaalsContact O-N 3.1Å
294	H	88.2	Confident	89.1	Confident	76 Å²	76	82.1 Å²	82.1	35%	0.352	42%	0.417	S	S	.	.	H	α-helix	trans	-80.8	-42	-179.3	-58.5	-53.3	0	0	0	111.7	C274 V276 C277 H290 Q291 R292 G296	C274-H294 PolarHBondContact SG-NE2 3.43Å; V276-H294 HydrophobicContact CG1-CB 4.21Å; C277-H294 PolarHBondContact SG-NE2 2.86Å; C277-H294 VanDerWaalsContact SG-NE2 3.41Å; H290-H294 AromaticContact CD2-NE2 3.84Å; H290-H294 AromaticContact CE1-NE2 3.75Å; H290-H294 AromaticContact NE2-CD2 3.9Å; H290-H294 AromaticContact NE2-CE1 3.98Å; H290-H294 AromaticContact NE2-NE2 3.07Å; H290-H294 PolarHBondContact NE2-NE2 3.08Å; Q291-H294 PolarHBondContact O-N 3.18Å; R292-H294 VanDerWaalsContact C-N 3.34Å; H294-G296 VanDerWaalsContact C-N 3.26Å; H294-G296 PolarHBondContact O-N 3.42Å
295	T	87.6	Confident	89	Confident	85 Å²	85	82.3 Å²	82.3	52%	0.521	42%	0.418	S	S	.	.	H	α-helix	trans	-76	-16.2	178.9	62.2	0	0	0	0	112.9	Q291 R292 E297	Q291-T295 PolarHBondContact O-N 2.83Å; Q291-T295 PolarHBondContact O-OG1 3.12Å; R292-T295 WeakPolarHBondContact CA-OG1 3.46Å; T295-E297 PolarHBondContact O-N 3.37Å; T295-E297 WeakPolarHBondContact OG1-CB 3.23Å; T295-E297 WeakPolarHBondContact OG1-CG 3.44Å; T295-E297 PolarHBondContact OG1-N 2.85Å
296	G	86.6	Confident	89	Confident	46 Å²	46	80.1 Å²	80.1	47%	0.474	42%	0.418	S	S	.	.			trans	68.7	7.5	-173.8	0	0	0	0	0	113.9	R292 H294 K298	R292-G296 WeakPolarHBondContact O-CA 3.38Å; R292-G296 PolarHBondContact O-N 3.38Å; R292-G296 VanDerWaalsContact O-N 3.1Å; H294-G296 VanDerWaalsContact C-N 3.26Å; H294-G296 PolarHBondContact O-N 3.42Å; G296-K298 PolarHBondContact O-N 3.03Å
297	E	88.2	Confident	88.9	Confident	109 Å²	109	80.6 Å²	80.6	51%	0.509	42%	0.423	S	S	.	.			trans	-59.3	126.8	-179.5	-80.2	178.7	-165.1	0	0	111.7	R292 T295	R292-E297 HydrophobicContact CG-CB 4.47Å; R292-E297 PolarHBondContact O-N 3.24Å; T295-E297 PolarHBondContact O-N 3.37Å; T295-E297 WeakPolarHBondContact OG1-CB 3.23Å; T295-E297 WeakPolarHBondContact OG1-CG 3.44Å; T295-E297 PolarHBondContact OG1-N 2.85Å
298	K	90	Very high	88.9	Confident	125 Å²	125	81 Å²	81	54%	0.543	43%	0.429	S	S	.	.			trans	-126.5	76.5	177.1	-68.9	173.1	-177.2	-179.1	0	110.2	G296 Y300 A308 F309	G296-K298 PolarHBondContact O-N 3.03Å; K298-Y300 PolarHBondContact O-N 2.76Å; K298-Y300 VanDerWaalsContact O-N 3.12Å; K298-A308 HydrophobicContact CB-CB 3.53Å; K298-A308 HydrophobicContact CD-CB 4.16Å; K298-A308 WeakPolarHBondContact CD-O 2.95Å; K298-A308 HydrophobicContact CG-CB 4.47Å; K298-F309 CarbonylContact C-O 3.52Å; K298-F309 VanDerWaalsContact C-O 3.26Å; K298-F309 VanDerWaalsContact CA-O 3.29Å; K298-F309 WeakPolarHBondContact CA-O 3.26Å
299	P	89.5	Confident	88.9	Confident	75 Å²	75	79.4 Å²	79.4	49%	0.487	42%	0.417	S	S	.	.			trans	-65.4	-18.3	-172.7	-21.7	34	0	0	0	114.1
300	Y	91.3	Very high	88.8	Confident	80 Å²	80	76.4 Å²	76.4	31%	0.314	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	97.2	-172	-54.5	-76.6	0	0	0	110.3	K298 A308 F309 S312	K298-Y300 PolarHBondContact O-N 2.76Å; K298-Y300 VanDerWaalsContact O-N 3.12Å; Y300-A308 CarbonylContact O-C 3.32Å; Y300-A308 WeakPolarHBondContact O-CA 3.27Å; Y300-F309 WeakPolarHBondContact CD2-O 3.46Å; Y300-F309 PolarHBondContact N-O 3.25Å; Y300-F309 VanDerWaalsContact N-O 3.13Å; Y300-F309 PolarHBondContact O-N 3.26Å; Y300-S312 VanDerWaalsContact CE2-N 3.26Å
301	K	89.7	Confident	88.6	Confident	136 Å²	136	77.4 Å²	77.4	59%	0.591	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	145.2	175.4	-89.5	179.6	173.9	179.4	0	112.2	A308 L315	K301-A308 HydrophobicContact CG-CB 3.71Å; K301-L315 WeakPolarHBondContact O-CD2 3.26Å
302	C	90.9	Very high	88.5	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.007	42%	0.415	C	S	.	.			trans	-89.6	117.5	169.3	-177.6	0	0	0	0	109.4	V304 C305 G306 K307 F309 L315 H322	C302-V304 PolarHBondContact O-N 3.38Å; C302-C305 PolarHBondContact O-N 3.48Å; C302-G306 WeakPolarHBondContact O-CA 3.4Å; C302-G306 PolarHBondContact O-N 3.5Å; C302-K307 WeakPolarHBondContact CB-O 3.37Å; C302-K307 PolarHBondContact N-O 3.37Å; C302-F309 HydrophobicContact CB-CE2 4.43Å; C302-L315 HydrophobicContact CB-CD1 3.56Å; C302-H322 VanDerWaalsContact SG-CD2 3.57Å; C302-H322 PolarHBondContact SG-NE2 3.33Å
303	E	89.7	Confident	88.3	Confident	169 Å²	169	78.7 Å²	78.7	79%	0.79	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-28	179.8	-57.4	-51.2	135.9	0	0	113.3
304	V	86.3	Confident	88.3	Confident	110 Å²	110	78.8 Å²	78.8	67%	0.667	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-36.2	-176.1	-178	0	0	0	0	112.8	C302 H322	C302-V304 PolarHBondContact O-N 3.38Å; V304-H322 HydrophobicContact CG1-CB 4.3Å
305	C	87.4	Confident	88.3	Confident	54 Å²	54	76.1 Å²	76.1	37%	0.365	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.1	5.6	-172.9	73.3	0	0	0	0	114.3	C302 K307 H318 H322	C302-C305 PolarHBondContact O-N 3.48Å; C305-K307 PolarHBondContact O-N 3.34Å; C305-H318 PolarHBondContact SG-NE2 3.47Å; C305-H322 PolarHBondContact SG-NE2 2.76Å
306	G	86.3	Confident	88.2	Confident	50 Å²	50	76 Å²	76	52%	0.515	41%	0.408	S	S	.	.			trans	69.1	-4.9	-179	0	0	0	0	0	115.6	C302 A308	C302-G306 WeakPolarHBondContact O-CA 3.4Å; C302-G306 PolarHBondContact O-N 3.5Å; G306-A308 PolarHBondContact O-N 3.43Å
307	K	88.1	Confident	88.1	Confident	129 Å²	129	79 Å²	79	56%	0.561	41%	0.408	S	S	*	.			trans	-65.5	128.2	-177.7	-74.7	-176.2	178.7	176.9	0	111.3	C302 C305 F309	C302-K307 WeakPolarHBondContact CB-O 3.37Å; C302-K307 PolarHBondContact N-O 3.37Å; C305-K307 PolarHBondContact O-N 3.34Å; K307-F309 HydrophobicContact CB-CE2 3.96Å; K307-F309 HydrophobicContact CB-CZ 4.07Å; K307-F309 WeakPolarHBondContact O-CE2 3.5Å
308	A	90.4	Very high	88	Confident	30 Å²	30	74.8 Å²	74.8	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.8	178.7	0	0	0	0	0	112.1	K298 Y300 K301 G306	K298-A308 HydrophobicContact CB-CB 3.53Å; K298-A308 HydrophobicContact CD-CB 4.16Å; K298-A308 WeakPolarHBondContact CD-O 2.95Å; K298-A308 HydrophobicContact CG-CB 4.47Å; Y300-A308 CarbonylContact O-C 3.32Å; Y300-A308 WeakPolarHBondContact O-CA 3.27Å; K301-A308 HydrophobicContact CG-CB 3.71Å; G306-A308 PolarHBondContact O-N 3.43Å
309	F	88.9	Confident	87.7	Confident	42 Å²	42	72.5 Å²	72.5	18%	0.184	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.2	-179.7	-58.4	-88.1	0	0	0	111.2	K298 Y300 C302 K307 F311 L315 H318	K298-F309 CarbonylContact C-O 3.52Å; K298-F309 VanDerWaalsContact C-O 3.26Å; K298-F309 VanDerWaalsContact CA-O 3.29Å; K298-F309 WeakPolarHBondContact CA-O 3.26Å; Y300-F309 WeakPolarHBondContact CD2-O 3.46Å; Y300-F309 PolarHBondContact N-O 3.25Å; Y300-F309 VanDerWaalsContact N-O 3.13Å; Y300-F309 PolarHBondContact O-N 3.26Å; C302-F309 HydrophobicContact CB-CE2 4.43Å; K307-F309 HydrophobicContact CB-CE2 3.96Å; K307-F309 HydrophobicContact CB-CZ 4.07Å; K307-F309 WeakPolarHBondContact O-CE2 3.5Å; F309-F311 VanDerWaalsContact C-N 3.29Å; F309-L315 HydrophobicContact CB-CB 4.38Å; F309-L315 HydrophobicContact CD2-CB 3.9Å; F309-L315 HydrophobicContact CD2-CD1 3.83Å; F309-L315 HydrophobicContact CD2-CG 4.49Å; F309-L315 HydrophobicContact CE2-CD1 4Å; F309-L315 HydrophobicContact CG-CB 4.35Å; F309-H318 HydrophobicContact CE1-CB 4.05Å; F309-H318 HydrophobicContact CE2-CB 3.77Å; F309-H318 AromaticContact CE2-CD2 3.53Å; F309-H318 AromaticContact CE2-CG 3.62Å; F309-H318 HydrophobicContact CZ-CB 3.41Å; F309-H318 VanDerWaalsContact CZ-CB 3.41Å; F309-H318 AromaticContact CZ-CD2 3.6Å; F309-H318 AromaticContact CZ-CG 3.25Å; F309-H318 AromaticContact CZ-ND1 3.73Å
310	S	86.9	Confident	87.4	Confident	27 Å²	27	70.6 Å²	70.6	19%	0.189	36%	0.362	C	S	.	.	S	Bend	trans	-75.8	-17.9	176.8	48.6	0	0	0	0	113.4	R292	R292-S310 PolarHBondContact NH1-O 3.43Å
311	F	86.3	Confident	86.9	Confident	43 Å²	43	72.1 Å²	72.1	19%	0.189	38%	0.375	C	S	.	.	S	Bend	trans	-133.2	136	-178.5	-59.7	-78.4	0	0	0	112.1	K289 F309 T313 Y314 L315	K289-F311 HydrophobicContact CB-CE1 3.7Å; K289-F311 HydrophobicContact CB-CZ 4.24Å; K289-F311 HydrophobicContact CD-CE1 4.03Å; K289-F311 HydrophobicContact CG-CD1 4.47Å; K289-F311 HydrophobicContact CG-CE1 3.75Å; F309-F311 VanDerWaalsContact C-N 3.29Å; F311-T313 PolarHBondContact O-N 2.84Å; F311-Y314 HydrophobicContact CB-CD2 3.89Å; F311-Y314 HydrophobicContact CB-CE2 4.29Å; F311-Y314 HydrophobicContact CB-CG 4.1Å; F311-Y314 AromaticContact CD2-CD2 3.59Å; F311-Y314 HydrophobicContact CD2-CD2 3.59Å; F311-Y314 AromaticContact CD2-CE2 3.31Å; F311-Y314 HydrophobicContact CD2-CE2 3.31Å; F311-Y314 HydrophobicContact CE2-CE2 4.01Å; F311-Y314 HydrophobicContact CG-CD2 4.19Å; F311-Y314 HydrophobicContact CG-CE2 4.15Å; F311-Y314 WeakPolarHBondContact O-CB 3.2Å; F311-Y314 PolarHBondContact O-N 3.47Å; F311-L315 PolarHBondContact O-N 3.49Å
312	S	87.4	Confident	86.4	Confident	65 Å²	65	69.2 Å²	69.2	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-57.3	-37.5	175.4	170.7	0	0	0	0	112.3	Y300 Y314 L315 H316	Y300-S312 VanDerWaalsContact CE2-N 3.26Å; S312-Y314 VanDerWaalsContact C-N 3.25Å; S312-Y314 PolarHBondContact O-N 3.12Å; S312-L315 WeakPolarHBondContact O-CB 3.32Å; S312-L315 PolarHBondContact O-N 3.09Å; S312-H316 PolarHBondContact O-N 3.43Å
313	T	86.3	Confident	85.8	Confident	88 Å²	88	73.3 Å²	73.3	54%	0.54	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-30.8	177.5	54.1	0	0	0	0	112.9	F311 K317	F311-T313 PolarHBondContact O-N 2.84Å; T313-K317 VanDerWaalsContact O-CG 3.31Å; T313-K317 WeakPolarHBondContact O-CG 3.42Å; T313-K317 PolarHBondContact O-N 2.89Å; T313-K317 VanDerWaalsContact O-N 3.09Å
314	Y	87.3	Confident	85	Confident	115 Å²	115	67.5 Å²	67.5	45%	0.451	37%	0.373	S	S	.	.	H	α-helix	trans	-77.2	-39.3	175.5	-64	-16.8	0	0	0	111.5	F311 S312 H316 K317 H318	F311-Y314 HydrophobicContact CB-CD2 3.89Å; F311-Y314 HydrophobicContact CB-CE2 4.29Å; F311-Y314 HydrophobicContact CB-CG 4.1Å; F311-Y314 AromaticContact CD2-CD2 3.59Å; F311-Y314 HydrophobicContact CD2-CD2 3.59Å; F311-Y314 AromaticContact CD2-CE2 3.31Å; F311-Y314 HydrophobicContact CD2-CE2 3.31Å; F311-Y314 HydrophobicContact CE2-CE2 4.01Å; F311-Y314 HydrophobicContact CG-CD2 4.19Å; F311-Y314 HydrophobicContact CG-CE2 4.15Å; F311-Y314 WeakPolarHBondContact O-CB 3.2Å; F311-Y314 PolarHBondContact O-N 3.47Å; S312-Y314 VanDerWaalsContact C-N 3.25Å; S312-Y314 PolarHBondContact O-N 3.12Å; Y314-H316 VanDerWaalsContact C-N 3.35Å; Y314-K317 PolarHBondContact O-N 3.48Å; Y314-H318 WeakPolarHBondContact O-CB 3.42Å; Y314-H318 PolarHBondContact O-N 3.08Å
315	L	89.3	Confident	84.4	Confident	19 Å²	19	66.2 Å²	66.2	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-57.9	-48.3	170	173.3	62.2	0	0	0	110.9	K301 C302 F309 F311 S312 K317 H318 Q319	K301-L315 WeakPolarHBondContact O-CD2 3.26Å; C302-L315 HydrophobicContact CB-CD1 3.56Å; F309-L315 HydrophobicContact CB-CB 4.38Å; F309-L315 HydrophobicContact CD2-CB 3.9Å; F309-L315 HydrophobicContact CD2-CD1 3.83Å; F309-L315 HydrophobicContact CD2-CG 4.49Å; F309-L315 HydrophobicContact CE2-CD1 4Å; F309-L315 HydrophobicContact CG-CB 4.35Å; F311-L315 PolarHBondContact O-N 3.49Å; S312-L315 WeakPolarHBondContact O-CB 3.32Å; S312-L315 PolarHBondContact O-N 3.09Å; L315-K317 VanDerWaalsContact C-N 3.34Å; L315-K317 PolarHBondContact O-N 2.82Å; L315-H318 CarbonylContact O-C 3.59Å; L315-H318 WeakPolarHBondContact O-CA 3.28Å; L315-H318 WeakPolarHBondContact O-CB 3.5Å; L315-H318 PolarHBondContact O-N 3.23Å; L315-Q319 HydrophobicContact CD1-CG 4.07Å; L315-Q319 HydrophobicContact CG-CG 4.36Å; L315-Q319 WeakPolarHBondContact O-CG 3.03Å; L315-Q319 PolarHBondContact O-N 3.23Å
316	H	85.4	Confident	83.9	Confident	83 Å²	83	69.2 Å²	69.2	38%	0.384	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-40.8	179.4	-175.9	64	0	0	0	112.3	S312 Y314 H318 Q319 R320	S312-H316 PolarHBondContact O-N 3.43Å; Y314-H316 VanDerWaalsContact C-N 3.35Å; H316-H318 VanDerWaalsContact C-N 3.3Å; H316-H318 PolarHBondContact O-N 3.21Å; H316-Q319 PolarHBondContact O-N 3.31Å; H316-R320 PolarHBondContact NE2-NH2 3.36Å; H316-R320 VanDerWaalsContact NE2-NH2 3.15Å; H316-R320 PolarHBondContact O-N 3.38Å
317	K	83.8	Confident	83.5	Confident	109 Å²	109	73.6 Å²	73.6	47%	0.474	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-38	172.3	-76.8	176.6	-178.2	-178.2	0	112.1	T313 Y314 L315 R320	T313-K317 VanDerWaalsContact O-CG 3.31Å; T313-K317 WeakPolarHBondContact O-CG 3.42Å; T313-K317 PolarHBondContact O-N 2.89Å; T313-K317 VanDerWaalsContact O-N 3.09Å; Y314-K317 PolarHBondContact O-N 3.48Å; L315-K317 VanDerWaalsContact C-N 3.34Å; L315-K317 PolarHBondContact O-N 2.82Å; K317-R320 WeakPolarHBondContact O-CB 3.47Å
318	H	86.1	Confident	83.2	Confident	21 Å²	21	71.1 Å²	71.1	10%	0.097	36%	0.356	C	S	.	.	H	α-helix	trans	-68.9	-42.2	178	173.8	68.8	0	0	0	112.3	C305 F309 Y314 L315 H316 R320 I321 H322	C305-H318 PolarHBondContact SG-NE2 3.47Å; F309-H318 HydrophobicContact CE1-CB 4.05Å; F309-H318 HydrophobicContact CE2-CB 3.77Å; F309-H318 AromaticContact CE2-CD2 3.53Å; F309-H318 AromaticContact CE2-CG 3.62Å; F309-H318 HydrophobicContact CZ-CB 3.41Å; F309-H318 VanDerWaalsContact CZ-CB 3.41Å; F309-H318 AromaticContact CZ-CD2 3.6Å; F309-H318 AromaticContact CZ-CG 3.25Å; F309-H318 AromaticContact CZ-ND1 3.73Å; Y314-H318 WeakPolarHBondContact O-CB 3.42Å; Y314-H318 PolarHBondContact O-N 3.08Å; L315-H318 CarbonylContact O-C 3.59Å; L315-H318 WeakPolarHBondContact O-CA 3.28Å; L315-H318 WeakPolarHBondContact O-CB 3.5Å; L315-H318 PolarHBondContact O-N 3.23Å; H316-H318 VanDerWaalsContact C-N 3.3Å; H316-H318 PolarHBondContact O-N 3.21Å; H318-R320 PolarHBondContact O-N 2.83Å; H318-R320 VanDerWaalsContact O-N 3.12Å; H318-I321 VanDerWaalsContact O-CB 3.22Å; H318-I321 WeakPolarHBondContact O-CB 3.26Å; H318-I321 WeakPolarHBondContact O-CG1 3.5Å; H318-I321 PolarHBondContact O-N 2.96Å; H318-H322 AromaticContact CD2-NE2 3.77Å; H318-H322 AromaticContact CE1-NE2 3.76Å; H318-H322 AromaticContact NE2-CD2 3.94Å; H318-H322 AromaticContact NE2-CE1 3.79Å; H318-H322 AromaticContact NE2-NE2 3.05Å; H318-H322 PolarHBondContact NE2-NE2 3.3Å
319	Q	84.1	Confident	82.9	Confident	77 Å²	77	78.6 Å²	78.6	36%	0.36	38%	0.378	S	S	.	.	H	α-helix	trans	-56.3	-30.5	177.9	-76.2	172.7	-36.1	0	0	112.4	L315 H316 I321 H322 T323	L315-Q319 HydrophobicContact CD1-CG 4.07Å; L315-Q319 HydrophobicContact CG-CG 4.36Å; L315-Q319 WeakPolarHBondContact O-CG 3.03Å; L315-Q319 PolarHBondContact O-N 3.23Å; H316-Q319 PolarHBondContact O-N 3.31Å; Q319-I321 PolarHBondContact O-N 3.47Å; Q319-H322 PolarHBondContact O-N 2.92Å; Q319-T323 PolarHBondContact O-N 2.89Å
320	R	82.7	Confident	82.9	Confident	35 Å²	35	76.7 Å²	76.7	13%	0.132	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-27.6	174.6	-64.4	176.1	-173.3	-164.3	-3.9	113.4	H316 K317 H318 H322 T323 G324 E325 T338	H316-R320 PolarHBondContact NE2-NH2 3.36Å; H316-R320 VanDerWaalsContact NE2-NH2 3.15Å; H316-R320 PolarHBondContact O-N 3.38Å; K317-R320 WeakPolarHBondContact O-CB 3.47Å; H318-R320 PolarHBondContact O-N 2.83Å; H318-R320 VanDerWaalsContact O-N 3.12Å; R320-H322 VanDerWaalsContact C-N 3.34Å; R320-T323 WeakPolarHBondContact CA-OG1 3.43Å; R320-T323 PolarHBondContact O-OG1 3.16Å; R320-G324 PolarHBondContact O-N 3.45Å; R320-G324 VanDerWaalsContact O-N 3.08Å; R320-E325 PolarHBondContact O-N 3.43Å; R320-T338 PolarHBondContact NH1-O 3.13Å
321	I	81.3	Confident	82.8	Confident	111 Å²	111	84.6 Å²	84.6	57%	0.569	40%	0.404	S	S	*	.	H	α-helix	trans	-66.2	-40.1	177.2	-58.9	172.1	0	0	0	110.3	H318 Q319 G324	H318-I321 VanDerWaalsContact O-CB 3.22Å; H318-I321 WeakPolarHBondContact O-CB 3.26Å; H318-I321 WeakPolarHBondContact O-CG1 3.5Å; H318-I321 PolarHBondContact O-N 2.96Å; Q319-I321 PolarHBondContact O-N 3.47Å; I321-G324 PolarHBondContact O-N 3.16Å
322	H	80.1	Confident	82.8	Confident	76 Å²	76	87.2 Å²	87.2	35%	0.352	42%	0.416	S	S	.	.	H	α-helix	trans	-70.7	-40.2	179.7	-60.8	-50.4	0	0	0	112	C302 V304 C305 H318 Q319 R320 G324	C302-H322 VanDerWaalsContact SG-CD2 3.57Å; C302-H322 PolarHBondContact SG-NE2 3.33Å; V304-H322 HydrophobicContact CG1-CB 4.3Å; C305-H322 PolarHBondContact SG-NE2 2.76Å; H318-H322 AromaticContact CD2-NE2 3.77Å; H318-H322 AromaticContact CE1-NE2 3.76Å; H318-H322 AromaticContact NE2-CD2 3.94Å; H318-H322 AromaticContact NE2-CE1 3.79Å; H318-H322 AromaticContact NE2-NE2 3.05Å; H318-H322 PolarHBondContact NE2-NE2 3.3Å; Q319-H322 PolarHBondContact O-N 2.92Å; R320-H322 VanDerWaalsContact C-N 3.34Å; H322-G324 VanDerWaalsContact C-N 3.26Å; H322-G324 PolarHBondContact O-N 3.47Å
323	T	77.9	Confident	82.7	Confident	86 Å²	86	86.6 Å²	86.6	53%	0.528	41%	0.412	S	S	.	.	H	α-helix	trans	-75.2	-14.2	178.1	58.8	0	0	0	0	113.7	Q319 R320 E325	Q319-T323 PolarHBondContact O-N 2.89Å; R320-T323 WeakPolarHBondContact CA-OG1 3.43Å; R320-T323 PolarHBondContact O-OG1 3.16Å; T323-E325 PolarHBondContact O-N 3.06Å; T323-E325 VanDerWaalsContact O-N 3.09Å; T323-E325 PolarHBondContact OG1-N 3.4Å
324	G	72.6	Confident	82.6	Confident	47 Å²	47	84.8 Å²	84.8	49%	0.485	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	5.2	-170.8	0	0	0	0	0	114.9	R320 I321 H322 K326	R320-G324 PolarHBondContact O-N 3.45Å; R320-G324 VanDerWaalsContact O-N 3.08Å; I321-G324 PolarHBondContact O-N 3.16Å; H322-G324 VanDerWaalsContact C-N 3.26Å; H322-G324 PolarHBondContact O-N 3.47Å; G324-K326 PolarHBondContact O-N 3.47Å
325	E	73.3	Confident	82.4	Confident	84 Å²	84	85.3 Å²	85.3	39%	0.393	42%	0.415	S	S	.	.			trans	-61.7	101.4	-178.1	-78.5	-173.2	-173.4	0	0	112.1	R320 T323 R327	R320-E325 PolarHBondContact O-N 3.43Å; T323-E325 PolarHBondContact O-N 3.06Å; T323-E325 VanDerWaalsContact O-N 3.09Å; T323-E325 PolarHBondContact OG1-N 3.4Å; E325-R327 IonicContact OE2-CZ 3.13Å; E325-R327 VanDerWaalsContact OE2-CZ 3.27Å; E325-R327 IonicContact OE2-NE 3.37Å; E325-R327 PolarHBondContact OE2-NE 3.36Å; E325-R327 IonicContact OE2-NH2 3Å; E325-R327 PolarHBondContact OE2-NH2 3.48Å
326	K	76.8	Confident	82.2	Confident	117 Å²	117	85.8 Å²	85.8	51%	0.509	42%	0.422	S	S	.	.			trans	-102.2	83.6	172.7	-69.4	168	172	-172.5	0	109.6	G324 Y328 A336 F337 T338	G324-K326 PolarHBondContact O-N 3.47Å; K326-Y328 VanDerWaalsContact C-N 3.29Å; K326-Y328 PolarHBondContact O-N 2.99Å; K326-A336 HydrophobicContact CB-CB 3.41Å; K326-A336 VanDerWaalsContact CB-CB 3.41Å; K326-A336 HydrophobicContact CD-CB 3.97Å; K326-A336 WeakPolarHBondContact CD-O 3.24Å; K326-A336 HydrophobicContact CG-CB 4.29Å; K326-F337 CarbonylContact C-O 3.59Å; K326-F337 WeakPolarHBondContact CA-O 3.41Å; K326-T338 HydrophobicContact CG-CG2 4Å
327	R	78.6	Confident	82	Confident	142 Å²	142	84.1 Å²	84.1	54%	0.536	41%	0.413	S	S	.	.			trans	-70.3	-22.3	-174.6	-60.1	-173.8	-169.9	-169.3	2.5	114	E325 F337	E325-R327 IonicContact OE2-CZ 3.13Å; E325-R327 VanDerWaalsContact OE2-CZ 3.27Å; E325-R327 IonicContact OE2-NE 3.37Å; E325-R327 PolarHBondContact OE2-NE 3.36Å; E325-R327 IonicContact OE2-NH2 3Å; E325-R327 PolarHBondContact OE2-NH2 3.48Å; R327-F337 PolarHBondContact N-O 3.01Å
328	Y	81.2	Confident	81.8	Confident	76 Å²	76	81 Å²	81	30%	0.298	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	101	-173.4	-56.7	-75.2	0	0	0	109.8	K326 A336 F337 N339 Y340	K326-Y328 VanDerWaalsContact C-N 3.29Å; K326-Y328 PolarHBondContact O-N 2.99Å; Y328-A336 CarbonylContact O-C 3.55Å; Y328-A336 WeakPolarHBondContact O-CA 3.47Å; Y328-F337 PolarHBondContact N-O 3.5Å; Y328-F337 VanDerWaalsContact N-O 3.17Å; Y328-F337 PolarHBondContact O-N 3.36Å; Y328-N339 VanDerWaalsContact CD2-C 3.41Å; Y328-Y340 AromaticContact CD1-CD2 3.82Å; Y328-Y340 HydrophobicContact CD1-CD2 3.82Å; Y328-Y340 HydrophobicContact CD1-CG 4.47Å; Y328-Y340 AromaticContact CE1-CD2 3.98Å; Y328-Y340 HydrophobicContact CE1-CD2 3.98Å; Y328-Y340 HydrophobicContact CE1-CG 4.35Å
329	R	84.6	Confident	81.6	Confident	187 Å²	187	83.3 Å²	83.3	71%	0.706	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	140.7	178.2	-66.3	-171.8	-177.4	-158.1	2.8	111	A336	R329-A336 HydrophobicContact CG-CB 3.95Å
330	C	88.4	Confident	81.5	Confident	3 Å²	3	86 Å²	86	2%	0.02	42%	0.424	C	S	.	.			trans	-81.2	123.8	166.5	-179.4	0	0	0	0	108.8	E332 G334 K335 F337 L343	C330-E332 VanDerWaalsContact C-N 3.32Å; C330-G334 WeakPolarHBondContact O-CA 3.41Å; C330-G334 PolarHBondContact O-N 3.41Å; C330-K335 WeakPolarHBondContact CB-O 3.43Å; C330-K335 PolarHBondContact N-O 3.1Å; C330-F337 HydrophobicContact CB-CE2 4.47Å; C330-L343 HydrophobicContact CB-CD1 3.67Å
331	E	86	Confident	81.6	Confident	193 Å²	193	88.6 Å²	88.6	90%	0.902	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-34.1	179.2	-67.5	174.5	178	0	0	111.8
332	E	85.4	Confident	81.7	Confident	98 Å²	98	84.7 Å²	84.7	46%	0.458	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-27.4	-174.3	-65.5	164.6	-137.8	0	0	113.8	C330 R347 H350	C330-E332 VanDerWaalsContact C-N 3.32Å; E332-R347 IonicContact OE1-CZ 3.27Å; E332-R347 IonicContact OE1-NE 4Å; E332-R347 IonicContact OE1-NH2 2.99Å; E332-R347 PolarHBondContact OE1-NH2 3.3Å; E332-H350 WeakPolarHBondContact OE2-CB 3.23Å; E332-H350 IonicContact OE2-CD2 3.25Å; E332-H350 PolarHBondContact OE2-CD2 3.17Å; E332-H350 IonicContact OE2-CG 2.7Å; E332-H350 IonicContact OE2-ND1 3.6Å
333	C	85.8	Confident	82.1	Confident	52 Å²	52	81.9 Å²	81.9	35%	0.351	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	7.2	-179.9	72.5	0	0	0	0	115.5	K335 H346 H350	C333-K335 PolarHBondContact O-N 3.31Å; C333-H346 PolarHBondContact SG-NE2 3Å; C333-H350 PolarHBondContact SG-NE2 3.37Å
334	G	83.2	Confident	82.5	Confident	50 Å²	50	80.7 Å²	80.7	52%	0.515	41%	0.412	S	S	.	.			trans	68.8	-3.1	179.6	0	0	0	0	0	115.4	C330 A336	C330-G334 WeakPolarHBondContact O-CA 3.41Å; C330-G334 PolarHBondContact O-N 3.41Å; G334-A336 PolarHBondContact O-N 2.81Å
335	K	83.4	Confident	83.2	Confident	126 Å²	126	81 Å²	81	55%	0.548	40%	0.404	S	S	.	.			trans	-65.1	129.8	-177.8	-75.9	-179	-177.6	171.4	0	111.3	C330 C333 F337	C330-K335 WeakPolarHBondContact CB-O 3.43Å; C330-K335 PolarHBondContact N-O 3.1Å; C333-K335 PolarHBondContact O-N 3.31Å; K335-F337 HydrophobicContact CB-CE2 3.92Å; K335-F337 HydrophobicContact CB-CZ 4.16Å; K335-F337 WeakPolarHBondContact O-CE2 3.38Å
336	A	85.3	Confident	83.9	Confident	29 Å²	29	78 Å²	78	24%	0.24	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	141	-177.2	0	0	0	0	0	112	K326 Y328 R329 G334	K326-A336 HydrophobicContact CB-CB 3.41Å; K326-A336 VanDerWaalsContact CB-CB 3.41Å; K326-A336 HydrophobicContact CD-CB 3.97Å; K326-A336 WeakPolarHBondContact CD-O 3.24Å; K326-A336 HydrophobicContact CG-CB 4.29Å; Y328-A336 CarbonylContact O-C 3.55Å; Y328-A336 WeakPolarHBondContact O-CA 3.47Å; R329-A336 HydrophobicContact CG-CB 3.95Å; G334-A336 PolarHBondContact O-N 2.81Å
337	F	82.2	Confident	84.4	Confident	48 Å²	48	77.7 Å²	77.7	21%	0.211	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.3	-176.9	-61	-91	0	0	0	111.1	K326 R327 Y328 C330 K335 N339 L343 H346	K326-F337 CarbonylContact C-O 3.59Å; K326-F337 WeakPolarHBondContact CA-O 3.41Å; R327-F337 PolarHBondContact N-O 3.01Å; Y328-F337 PolarHBondContact N-O 3.5Å; Y328-F337 VanDerWaalsContact N-O 3.17Å; Y328-F337 PolarHBondContact O-N 3.36Å; C330-F337 HydrophobicContact CB-CE2 4.47Å; K335-F337 HydrophobicContact CB-CE2 3.92Å; K335-F337 HydrophobicContact CB-CZ 4.16Å; K335-F337 WeakPolarHBondContact O-CE2 3.38Å; F337-N339 VanDerWaalsContact C-N 3.31Å; F337-L343 HydrophobicContact CB-CB 4.44Å; F337-L343 HydrophobicContact CD2-CB 4.03Å; F337-L343 HydrophobicContact CD2-CD1 3.9Å; F337-L343 HydrophobicContact CE2-CD1 4.09Å; F337-L343 HydrophobicContact CG-CB 4.35Å; F337-H346 HydrophobicContact CE1-CB 3.84Å; F337-H346 HydrophobicContact CE2-CB 3.84Å; F337-H346 AromaticContact CE2-CD2 3.29Å; F337-H346 WeakPolarHBondContact CE2-CD2 3.32Å; F337-H346 AromaticContact CE2-CG 3.64Å; F337-H346 HydrophobicContact CZ-CB 3.33Å; F337-H346 AromaticContact CZ-CD2 3.3Å; F337-H346 WeakPolarHBondContact CZ-CD2 3.43Å; F337-H346 AromaticContact CZ-CG 3.16Å; F337-H346 AromaticContact CZ-ND1 3.81Å; F337-H346 AromaticContact CZ-NE2 3.94Å
338	T	79.3	Confident	84.9	Confident	42 Å²	42	73.2 Å²	73.2	26%	0.258	37%	0.369	S	S	.	.	S	Bend	trans	-75.6	-21.9	175.6	51.3	0	0	0	0	112.5	R320 K326	R320-T338 PolarHBondContact NH1-O 3.13Å; K326-T338 HydrophobicContact CG-CG2 4Å
339	N	80.8	Confident	85.2	Confident	70 Å²	70	74.4 Å²	74.4	37%	0.374	38%	0.384	S	S	.	.	S	Bend	trans	-133.2	138.3	-170.3	-46.6	12.9	0	0	0	110.4	Y328 F337 S341 G342 L343	Y328-N339 VanDerWaalsContact CD2-C 3.41Å; F337-N339 VanDerWaalsContact C-N 3.31Å; N339-S341 PolarHBondContact O-N 3.33Å; N339-G342 PolarHBondContact O-N 3.43Å; N339-G342 VanDerWaalsContact O-N 3.12Å; N339-L343 PolarHBondContact O-N 3.44Å
340	Y	81.9	Confident	85.3	Confident	134 Å²	134	69 Å²	69	53%	0.525	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-42.8	177.1	-175.5	-108	0	0	0	113.3	Y328 G342 L343 I344	Y328-Y340 AromaticContact CD1-CD2 3.82Å; Y328-Y340 HydrophobicContact CD1-CD2 3.82Å; Y328-Y340 HydrophobicContact CD1-CG 4.47Å; Y328-Y340 AromaticContact CE1-CD2 3.98Å; Y328-Y340 HydrophobicContact CE1-CD2 3.98Å; Y328-Y340 HydrophobicContact CE1-CG 4.35Å; Y340-G342 PolarHBondContact O-N 2.99Å; Y340-L343 WeakPolarHBondContact O-CB 3.46Å; Y340-L343 PolarHBondContact O-N 2.87Å; Y340-I344 HydrophobicContact CD1-CG1 4.1Å; Y340-I344 HydrophobicContact CE1-CD1 4.03Å; Y340-I344 HydrophobicContact CE1-CG1 3.7Å; Y340-I344 HydrophobicContact CE2-CD1 4.33Å; Y340-I344 HydrophobicContact CE2-CG1 4.48Å; Y340-I344 PolarHBondContact O-N 3.38Å
341	S	85	Confident	85.1	Confident	89 Å²	89	72.2 Å²	72.2	62%	0.622	39%	0.386	S	S	*	.	H	α-helix	trans	-59.9	-31.7	176.9	-47.8	0	0	0	0	112.8	N339 V345	N339-S341 PolarHBondContact O-N 3.33Å; S341-V345 WeakPolarHBondContact O-CG2 3.42Å; S341-V345 PolarHBondContact O-N 2.91Å; S341-V345 VanDerWaalsContact O-N 3.09Å
342	G	85	Confident	85.1	Confident	29 Å²	29	65.3 Å²	65.3	30%	0.299	37%	0.367	S	S	.	.	H	α-helix	trans	-68	-40.7	175.4	0	0	0	0	0	111.9	N339 Y340 H346	N339-G342 PolarHBondContact O-N 3.43Å; N339-G342 VanDerWaalsContact O-N 3.12Å; Y340-G342 PolarHBondContact O-N 2.99Å; G342-H346 VanDerWaalsContact O-CB 3.32Å; G342-H346 WeakPolarHBondContact O-CB 3.44Å; G342-H346 PolarHBondContact O-N 3.23Å
343	L	87.1	Confident	85.2	Confident	17 Å²	17	65.9 Å²	65.9	9%	0.089	37%	0.369	C	S	.	.	H	α-helix	trans	-61.7	-47.3	173.4	174.1	62.2	0	0	0	111.3	C330 F337 N339 Y340 V345 H346 R347	C330-L343 HydrophobicContact CB-CD1 3.67Å; F337-L343 HydrophobicContact CB-CB 4.44Å; F337-L343 HydrophobicContact CD2-CB 4.03Å; F337-L343 HydrophobicContact CD2-CD1 3.9Å; F337-L343 HydrophobicContact CE2-CD1 4.09Å; F337-L343 HydrophobicContact CG-CB 4.35Å; N339-L343 PolarHBondContact O-N 3.44Å; Y340-L343 WeakPolarHBondContact O-CB 3.46Å; Y340-L343 PolarHBondContact O-N 2.87Å; L343-V345 PolarHBondContact O-N 3.43Å; L343-H346 CarbonylContact O-C 3.53Å; L343-H346 WeakPolarHBondContact O-CA 3.4Å; L343-H346 WeakPolarHBondContact O-CB 2.97Å; L343-H346 PolarHBondContact O-N 3.42Å; L343-H346 VanDerWaalsContact O-N 3.08Å; L343-R347 HydrophobicContact CD1-CG 4.28Å; L343-R347 WeakPolarHBondContact O-CG 3.42Å; L343-R347 PolarHBondContact O-N 3.37Å
344	I	86.6	Confident	85.3	Confident	61 Å²	61	69 Å²	69	31%	0.313	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-45.3	179.1	-65.5	-59.6	0	0	0	112	Y340 H346 R347	Y340-I344 HydrophobicContact CD1-CG1 4.1Å; Y340-I344 HydrophobicContact CE1-CD1 4.03Å; Y340-I344 HydrophobicContact CE1-CG1 3.7Å; Y340-I344 HydrophobicContact CE2-CD1 4.33Å; Y340-I344 HydrophobicContact CE2-CG1 4.48Å; Y340-I344 PolarHBondContact O-N 3.38Å; I344-H346 VanDerWaalsContact C-N 3.27Å; I344-H346 PolarHBondContact O-N 2.97Å; I344-R347 PolarHBondContact O-N 3.09Å
345	V	87	Confident	85.6	Confident	53 Å²	53	70.1 Å²	70.1	32%	0.321	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-38.1	175.6	168.5	0	0	0	0	111.1	S341 L343 R348 V367	S341-V345 WeakPolarHBondContact O-CG2 3.42Å; S341-V345 PolarHBondContact O-N 2.91Å; S341-V345 VanDerWaalsContact O-N 3.09Å; L343-V345 PolarHBondContact O-N 3.43Å; V345-R348 WeakPolarHBondContact O-CB 3.34Å; V345-R348 PolarHBondContact O-N 3.06Å; V345-V367 HydrophobicContact CG1-CG2 3.43Å; V345-V367 VanDerWaalsContact CG1-CG2 3.43Å
346	H	88	Confident	86	Confident	22 Å²	22	67.7 Å²	67.7	10%	0.102	36%	0.363	C	S	.	.	H	α-helix	trans	-67.2	-38.9	177.6	173.4	60	0	0	0	113.1	C333 F337 G342 L343 I344 R348 V349 H350	C333-H346 PolarHBondContact SG-NE2 3Å; F337-H346 HydrophobicContact CE1-CB 3.84Å; F337-H346 HydrophobicContact CE2-CB 3.84Å; F337-H346 AromaticContact CE2-CD2 3.29Å; F337-H346 WeakPolarHBondContact CE2-CD2 3.32Å; F337-H346 AromaticContact CE2-CG 3.64Å; F337-H346 HydrophobicContact CZ-CB 3.33Å; F337-H346 AromaticContact CZ-CD2 3.3Å; F337-H346 WeakPolarHBondContact CZ-CD2 3.43Å; F337-H346 AromaticContact CZ-CG 3.16Å; F337-H346 AromaticContact CZ-ND1 3.81Å; F337-H346 AromaticContact CZ-NE2 3.94Å; G342-H346 VanDerWaalsContact O-CB 3.32Å; G342-H346 WeakPolarHBondContact O-CB 3.44Å; G342-H346 PolarHBondContact O-N 3.23Å; L343-H346 CarbonylContact O-C 3.53Å; L343-H346 WeakPolarHBondContact O-CA 3.4Å; L343-H346 WeakPolarHBondContact O-CB 2.97Å; L343-H346 PolarHBondContact O-N 3.42Å; L343-H346 VanDerWaalsContact O-N 3.08Å; I344-H346 VanDerWaalsContact C-N 3.27Å; I344-H346 PolarHBondContact O-N 2.97Å; H346-R348 PolarHBondContact O-N 3.45Å; H346-R348 VanDerWaalsContact O-N 3.11Å; H346-V349 VanDerWaalsContact O-CB 3.23Å; H346-V349 WeakPolarHBondContact O-CB 2.91Å; H346-V349 WeakPolarHBondContact O-CG2 3.46Å; H346-V349 PolarHBondContact O-N 3.1Å; H346-H350 AromaticContact CE1-NE2 3.73Å; H346-H350 AromaticContact NE2-NE2 3.38Å; H346-H350 PolarHBondContact NE2-NE2 3.18Å
347	R	86.7	Confident	86.1	Confident	111 Å²	111	73 Å²	73	42%	0.419	38%	0.381	S	S	.	.	H	α-helix	trans	-56.1	-30	177.3	-70.7	-165.2	76.6	-152.9	1.9	112.8	E332 L343 I344 V349 H350 T351	E332-R347 IonicContact OE1-CZ 3.27Å; E332-R347 IonicContact OE1-NE 4Å; E332-R347 IonicContact OE1-NH2 2.99Å; E332-R347 PolarHBondContact OE1-NH2 3.3Å; L343-R347 HydrophobicContact CD1-CG 4.28Å; L343-R347 WeakPolarHBondContact O-CG 3.42Å; L343-R347 PolarHBondContact O-N 3.37Å; I344-R347 PolarHBondContact O-N 3.09Å; R347-V349 PolarHBondContact O-N 3.3Å; R347-V349 VanDerWaalsContact O-N 3.13Å; R347-H350 PolarHBondContact O-N 3.48Å; R347-T351 PolarHBondContact O-N 2.91Å; R347-T351 VanDerWaalsContact O-N 3.13Å
348	R	89.4	Confident	86.6	Confident	47 Å²	47	70.8 Å²	70.8	18%	0.177	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-20	174.3	-60.3	178.1	-177.1	164	0.3	114.1	V345 H346 H350 T351 G352 E353 S366	V345-R348 WeakPolarHBondContact O-CB 3.34Å; V345-R348 PolarHBondContact O-N 3.06Å; H346-R348 PolarHBondContact O-N 3.45Å; H346-R348 VanDerWaalsContact O-N 3.11Å; R348-H350 VanDerWaalsContact C-N 3.32Å; R348-T351 WeakPolarHBondContact CA-OG1 3.41Å; R348-G352 CarbonylContact O-C 3.4Å; R348-G352 WeakPolarHBondContact O-CA 3.39Å; R348-G352 PolarHBondContact O-N 3.43Å; R348-E353 HydrophobicContact CB-CB 4.41Å; R348-E353 HydrophobicContact CG-CB 4.31Å; R348-E353 PolarHBondContact O-N 2.99Å; R348-S366 WeakPolarHBondContact CD-O 3.44Å; R348-S366 PolarHBondContact NH1-O 3.45Å
349	V	87.6	Confident	87	Confident	101 Å²	101	77.1 Å²	77.1	61%	0.612	40%	0.398	S	S	*	.	H	α-helix	trans	-69.5	-35.1	173.9	179.4	0	0	0	0	110.7	H346 R347	H346-V349 VanDerWaalsContact O-CB 3.23Å; H346-V349 WeakPolarHBondContact O-CB 2.91Å; H346-V349 WeakPolarHBondContact O-CG2 3.46Å; H346-V349 PolarHBondContact O-N 3.1Å; R347-V349 PolarHBondContact O-N 3.3Å; R347-V349 VanDerWaalsContact O-N 3.13Å
350	H	86.1	Confident	87.2	Confident	74 Å²	74	79.9 Å²	79.9	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-81.7	-43.1	179.2	-60.3	-63.6	0	0	0	112.1	E332 C333 H346 R347 R348 G352	E332-H350 WeakPolarHBondContact OE2-CB 3.23Å; E332-H350 IonicContact OE2-CD2 3.25Å; E332-H350 PolarHBondContact OE2-CD2 3.17Å; E332-H350 IonicContact OE2-CG 2.7Å; E332-H350 IonicContact OE2-ND1 3.6Å; C333-H350 PolarHBondContact SG-NE2 3.37Å; H346-H350 AromaticContact CE1-NE2 3.73Å; H346-H350 AromaticContact NE2-NE2 3.38Å; H346-H350 PolarHBondContact NE2-NE2 3.18Å; R347-H350 PolarHBondContact O-N 3.48Å; R348-H350 VanDerWaalsContact C-N 3.32Å; H350-G352 PolarHBondContact O-N 2.97Å
351	T	85.9	Confident	87.5	Confident	71 Å²	71	76 Å²	76	44%	0.436	40%	0.4	S	S	.	.	H	α-helix	trans	-75.7	-14.7	178.4	64.3	0	0	0	0	113.1	R347 R348 E353	R347-T351 PolarHBondContact O-N 2.91Å; R347-T351 VanDerWaalsContact O-N 3.13Å; R348-T351 WeakPolarHBondContact CA-OG1 3.41Å; T351-E353 PolarHBondContact O-N 2.8Å; T351-E353 WeakPolarHBondContact OG1-CB 3.34Å; T351-E353 WeakPolarHBondContact OG1-CG 3.48Å; T351-E353 PolarHBondContact OG1-N 3.07Å
352	G	84.8	Confident	87.5	Confident	47 Å²	47	74.5 Å²	74.5	49%	0.485	40%	0.399	S	S	.	.			trans	70.2	4.9	-174.6	0	0	0	0	0	114.1	R348 H350 K354	R348-G352 CarbonylContact O-C 3.4Å; R348-G352 WeakPolarHBondContact O-CA 3.39Å; R348-G352 PolarHBondContact O-N 3.43Å; H350-G352 PolarHBondContact O-N 2.97Å; G352-K354 PolarHBondContact O-N 3.12Å
353	E	87.6	Confident	87.6	Confident	110 Å²	110	79.1 Å²	79.1	51%	0.514	41%	0.411	S	S	.	.			trans	-60.5	124.6	-178.3	-78	177.9	-166.3	0	0	111.9	R348 T351	R348-E353 HydrophobicContact CB-CB 4.41Å; R348-E353 HydrophobicContact CG-CB 4.31Å; R348-E353 PolarHBondContact O-N 2.99Å; T351-E353 PolarHBondContact O-N 2.8Å; T351-E353 WeakPolarHBondContact OG1-CB 3.34Å; T351-E353 WeakPolarHBondContact OG1-CG 3.48Å; T351-E353 PolarHBondContact OG1-N 3.07Å
354	K	89.1	Confident	87.7	Confident	119 Å²	119	79.8 Å²	79.8	52%	0.517	42%	0.419	S	S	.	.			trans	-126.3	78.7	176.2	-68.8	171.3	-180	-178.1	0	110	G352 Y356 A364 F365	G352-K354 PolarHBondContact O-N 3.12Å; K354-Y356 PolarHBondContact O-N 3.32Å; K354-A364 HydrophobicContact CB-CB 3.53Å; K354-A364 HydrophobicContact CD-CB 4.11Å; K354-A364 WeakPolarHBondContact CD-O 3.41Å; K354-A364 HydrophobicContact CG-CB 4.45Å; K354-F365 CarbonylContact C-O 3.53Å; K354-F365 WeakPolarHBondContact CA-O 3.47Å
355	P	89.6	Confident	87.8	Confident	72 Å²	72	79 Å²	79	47%	0.468	41%	0.413	S	S	.	.			trans	-65.3	-22.3	-173.2	-22.2	34.2	0	0	0	114
356	Y	90.8	Very high	87.8	Confident	76 Å²	76	78.4 Å²	78.4	30%	0.298	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	97.8	-172.3	-54.9	-76.6	0	0	0	109.9	K354 A364 F365 V367 H368	K354-Y356 PolarHBondContact O-N 3.32Å; Y356-A364 CarbonylContact O-C 3.59Å; Y356-A364 WeakPolarHBondContact O-CA 3.41Å; Y356-F365 PolarHBondContact N-O 2.78Å; Y356-F365 VanDerWaalsContact N-O 3.17Å; Y356-F365 PolarHBondContact O-N 2.83Å; Y356-V367 VanDerWaalsContact CD2-C 3.45Å; Y356-H368 HydrophobicContact CD1-CB 3.99Å; Y356-H368 VanDerWaalsContact CD2-N 3.33Å; Y356-H368 HydrophobicContact CE1-CB 3.78Å; Y356-H368 HydrophobicContact CE2-CB 4.33Å; Y356-H368 HydrophobicContact CG-CB 4.36Å
357	K	87.9	Confident	87.8	Confident	140 Å²	140	79.1 Å²	79.1	61%	0.609	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	143.1	178.2	-61.9	-177.2	-178	178.2	0	110.7	A364	K357-A364 HydrophobicContact CG-CB 3.95Å
358	C	91.4	Very high	87.8	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.014	42%	0.419	C	S	.	.			trans	-87.5	118.4	169.8	177.7	0	0	0	0	108.6	E360 C361 G362 K363 F365 L371 H378	C358-E360 VanDerWaalsContact C-N 3.27Å; C358-E360 PolarHBondContact O-N 3.23Å; C358-C361 VanDerWaalsContact SG-SG 3.62Å; C358-G362 WeakPolarHBondContact O-CA 3.42Å; C358-G362 PolarHBondContact O-N 3.05Å; C358-K363 WeakPolarHBondContact CB-O 3.33Å; C358-K363 PolarHBondContact N-O 3.33Å; C358-F365 HydrophobicContact CB-CE2 4.46Å; C358-L371 HydrophobicContact CB-CD1 3.61Å; C358-H378 PolarHBondContact SG-NE2 3.05Å; C358-H378 VanDerWaalsContact SG-NE2 3.35Å
359	E	88	Confident	87.7	Confident	175 Å²	175	80.3 Å²	80.3	82%	0.818	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-34	-180	-60.1	-55.3	143.3	0	0	112.4
360	E	86.2	Confident	87.7	Confident	127 Å²	127	77.7 Å²	77.7	59%	0.593	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-27	-174.1	-63.4	-178.7	-134.9	0	0	114.5	C358 H378	C358-E360 VanDerWaalsContact C-N 3.27Å; C358-E360 PolarHBondContact O-N 3.23Å; E360-H378 WeakPolarHBondContact OE2-CB 3.21Å; E360-H378 IonicContact OE2-CD2 3.93Å; E360-H378 IonicContact OE2-CG 2.88Å; E360-H378 VanDerWaalsContact OE2-CG 3.25Å
361	C	87.2	Confident	87.9	Confident	53 Å²	53	74.8 Å²	74.8	36%	0.358	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136	7.6	-176.8	74	0	0	0	0	114.5	C358 K363 H374	C358-C361 VanDerWaalsContact SG-SG 3.62Å; C361-K363 PolarHBondContact O-N 2.81Å; C361-H374 PolarHBondContact SG-NE2 3.43Å
362	G	84.9	Confident	87.9	Confident	57 Å²	57	73.3 Å²	73.3	59%	0.588	40%	0.401	S	S	*	.			trans	67.2	-3.4	-179.7	0	0	0	0	0	115.5	C358 A364	C358-G362 WeakPolarHBondContact O-CA 3.42Å; C358-G362 PolarHBondContact O-N 3.05Å; G362-A364 PolarHBondContact O-N 3.36Å
363	K	86.9	Confident	87.9	Confident	127 Å²	127	76.2 Å²	76.2	55%	0.552	40%	0.4	S	S	*	.			trans	-66.6	126.9	-177.6	-73.8	-179.6	-178.3	171.4	0	111.1	C358 C361 F365	C358-K363 WeakPolarHBondContact CB-O 3.33Å; C358-K363 PolarHBondContact N-O 3.33Å; C361-K363 PolarHBondContact O-N 2.81Å; K363-F365 HydrophobicContact CB-CE2 3.96Å; K363-F365 HydrophobicContact CB-CZ 4.12Å; K363-F365 WeakPolarHBondContact O-CE2 3.11Å
364	A	89.6	Confident	87.8	Confident	31 Å²	31	72 Å²	72	26%	0.256	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	145.2	179.9	0	0	0	0	0	112.4	K354 Y356 K357 G362	K354-A364 HydrophobicContact CB-CB 3.53Å; K354-A364 HydrophobicContact CD-CB 4.11Å; K354-A364 WeakPolarHBondContact CD-O 3.41Å; K354-A364 HydrophobicContact CG-CB 4.45Å; Y356-A364 CarbonylContact O-C 3.59Å; Y356-A364 WeakPolarHBondContact O-CA 3.41Å; K357-A364 HydrophobicContact CG-CB 3.95Å; G362-A364 PolarHBondContact O-N 3.36Å
365	F	88.8	Confident	87.6	Confident	45 Å²	45	69.9 Å²	69.9	20%	0.197	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.9	-178.5	-58.8	-89.4	0	0	0	111.2	K354 Y356 C358 K363 L371 H374	K354-F365 CarbonylContact C-O 3.53Å; K354-F365 WeakPolarHBondContact CA-O 3.47Å; Y356-F365 PolarHBondContact N-O 2.78Å; Y356-F365 VanDerWaalsContact N-O 3.17Å; Y356-F365 PolarHBondContact O-N 2.83Å; C358-F365 HydrophobicContact CB-CE2 4.46Å; K363-F365 HydrophobicContact CB-CE2 3.96Å; K363-F365 HydrophobicContact CB-CZ 4.12Å; K363-F365 WeakPolarHBondContact O-CE2 3.11Å; F365-L371 HydrophobicContact CB-CB 4.38Å; F365-L371 HydrophobicContact CD2-CB 3.91Å; F365-L371 HydrophobicContact CD2-CD1 3.81Å; F365-L371 HydrophobicContact CD2-CG 4.48Å; F365-L371 HydrophobicContact CE2-CD1 3.97Å; F365-L371 HydrophobicContact CG-CB 4.33Å; F365-H374 HydrophobicContact CE1-CB 4.04Å; F365-H374 HydrophobicContact CE2-CB 3.82Å; F365-H374 AromaticContact CE2-CD2 3.49Å; F365-H374 VanDerWaalsContact CE2-CD2 3.49Å; F365-H374 WeakPolarHBondContact CE2-CD2 3.45Å; F365-H374 AromaticContact CE2-CG 3.64Å; F365-H374 HydrophobicContact CZ-CB 3.41Å; F365-H374 VanDerWaalsContact CZ-CB 3.41Å; F365-H374 AromaticContact CZ-CD2 3.6Å; F365-H374 AromaticContact CZ-CG 3.27Å; F365-H374 AromaticContact CZ-ND1 3.8Å
366	S	86.7	Confident	87.4	Confident	39 Å²	39	69.8 Å²	69.8	27%	0.273	36%	0.362	S	S	.	.	S	Bend	trans	-80.5	-15.4	178.7	55.8	0	0	0	0	113.7	R348	R348-S366 WeakPolarHBondContact CD-O 3.44Å; R348-S366 PolarHBondContact NH1-O 3.45Å
367	V	88.4	Confident	87	Confident	37 Å²	37	71.3 Å²	71.3	22%	0.224	37%	0.374	C	S	.	.	S	Bend	trans	-139	136	-178.1	-170	0	0	0	0	110.5	V345 Y356 T369 S370 L371	V345-V367 HydrophobicContact CG1-CG2 3.43Å; V345-V367 VanDerWaalsContact CG1-CG2 3.43Å; Y356-V367 VanDerWaalsContact CD2-C 3.45Å; V367-T369 VanDerWaalsContact C-N 3.31Å; V367-T369 WeakPolarHBondContact CG1-OG1 3.43Å; V367-T369 PolarHBondContact O-N 3.26Å; V367-S370 WeakPolarHBondContact O-CB 3.37Å; V367-S370 PolarHBondContact O-N 3.11Å; V367-L371 PolarHBondContact O-N 2.8Å
368	H	87.5	Confident	86.7	Confident	100 Å²	100	67.4 Å²	67.4	46%	0.463	36%	0.358	S	S	.	.	H	α-helix	trans	-54	-42.4	179.7	-178.2	-87.5	0	0	0	113.2	Y356 S370 L371 S372	Y356-H368 HydrophobicContact CD1-CB 3.99Å; Y356-H368 VanDerWaalsContact CD2-N 3.33Å; Y356-H368 HydrophobicContact CE1-CB 3.78Å; Y356-H368 HydrophobicContact CE2-CB 4.33Å; Y356-H368 HydrophobicContact CG-CB 4.36Å; H368-S370 PolarHBondContact O-N 2.9Å; H368-S370 VanDerWaalsContact O-N 3.15Å; H368-L371 WeakPolarHBondContact O-CA 3.39Å; H368-L371 WeakPolarHBondContact O-CB 3.45Å; H368-L371 PolarHBondContact O-N 3.13Å; H368-S372 PolarHBondContact CE1-OG 2.75Å; H368-S372 PolarHBondContact ND1-OG 3.27Å; H368-S372 PolarHBondContact O-N 3.14Å; H368-S372 PolarHBondContact O-OG 3.4Å
369	T	87.2	Confident	86.1	Confident	83 Å²	83	70.8 Å²	70.8	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-28.5	179.1	55.4	0	0	0	0	113.3	V367 K373	V367-T369 VanDerWaalsContact C-N 3.31Å; V367-T369 WeakPolarHBondContact CG1-OG1 3.43Å; V367-T369 PolarHBondContact O-N 3.26Å; T369-K373 VanDerWaalsContact O-CG 3.29Å; T369-K373 WeakPolarHBondContact O-CG 3.3Å; T369-K373 PolarHBondContact O-N 3.01Å
370	S	87.5	Confident	85.4	Confident	47 Å²	47	72.8 Å²	72.8	33%	0.329	38%	0.379	S	S	.	.	H	α-helix	trans	-75.2	-40	176.5	-57.8	0	0	0	0	110.8	V367 H368 K373 H374	V367-S370 WeakPolarHBondContact O-CB 3.37Å; V367-S370 PolarHBondContact O-N 3.11Å; H368-S370 PolarHBondContact O-N 2.9Å; H368-S370 VanDerWaalsContact O-N 3.15Å; S370-K373 PolarHBondContact O-N 3.14Å; S370-H374 WeakPolarHBondContact O-CB 3.41Å; S370-H374 PolarHBondContact O-N 2.85Å
371	L	89.1	Confident	84.9	Confident	13 Å²	13	72.1 Å²	72.1	7%	0.068	38%	0.376	C	S	.	.	H	α-helix	trans	-60.4	-49.2	171	174.6	63.9	0	0	0	110.9	C358 F365 V367 H368 K373 H374 Q375	C358-L371 HydrophobicContact CB-CD1 3.61Å; F365-L371 HydrophobicContact CB-CB 4.38Å; F365-L371 HydrophobicContact CD2-CB 3.91Å; F365-L371 HydrophobicContact CD2-CD1 3.81Å; F365-L371 HydrophobicContact CD2-CG 4.48Å; F365-L371 HydrophobicContact CE2-CD1 3.97Å; F365-L371 HydrophobicContact CG-CB 4.33Å; V367-L371 PolarHBondContact O-N 2.8Å; H368-L371 WeakPolarHBondContact O-CA 3.39Å; H368-L371 WeakPolarHBondContact O-CB 3.45Å; H368-L371 PolarHBondContact O-N 3.13Å; L371-K373 VanDerWaalsContact C-N 3.3Å; L371-K373 PolarHBondContact O-N 3.25Å; L371-H374 CarbonylContact O-C 3.28Å; L371-H374 WeakPolarHBondContact O-CA 3.2Å; L371-H374 WeakPolarHBondContact O-CB 3.37Å; L371-H374 PolarHBondContact O-N 3.47Å; L371-Q375 HydrophobicContact CD1-CG 4.12Å; L371-Q375 HydrophobicContact CG-CG 4.35Å; L371-Q375 WeakPolarHBondContact O-CG 3.38Å; L371-Q375 PolarHBondContact O-N 3.1Å
372	S	86.4	Confident	84.4	Confident	40 Å²	40	73.7 Å²	73.7	28%	0.28	38%	0.378	S	S	.	.	H	α-helix	trans	-60.5	-37.6	179.5	-49.7	0	0	0	0	112.8	H368 H374	H368-S372 PolarHBondContact CE1-OG 2.75Å; H368-S372 PolarHBondContact ND1-OG 3.27Å; H368-S372 PolarHBondContact O-N 3.14Å; H368-S372 PolarHBondContact O-OG 3.4Å; S372-H374 VanDerWaalsContact C-N 3.33Å
373	K	85	Confident	84.3	Confident	108 Å²	108	74.7 Å²	74.7	47%	0.47	37%	0.374	S	S	.	.	H	α-helix	trans	-67.2	-36.2	173.5	-75.1	173.7	-175.2	178.5	0	112.1	T369 S370 L371	T369-K373 VanDerWaalsContact O-CG 3.29Å; T369-K373 WeakPolarHBondContact O-CG 3.3Å; T369-K373 PolarHBondContact O-N 3.01Å; S370-K373 PolarHBondContact O-N 3.14Å; L371-K373 VanDerWaalsContact C-N 3.3Å; L371-K373 PolarHBondContact O-N 3.25Å
374	H	86.3	Confident	84.1	Confident	20 Å²	20	71.8 Å²	71.8	9%	0.093	36%	0.36	C	S	.	.	H	α-helix	trans	-69.7	-41	177.6	170.2	68.5	0	0	0	112.2	C361 F365 S370 L371 S372 R376 I377 H378	C361-H374 PolarHBondContact SG-NE2 3.43Å; F365-H374 HydrophobicContact CE1-CB 4.04Å; F365-H374 HydrophobicContact CE2-CB 3.82Å; F365-H374 AromaticContact CE2-CD2 3.49Å; F365-H374 VanDerWaalsContact CE2-CD2 3.49Å; F365-H374 WeakPolarHBondContact CE2-CD2 3.45Å; F365-H374 AromaticContact CE2-CG 3.64Å; F365-H374 HydrophobicContact CZ-CB 3.41Å; F365-H374 VanDerWaalsContact CZ-CB 3.41Å; F365-H374 AromaticContact CZ-CD2 3.6Å; F365-H374 AromaticContact CZ-CG 3.27Å; F365-H374 AromaticContact CZ-ND1 3.8Å; S370-H374 WeakPolarHBondContact O-CB 3.41Å; S370-H374 PolarHBondContact O-N 2.85Å; L371-H374 CarbonylContact O-C 3.28Å; L371-H374 WeakPolarHBondContact O-CA 3.2Å; L371-H374 WeakPolarHBondContact O-CB 3.37Å; L371-H374 PolarHBondContact O-N 3.47Å; S372-H374 VanDerWaalsContact C-N 3.33Å; H374-R376 PolarHBondContact O-N 2.75Å; H374-R376 VanDerWaalsContact O-N 3.14Å; H374-I377 VanDerWaalsContact O-CB 3.22Å; H374-I377 WeakPolarHBondContact O-CB 3.38Å; H374-I377 WeakPolarHBondContact O-CG1 3.43Å; H374-I377 PolarHBondContact O-N 3.19Å; H374-H378 AromaticContact CD2-NE2 3.97Å; H374-H378 AromaticContact CE1-NE2 3.7Å; H374-H378 AromaticContact NE2-CE1 3.91Å; H374-H378 AromaticContact NE2-NE2 3.16Å; H374-H378 PolarHBondContact NE2-NE2 3.18Å; H374-H378 VanDerWaalsContact NE2-NE2 3.16Å
375	Q	85.1	Confident	83.8	Confident	76 Å²	76	76.4 Å²	76.4	36%	0.355	37%	0.374	S	S	.	.	H	α-helix	trans	-57.1	-29.5	178.2	-74.9	173.2	-52.4	0	0	112.9	L371 I377 H378 T379	L371-Q375 HydrophobicContact CD1-CG 4.12Å; L371-Q375 HydrophobicContact CG-CG 4.35Å; L371-Q375 WeakPolarHBondContact O-CG 3.38Å; L371-Q375 PolarHBondContact O-N 3.1Å; Q375-I377 PolarHBondContact O-N 3.45Å; Q375-I377 VanDerWaalsContact O-N 3.12Å; Q375-H378 PolarHBondContact O-N 3.03Å; Q375-T379 PolarHBondContact O-N 3.2Å; Q375-T379 VanDerWaalsContact O-N 3.12Å; Q375-T379 PolarHBondContact O-OG1 2.75Å
376	R	84.2	Confident	83.7	Confident	69 Å²	69	74.4 Å²	74.4	26%	0.26	37%	0.366	S	S	.	.	H	α-helix	trans	-61	-19.7	173.7	-64.1	178.1	-176.3	-170.3	-6.1	114.4	H374 H378 T379 R380 E381 S394	H374-R376 PolarHBondContact O-N 2.75Å; H374-R376 VanDerWaalsContact O-N 3.14Å; R376-H378 VanDerWaalsContact C-N 3.34Å; R376-T379 WeakPolarHBondContact CA-OG1 3.38Å; R376-R380 WeakPolarHBondContact O-CA 3.48Å; R376-R380 PolarHBondContact O-N 3.08Å; R376-E381 PolarHBondContact O-N 3.34Å; R376-S394 VanDerWaalsContact CD-O 3.29Å; R376-S394 WeakPolarHBondContact CD-O 3.37Å; R376-S394 PolarHBondContact NH1-O 3.46Å
377	I	81.9	Confident	83.5	Confident	108 Å²	108	79.6 Å²	79.6	55%	0.554	39%	0.391	S	S	*	.	H	α-helix	trans	-69.9	-39.2	174.8	-62.7	169.7	0	0	0	109.7	H374 Q375	H374-I377 VanDerWaalsContact O-CB 3.22Å; H374-I377 WeakPolarHBondContact O-CB 3.38Å; H374-I377 WeakPolarHBondContact O-CG1 3.43Å; H374-I377 PolarHBondContact O-N 3.19Å; Q375-I377 PolarHBondContact O-N 3.45Å; Q375-I377 VanDerWaalsContact O-N 3.12Å
378	H	81.4	Confident	83.2	Confident	59 Å²	59	84.5 Å²	84.5	27%	0.273	41%	0.411	S	S	.	.	H	α-helix	trans	-79.9	-42	-178.1	-53.3	-51.6	0	0	0	112.3	C358 E360 H374 Q375 R376 R380	C358-H378 PolarHBondContact SG-NE2 3.05Å; C358-H378 VanDerWaalsContact SG-NE2 3.35Å; E360-H378 WeakPolarHBondContact OE2-CB 3.21Å; E360-H378 IonicContact OE2-CD2 3.93Å; E360-H378 IonicContact OE2-CG 2.88Å; E360-H378 VanDerWaalsContact OE2-CG 3.25Å; H374-H378 AromaticContact CD2-NE2 3.97Å; H374-H378 AromaticContact CE1-NE2 3.7Å; H374-H378 AromaticContact NE2-CE1 3.91Å; H374-H378 AromaticContact NE2-NE2 3.16Å; H374-H378 PolarHBondContact NE2-NE2 3.18Å; H374-H378 VanDerWaalsContact NE2-NE2 3.16Å; Q375-H378 PolarHBondContact O-N 3.03Å; R376-H378 VanDerWaalsContact C-N 3.34Å; H378-R380 PolarHBondContact O-N 3.25Å
379	T	79.1	Confident	83	Confident	73 Å²	73	82.2 Å²	82.2	45%	0.448	41%	0.406	S	S	.	.	S	Bend	trans	-72.1	-8.9	175.7	63.3	0	0	0	0	113.2	Q375 R376 E381	Q375-T379 PolarHBondContact O-N 3.2Å; Q375-T379 VanDerWaalsContact O-N 3.12Å; Q375-T379 PolarHBondContact O-OG1 2.75Å; R376-T379 WeakPolarHBondContact CA-OG1 3.38Å; T379-E381 PolarHBondContact O-N 3.28Å; T379-E381 WeakPolarHBondContact OG1-CG 3.45Å
380	R	74.2	Confident	82.7	Confident	216 Å²	216	80.2 Å²	80.2	82%	0.815	40%	0.402	S	S	*	.			trans	51.4	19.5	-171.1	-60.2	-175.1	178.9	-173	1.1	113.8	R376 H378 Q382	R376-R380 WeakPolarHBondContact O-CA 3.48Å; R376-R380 PolarHBondContact O-N 3.08Å; H378-R380 PolarHBondContact O-N 3.25Å; R380-Q382 PolarHBondContact O-N 2.88Å
381	E	74.6	Confident	82.4	Confident	113 Å²	113	84 Å²	84	53%	0.528	41%	0.412	S	S	.	.			trans	-66.2	118.6	176.6	-76.5	-178.9	176.8	0	0	109.8	R376 T379 P383	R376-E381 PolarHBondContact O-N 3.34Å; T379-E381 PolarHBondContact O-N 3.28Å; T379-E381 WeakPolarHBondContact OG1-CG 3.45Å; E381-P383 WeakPolarHBondContact O-CD 3.42Å
382	Q	77.9	Confident	82.2	Confident	87 Å²	87	86.4 Å²	86.4	41%	0.407	43%	0.428	S	S	.	.			trans	-122.2	78.7	174.6	-63.1	-158.4	-19.1	0	0	110.2	R380 Y384 T392 F393	R380-Q382 PolarHBondContact O-N 2.88Å; Q382-Y384 PolarHBondContact O-N 3.02Å; Q382-Y384 VanDerWaalsContact O-N 3.12Å; Q382-T392 PolarHBondContact OE1-O 3.12Å; Q382-T392 PolarHBondContact OE1-OG1 3.35Å; Q382-F393 CarbonylContact C-O 3.52Å; Q382-F393 WeakPolarHBondContact CA-O 3.38Å
383	P	82.3	Confident	82	Confident	77 Å²	77	86.3 Å²	86.3	50%	0.5	42%	0.422	S	S	.	.			trans	-66.5	-17.3	-171.9	-18.9	31.9	0	0	0	113.7	E381	E381-P383 WeakPolarHBondContact O-CD 3.42Å
384	Y	82.6	Confident	81.8	Confident	67 Å²	67	82.5 Å²	82.5	26%	0.263	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	99	-175	-52.5	-74.2	0	0	0	109.5	Q382 T392 F393 H396 F399	Q382-Y384 PolarHBondContact O-N 3.02Å; Q382-Y384 VanDerWaalsContact O-N 3.12Å; Y384-T392 CarbonylContact O-C 3.54Å; Y384-T392 WeakPolarHBondContact O-CA 3.5Å; Y384-F393 WeakPolarHBondContact CD2-O 3.29Å; Y384-F393 PolarHBondContact N-O 3.24Å; Y384-F393 PolarHBondContact O-N 3.18Å; Y384-H396 HydrophobicContact CD1-CB 4.41Å; Y384-H396 HydrophobicContact CD2-CB 4.48Å; Y384-H396 HydrophobicContact CE1-CB 3.91Å; Y384-H396 AromaticContact CE1-CD2 3.75Å; Y384-H396 HydrophobicContact CE2-CB 3.98Å; Y384-F399 HydrophobicContact CD1-CD1 4.46Å; Y384-F399 HydrophobicContact CG-CB 4.34Å; Y384-F399 HydrophobicContact CG-CG 4.49Å
385	K	83.5	Confident	81.6	Confident	127 Å²	127	83 Å²	83	55%	0.552	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	136.8	174.4	-173.5	178.9	176.5	-172.6	0	109.9	T392 F399	K385-T392 HydrophobicContact CB-CG2 4.07Å; K385-T392 HydrophobicContact CG-CG2 3.98Å; K385-F399 WeakPolarHBondContact O-CE2 3.44Å
386	C	87.3	Confident	81.5	Confident	3 Å²	3	84.1 Å²	84.1	2%	0.02	42%	0.419	C	S	.	.			trans	-86.8	120.5	169.9	-175.2	0	0	0	0	109.8	E388 G390 K391 F393 F399 H402 H406	C386-E388 VanDerWaalsContact C-N 3.31Å; C386-G390 WeakPolarHBondContact O-CA 3.44Å; C386-G390 PolarHBondContact O-N 2.93Å; C386-K391 VanDerWaalsContact CB-O 3.28Å; C386-K391 WeakPolarHBondContact CB-O 3.19Å; C386-K391 PolarHBondContact N-O 3.21Å; C386-F393 HydrophobicContact CB-CE2 4.4Å; C386-F399 HydrophobicContact CB-CE2 3.94Å; C386-H402 PolarHBondContact SG-NE2 2.77Å; C386-H406 VanDerWaalsContact SG-CD2 3.56Å; C386-H406 PolarHBondContact SG-NE2 3.4Å
387	D	82.6	Confident	81.5	Confident	149 Å²	149	84 Å²	84	80%	0.797	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-29.8	-178.9	-58.7	-39.9	0	0	0	111.8
388	E	80.8	Confident	81.6	Confident	139 Å²	139	81.7 Å²	81.7	65%	0.65	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-30.1	-177	-63.8	-173.5	-132.9	0	0	114.2	C386 H406	C386-E388 VanDerWaalsContact C-N 3.31Å; E388-H406 WeakPolarHBondContact OE2-CB 3.49Å; E388-H406 IonicContact OE2-CD2 3.71Å; E388-H406 IonicContact OE2-CG 3.04Å
389	C	84.3	Confident	81.7	Confident	52 Å²	52	80 Å²	80	35%	0.351	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	10.2	-178.1	80.7	0	0	0	0	114.6	K391 H402 H406	C389-K391 PolarHBondContact O-N 3.3Å; C389-K391 VanDerWaalsContact SG-CG 3.59Å; C389-H402 PolarHBondContact SG-CE1 3.07Å; C389-H402 PolarHBondContact SG-NE2 3.34Å; C389-H406 PolarHBondContact SG-NE2 3.11Å; C389-H406 VanDerWaalsContact SG-NE2 3.44Å
390	G	80.1	Confident	81.9	Confident	41 Å²	41	78.2 Å²	78.2	42%	0.423	40%	0.402	S	S	.	.			trans	67.5	-3.7	177.6	0	0	0	0	0	116	C386	C386-G390 WeakPolarHBondContact O-CA 3.44Å; C386-G390 PolarHBondContact O-N 2.93Å
391	K	82.6	Confident	82.2	Confident	126 Å²	126	73.8 Å²	73.8	55%	0.548	39%	0.388	S	S	.	.			trans	-69.6	134.1	-176.1	-72.4	-179.3	-175.5	177.7	0	110.9	C386 C389 F393	C386-K391 VanDerWaalsContact CB-O 3.28Å; C386-K391 WeakPolarHBondContact CB-O 3.19Å; C386-K391 PolarHBondContact N-O 3.21Å; C389-K391 PolarHBondContact O-N 3.3Å; C389-K391 VanDerWaalsContact SG-CG 3.59Å; K391-F393 HydrophobicContact CB-CE2 3.84Å; K391-F393 HydrophobicContact CB-CZ 3.99Å; K391-F393 WeakPolarHBondContact O-CE2 3.47Å
392	T	83.8	Confident	82.5	Confident	64 Å²	64	69.6 Å²	69.6	39%	0.393	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	150.7	179.8	50.4	0	0	0	0	110.8	Q382 Y384 K385	Q382-T392 PolarHBondContact OE1-O 3.12Å; Q382-T392 PolarHBondContact OE1-OG1 3.35Å; Y384-T392 CarbonylContact O-C 3.54Å; Y384-T392 WeakPolarHBondContact O-CA 3.5Å; K385-T392 HydrophobicContact CB-CG2 4.07Å; K385-T392 HydrophobicContact CG-CG2 3.98Å
393	F	81.8	Confident	82.6	Confident	39 Å²	39	69.3 Å²	69.3	17%	0.171	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	142.7	-178.5	-58.3	-92.8	0	0	0	110.7	Q382 Y384 C386 K391 F399 H402	Q382-F393 CarbonylContact C-O 3.52Å; Q382-F393 WeakPolarHBondContact CA-O 3.38Å; Y384-F393 WeakPolarHBondContact CD2-O 3.29Å; Y384-F393 PolarHBondContact N-O 3.24Å; Y384-F393 PolarHBondContact O-N 3.18Å; C386-F393 HydrophobicContact CB-CE2 4.4Å; K391-F393 HydrophobicContact CB-CE2 3.84Å; K391-F393 HydrophobicContact CB-CZ 3.99Å; K391-F393 WeakPolarHBondContact O-CE2 3.47Å; F393-F399 HydrophobicContact CB-CB 4.03Å; F393-F399 HydrophobicContact CD2-CB 4.07Å; F393-F399 AromaticContact CD2-CD2 3.67Å; F393-F399 HydrophobicContact CD2-CD2 3.67Å; F393-F399 HydrophobicContact CD2-CG 4.36Å; F393-F399 HydrophobicContact CE2-CD2 4.1Å; F393-F399 HydrophobicContact CG-CB 4.1Å; F393-H402 HydrophobicContact CE1-CB 3.87Å; F393-H402 HydrophobicContact CE2-CB 3.94Å; F393-H402 AromaticContact CE2-CD2 3.31Å; F393-H402 WeakPolarHBondContact CE2-CD2 3.35Å; F393-H402 AromaticContact CE2-CG 3.59Å; F393-H402 AromaticContact CE2-NE2 3.94Å; F393-H402 HydrophobicContact CZ-CB 3.42Å; F393-H402 VanDerWaalsContact CZ-CB 3.42Å; F393-H402 AromaticContact CZ-CD2 3.4Å; F393-H402 WeakPolarHBondContact CZ-CD2 3.49Å; F393-H402 AromaticContact CZ-CG 3.16Å; F393-H402 AromaticContact CZ-ND1 3.64Å; F393-H402 AromaticContact CZ-NE2 3.95Å
394	S	81.9	Confident	82.4	Confident	28 Å²	28	68 Å²	68	20%	0.196	36%	0.356	C	S	.	.	S	Bend	trans	-81.7	-18.3	176.5	56.9	0	0	0	0	113.6	R376	R376-S394 VanDerWaalsContact CD-O 3.29Å; R376-S394 WeakPolarHBondContact CD-O 3.37Å; R376-S394 PolarHBondContact NH1-O 3.46Å
395	V	82.2	Confident	82.1	Confident	29 Å²	29	69.1 Å²	69.1	18%	0.176	36%	0.364	C	S	.	.	S	Bend	trans	-129.3	132	-176.1	-171.8	0	0	0	0	111.4	S397 T398 F399	V395-S397 VanDerWaalsContact C-N 3.31Å; V395-S397 WeakPolarHBondContact CG1-OG 3.45Å; V395-S397 PolarHBondContact O-N 3.24Å; V395-T398 PolarHBondContact O-N 3.38Å; V395-T398 PolarHBondContact O-OG1 3.44Å; V395-F399 PolarHBondContact O-N 3.12Å; V395-F399 VanDerWaalsContact O-N 3.15Å
396	H	83.2	Confident	81.7	Confident	101 Å²	101	65.8 Å²	65.8	47%	0.468	35%	0.351	S	S	.	.	H	α-helix	trans	-57.5	-40.3	179.3	-176.8	-88.9	0	0	0	113	Y384 T398 F399 S400	Y384-H396 HydrophobicContact CD1-CB 4.41Å; Y384-H396 HydrophobicContact CD2-CB 4.48Å; Y384-H396 HydrophobicContact CE1-CB 3.91Å; Y384-H396 AromaticContact CE1-CD2 3.75Å; Y384-H396 HydrophobicContact CE2-CB 3.98Å; H396-T398 VanDerWaalsContact C-N 3.29Å; H396-T398 PolarHBondContact O-N 3.12Å; H396-F399 CarbonylContact O-C 3.28Å; H396-F399 WeakPolarHBondContact O-CB 3.45Å; H396-F399 PolarHBondContact O-N 3.33Å; H396-F399 VanDerWaalsContact O-N 3.13Å; H396-S400 PolarHBondContact CE1-OG 3.03Å; H396-S400 PolarHBondContact ND1-OG 3.16Å; H396-S400 PolarHBondContact O-N 2.89Å; H396-S400 PolarHBondContact O-OG 3.15Å; H396-S400 VanDerWaalsContact O-OG 3.1Å
397	S	83.3	Confident	80.9	Confident	65 Å²	65	68.1 Å²	68.1	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-65	-30.5	-178.6	57.6	0	0	0	0	113.6	V395 K401	V395-S397 VanDerWaalsContact C-N 3.31Å; V395-S397 WeakPolarHBondContact CG1-OG 3.45Å; V395-S397 PolarHBondContact O-N 3.24Å; S397-K401 VanDerWaalsContact O-CG 3.27Å; S397-K401 WeakPolarHBondContact O-CG 3.22Å; S397-K401 PolarHBondContact O-N 3.22Å
398	T	83.3	Confident	80	Confident	61 Å²	61	72.5 Å²	72.5	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-76.6	-36.5	173.2	52.2	0	0	0	0	111	V395 H396 K401 H402	V395-T398 PolarHBondContact O-N 3.38Å; V395-T398 PolarHBondContact O-OG1 3.44Å; H396-T398 VanDerWaalsContact C-N 3.29Å; H396-T398 PolarHBondContact O-N 3.12Å; T398-K401 PolarHBondContact O-N 3.28Å; T398-H402 WeakPolarHBondContact O-CB 3.25Å; T398-H402 PolarHBondContact O-N 3.45Å
399	F	83.8	Confident	79.5	Confident	23 Å²	23	72.2 Å²	72.2	10%	0.101	37%	0.369	C	S	.	.	H	α-helix	trans	-62.1	-51.3	173.3	173.1	-114.3	0	0	0	112.1	Y384 K385 C386 F393 V395 H396 K401 H402 Q403	Y384-F399 HydrophobicContact CD1-CD1 4.46Å; Y384-F399 HydrophobicContact CG-CB 4.34Å; Y384-F399 HydrophobicContact CG-CG 4.49Å; K385-F399 WeakPolarHBondContact O-CE2 3.44Å; C386-F399 HydrophobicContact CB-CE2 3.94Å; F393-F399 HydrophobicContact CB-CB 4.03Å; F393-F399 HydrophobicContact CD2-CB 4.07Å; F393-F399 AromaticContact CD2-CD2 3.67Å; F393-F399 HydrophobicContact CD2-CD2 3.67Å; F393-F399 HydrophobicContact CD2-CG 4.36Å; F393-F399 HydrophobicContact CE2-CD2 4.1Å; F393-F399 HydrophobicContact CG-CB 4.1Å; V395-F399 PolarHBondContact O-N 3.12Å; V395-F399 VanDerWaalsContact O-N 3.15Å; H396-F399 CarbonylContact O-C 3.28Å; H396-F399 WeakPolarHBondContact O-CB 3.45Å; H396-F399 PolarHBondContact O-N 3.33Å; H396-F399 VanDerWaalsContact O-N 3.13Å; F399-K401 VanDerWaalsContact C-N 3.29Å; F399-K401 PolarHBondContact O-N 3.29Å; F399-H402 CarbonylContact O-C 3.53Å; F399-H402 WeakPolarHBondContact O-CA 3.46Å; F399-H402 VanDerWaalsContact O-CB 3.31Å; F399-H402 WeakPolarHBondContact O-CB 3.25Å; F399-H402 PolarHBondContact O-N 3.24Å; F399-Q403 HydrophobicContact CD2-CG 4.3Å; F399-Q403 HydrophobicContact CE1-CG 4.12Å; F399-Q403 VanDerWaalsContact CE1-OE1 3.23Å; F399-Q403 HydrophobicContact CE2-CG 3.87Å; F399-Q403 HydrophobicContact CZ-CG 3.79Å; F399-Q403 VanDerWaalsContact CZ-NE2 3.28Å; F399-Q403 WeakPolarHBondContact O-CG 3.49Å; F399-Q403 PolarHBondContact O-N 3.38Å
400	S	83	Confident	79.3	Confident	36 Å²	36	75 Å²	75	25%	0.252	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-38.6	177.7	-52.5	0	0	0	0	112.3	H396 H402 Q403 I404	H396-S400 PolarHBondContact CE1-OG 3.03Å; H396-S400 PolarHBondContact ND1-OG 3.16Å; H396-S400 PolarHBondContact O-N 2.89Å; H396-S400 PolarHBondContact O-OG 3.15Å; H396-S400 VanDerWaalsContact O-OG 3.1Å; S400-H402 VanDerWaalsContact C-N 3.33Å; S400-Q403 PolarHBondContact O-N 3.04Å; S400-I404 WeakPolarHBondContact O-CG1 3.44Å; S400-I404 PolarHBondContact O-N 3.1Å
401	K	80.6	Confident	79.2	Confident	123 Å²	123	76.9 Å²	76.9	54%	0.535	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-41.7	172.7	-75.3	176.3	-177.1	-175.1	0	111.5	S397 T398 F399 Q403 I404 Y423	S397-K401 VanDerWaalsContact O-CG 3.27Å; S397-K401 WeakPolarHBondContact O-CG 3.22Å; S397-K401 PolarHBondContact O-N 3.22Å; T398-K401 PolarHBondContact O-N 3.28Å; F399-K401 VanDerWaalsContact C-N 3.29Å; F399-K401 PolarHBondContact O-N 3.29Å; K401-Q403 VanDerWaalsContact C-N 3.35Å; K401-I404 PolarHBondContact O-N 3.32Å; K401-Y423 HydrophobicContact CB-CE1 4.09Å; K401-Y423 HydrophobicContact CG-CE1 4.22Å; K401-Y423 PolarHBondContact O-OH 2.94Å
402	H	82.5	Confident	79.2	Confident	25 Å²	25	75.1 Å²	75.1	12%	0.116	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-38.3	176.4	169.9	72.2	0	0	0	112.4	C386 C389 F393 T398 F399 S400 I404 M405 H406	C386-H402 PolarHBondContact SG-NE2 2.77Å; C389-H402 PolarHBondContact SG-CE1 3.07Å; C389-H402 PolarHBondContact SG-NE2 3.34Å; F393-H402 HydrophobicContact CE1-CB 3.87Å; F393-H402 HydrophobicContact CE2-CB 3.94Å; F393-H402 AromaticContact CE2-CD2 3.31Å; F393-H402 WeakPolarHBondContact CE2-CD2 3.35Å; F393-H402 AromaticContact CE2-CG 3.59Å; F393-H402 AromaticContact CE2-NE2 3.94Å; F393-H402 HydrophobicContact CZ-CB 3.42Å; F393-H402 VanDerWaalsContact CZ-CB 3.42Å; F393-H402 AromaticContact CZ-CD2 3.4Å; F393-H402 WeakPolarHBondContact CZ-CD2 3.49Å; F393-H402 AromaticContact CZ-CG 3.16Å; F393-H402 AromaticContact CZ-ND1 3.64Å; F393-H402 AromaticContact CZ-NE2 3.95Å; T398-H402 WeakPolarHBondContact O-CB 3.25Å; T398-H402 PolarHBondContact O-N 3.45Å; F399-H402 CarbonylContact O-C 3.53Å; F399-H402 WeakPolarHBondContact O-CA 3.46Å; F399-H402 VanDerWaalsContact O-CB 3.31Å; F399-H402 WeakPolarHBondContact O-CB 3.25Å; F399-H402 PolarHBondContact O-N 3.24Å; S400-H402 VanDerWaalsContact C-N 3.33Å; H402-I404 VanDerWaalsContact C-N 3.25Å; H402-I404 PolarHBondContact O-N 3.5Å; H402-M405 WeakPolarHBondContact O-CA 3.43Å; H402-M405 WeakPolarHBondContact O-CB 3.49Å; H402-M405 PolarHBondContact O-N 2.91Å; H402-H406 AromaticContact CD2-NE2 3.99Å; H402-H406 AromaticContact CE1-CE1 3.94Å; H402-H406 AromaticContact CE1-NE2 3.44Å; H402-H406 PolarHBondContact CE1-NE2 2.93Å; H402-H406 AromaticContact NE2-CD2 3.88Å; H402-H406 AromaticContact NE2-CE1 3.98Å; H402-H406 AromaticContact NE2-NE2 3.09Å; H402-H406 PolarHBondContact NE2-NE2 3.25Å
403	Q	78.8	Confident	79.2	Confident	80 Å²	80	77.8 Å²	77.8	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-60.2	-35.3	176.1	-69.3	179.3	-66.9	0	0	112.4	F399 S400 K401 M405 H406 T407	F399-Q403 HydrophobicContact CD2-CG 4.3Å; F399-Q403 HydrophobicContact CE1-CG 4.12Å; F399-Q403 VanDerWaalsContact CE1-OE1 3.23Å; F399-Q403 HydrophobicContact CE2-CG 3.87Å; F399-Q403 HydrophobicContact CZ-CG 3.79Å; F399-Q403 VanDerWaalsContact CZ-NE2 3.28Å; F399-Q403 WeakPolarHBondContact O-CG 3.49Å; F399-Q403 PolarHBondContact O-N 3.38Å; S400-Q403 PolarHBondContact O-N 3.04Å; K401-Q403 VanDerWaalsContact C-N 3.35Å; Q403-M405 PolarHBondContact O-N 3.31Å; Q403-M405 VanDerWaalsContact O-N 3.13Å; Q403-H406 PolarHBondContact O-N 3.23Å; Q403-H406 VanDerWaalsContact O-N 3.07Å; Q403-T407 PolarHBondContact O-N 3.29Å
404	I	79.4	Confident	79.5	Confident	50 Å²	50	76.1 Å²	76.1	26%	0.256	37%	0.37	S	S	.	.	H	α-helix	trans	-65	-14.6	173.7	-57.2	164.4	0	0	0	112.1	S400 K401 H402 T407 Y423	S400-I404 WeakPolarHBondContact O-CG1 3.44Å; S400-I404 PolarHBondContact O-N 3.1Å; K401-I404 PolarHBondContact O-N 3.32Å; H402-I404 VanDerWaalsContact C-N 3.25Å; H402-I404 PolarHBondContact O-N 3.5Å; I404-T407 WeakPolarHBondContact CA-OG1 3.48Å; I404-T407 PolarHBondContact O-OG1 3.39Å; I404-Y423 HydrophobicContact CD1-CE1 4.47Å
405	M	74.8	Confident	79.7	Confident	91 Å²	91	83.5 Å²	83.5	45%	0.448	40%	0.398	S	S	.	.	H	α-helix	trans	-74.2	-32	173.6	-66.7	-64.3	-59.4	0	0	112.5	H402 Q403 K422 Y423	H402-M405 WeakPolarHBondContact O-CA 3.43Å; H402-M405 WeakPolarHBondContact O-CB 3.49Å; H402-M405 PolarHBondContact O-N 2.91Å; Q403-M405 PolarHBondContact O-N 3.31Å; Q403-M405 VanDerWaalsContact O-N 3.13Å; M405-K422 PolarHBondContact O-NZ 3.26Å; M405-K422 HydrophobicContact SD-CD 3.83Å; M405-Y423 WeakPolarHBondContact CG-OH 3.39Å; M405-Y423 HydrophobicContact SD-CE2 4.2Å; M405-Y423 PolarHBondContact SD-OH 3.39Å
406	H	75.8	Confident	79.9	Confident	57 Å²	57	87.9 Å²	87.9	26%	0.264	42%	0.417	S	S	.	.	H	α-helix	trans	-79.5	-33.8	178.5	-64.3	-46.1	0	0	0	112.2	C386 E388 C389 H402 Q403 R408	C386-H406 VanDerWaalsContact SG-CD2 3.56Å; C386-H406 PolarHBondContact SG-NE2 3.4Å; E388-H406 WeakPolarHBondContact OE2-CB 3.49Å; E388-H406 IonicContact OE2-CD2 3.71Å; E388-H406 IonicContact OE2-CG 3.04Å; C389-H406 PolarHBondContact SG-NE2 3.11Å; C389-H406 VanDerWaalsContact SG-NE2 3.44Å; H402-H406 AromaticContact CD2-NE2 3.99Å; H402-H406 AromaticContact CE1-CE1 3.94Å; H402-H406 AromaticContact CE1-NE2 3.44Å; H402-H406 PolarHBondContact CE1-NE2 2.93Å; H402-H406 AromaticContact NE2-CD2 3.88Å; H402-H406 AromaticContact NE2-CE1 3.98Å; H402-H406 AromaticContact NE2-NE2 3.09Å; H402-H406 PolarHBondContact NE2-NE2 3.25Å; Q403-H406 PolarHBondContact O-N 3.23Å; Q403-H406 VanDerWaalsContact O-N 3.07Å; H406-R408 PolarHBondContact O-N 3.17Å
407	T	70.9	Confident	80.2	Confident	52 Å²	52	84.8 Å²	84.8	32%	0.319	41%	0.406	S	S	.	.	S	Bend	trans	-67.3	125.9	166.8	69.1	0	0	0	0	108.8	Q403 I404 E409 K422	Q403-T407 PolarHBondContact O-N 3.29Å; I404-T407 WeakPolarHBondContact CA-OG1 3.48Å; I404-T407 PolarHBondContact O-OG1 3.39Å; T407-E409 PolarHBondContact O-N 3.36Å; T407-K422 PolarHBondContact O-NZ 3.01Å
408	R	64.1	Low	80.3	Confident	240 Å²	240	88 Å²	88	91%	0.906	42%	0.418	S	S	*	.			trans	-68.7	-5.3	171.7	-71.2	-172.5	179.9	-171.8	1.6	112	H406 K410	H406-R408 PolarHBondContact O-N 3.17Å; R408-K410 PolarHBondContact O-N 3.25Å
409	E	70	Confident	80.3	Confident	133 Å²	133	91.1 Å²	91.1	62%	0.621	43%	0.426	S	S	*	.			trans	-61	130.2	178.7	-61.3	-176.4	171.9	0	0	110.8	T407 P411	T407-E409 PolarHBondContact O-N 3.36Å; E409-P411 HydrophobicContact CB-CG 4.43Å; E409-P411 WeakPolarHBondContact O-CD 3.47Å
410	K	78.6	Confident	80.4	Confident	110 Å²	110	92.6 Å²	92.6	48%	0.478	44%	0.438	S	S	.	.			trans	-117	79.8	170.6	-70.4	177	175.9	-178.2	0	106.9	R408 Y412 T420 F421 K422	R408-K410 PolarHBondContact O-N 3.25Å; K410-Y412 PolarHBondContact O-N 3.01Å; K410-T420 WeakPolarHBondContact CB-OG1 3.29Å; K410-T420 VanDerWaalsContact CD-OG1 3.24Å; K410-T420 WeakPolarHBondContact CD-OG1 3.38Å; K410-F421 CarbonylContact C-O 3.57Å; K410-F421 VanDerWaalsContact C-O 3.25Å; K410-F421 WeakPolarHBondContact CA-O 3.36Å; K410-K422 HydrophobicContact CG-CG 3.88Å
411	P	79.2	Confident	80.4	Confident	81 Å²	81	92.8 Å²	92.8	53%	0.526	43%	0.434	S	S	.	.			trans	-65.8	-18.4	-165.5	-20.1	33	0	0	0	113.3	E409	E409-P411 HydrophobicContact CB-CG 4.43Å; E409-P411 WeakPolarHBondContact O-CD 3.47Å
412	Y	81.4	Confident	80.4	Confident	89 Å²	89	89.1 Å²	89.1	35%	0.349	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	95.1	-171	-56.1	-81.1	0	0	0	109.8	K410 T420 F421 K422 P424	K410-Y412 PolarHBondContact O-N 3.01Å; Y412-T420 CarbonylContact O-C 3.55Å; Y412-T420 WeakPolarHBondContact O-CA 3.22Å; Y412-F421 WeakPolarHBondContact CB-O 3.36Å; Y412-F421 PolarHBondContact N-O 3.1Å; Y412-F421 PolarHBondContact O-N 2.9Å; Y412-K422 WeakPolarHBondContact CD2-O 3.45Å; Y412-K422 WeakPolarHBondContact CE2-O 3.43Å; Y412-P424 HydrophobicContact CD1-CG 4.09Å; Y412-P424 HydrophobicContact CE1-CB 4.46Å; Y412-P424 HydrophobicContact CE1-CG 3.6Å; Y412-P424 HydrophobicContact CE2-CG 4.23Å
413	K	84.7	Confident	80.3	Confident	120 Å²	120	90.9 Å²	90.9	52%	0.522	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.8	176.5	-171.1	175.5	179.8	177.9	0	111.1	D418 T420	K413-D418 WeakPolarHBondContact CE-OD1 3.41Å; K413-D418 IonicContact NZ-OD1 3.36Å; K413-D418 PolarHBondContact NZ-OD1 3.28Å; K413-T420 HydrophobicContact CB-CG2 4.05Å; K413-T420 HydrophobicContact CG-CG2 3.96Å
414	C	88.9	Confident	80.5	Confident	5 Å²	5	90.2 Å²	90.2	3%	0.034	43%	0.426	C	S	.	.			trans	-69.4	139.8	170.9	-176.6	0	0	0	0	111	H416 C417 K419 F421 L427	C414-H416 VanDerWaalsContact C-N 3.33Å; C414-H416 PolarHBondContact SG-N 3.49Å; C414-H416 VanDerWaalsContact SG-N 3.44Å; C414-C417 WeakPolarHBondContact CB-O 3.21Å; C414-K419 WeakPolarHBondContact CB-O 3.3Å; C414-K419 PolarHBondContact N-O 3.32Å; C414-F421 HydrophobicContact CB-CE2 4.37Å; C414-L427 HydrophobicContact CB-CD1 3.77Å
415	K	86.1	Confident	80.7	Confident	183 Å²	183	92 Å²	92	80%	0.796	44%	0.444	S	S	*	.	S	Bend	trans	-75.7	-22.4	178.2	-62.8	-177	-178.9	179.9	0	113.6
416	H	85.4	Confident	81.2	Confident	121 Å²	121	90 Å²	90	56%	0.56	44%	0.438	S	S	*	.	S	Bend	trans	-105.5	-7.4	-172.7	-58	-71.9	0	0	0	113.5	C414 H434	C414-H416 VanDerWaalsContact C-N 3.33Å; C414-H416 PolarHBondContact SG-N 3.49Å; C414-H416 VanDerWaalsContact SG-N 3.44Å; H416-H434 HydrophobicContact CB-CB 4.12Å
417	C	89.5	Confident	81.8	Confident	36 Å²	36	88.2 Å²	88.2	24%	0.243	43%	0.43	C	S	.	.	S	Bend	trans	-160	170.2	175	69.6	0	0	0	0	111.2	C414 K419 H430 H434	C414-C417 WeakPolarHBondContact CB-O 3.21Å; C417-K419 PolarHBondContact O-N 2.88Å; C417-K419 VanDerWaalsContact O-N 3.09Å; C417-H430 PolarHBondContact SG-NE2 3.38Å; C417-H434 PolarHBondContact SG-NE2 2.83Å
418	D	84.8	Confident	82.4	Confident	131 Å²	131	89.1 Å²	89.1	70%	0.701	44%	0.435	S	S	*	.	S	Bend	trans	-77.1	8.9	-178.3	-68.1	-52.6	0	0	0	115.6	K413 T420	K413-D418 WeakPolarHBondContact CE-OD1 3.41Å; K413-D418 IonicContact NZ-OD1 3.36Å; K413-D418 PolarHBondContact NZ-OD1 3.28Å; D418-T420 PolarHBondContact O-N 3.17Å
419	K	84.6	Confident	83.4	Confident	127 Å²	127	81.3 Å²	81.3	55%	0.552	41%	0.409	S	S	*	.			trans	-70.5	127.7	177	-69.6	178.1	178	174.5	0	110.7	C414 C417 F421	C414-K419 WeakPolarHBondContact CB-O 3.3Å; C414-K419 PolarHBondContact N-O 3.32Å; C417-K419 PolarHBondContact O-N 2.88Å; C417-K419 VanDerWaalsContact O-N 3.09Å; K419-F421 HydrophobicContact CB-CE2 3.85Å; K419-F421 HydrophobicContact CB-CZ 3.95Å
420	T	85.6	Confident	84.2	Confident	55 Å²	55	75.8 Å²	75.8	34%	0.337	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	147	175.3	56	0	0	0	0	110.8	K410 Y412 K413 D418	K410-T420 WeakPolarHBondContact CB-OG1 3.29Å; K410-T420 VanDerWaalsContact CD-OG1 3.24Å; K410-T420 WeakPolarHBondContact CD-OG1 3.38Å; Y412-T420 CarbonylContact O-C 3.55Å; Y412-T420 WeakPolarHBondContact O-CA 3.22Å; K413-T420 HydrophobicContact CB-CG2 4.05Å; K413-T420 HydrophobicContact CG-CG2 3.96Å; D418-T420 PolarHBondContact O-N 3.17Å
421	F	82.7	Confident	84.6	Confident	39 Å²	39	72.8 Å²	72.8	17%	0.171	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.1	-174.9	-59.4	-89.8	0	0	0	110.8	K410 Y412 C414 K419 P426 L427 H430	K410-F421 CarbonylContact C-O 3.57Å; K410-F421 VanDerWaalsContact C-O 3.25Å; K410-F421 WeakPolarHBondContact CA-O 3.36Å; Y412-F421 WeakPolarHBondContact CB-O 3.36Å; Y412-F421 PolarHBondContact N-O 3.1Å; Y412-F421 PolarHBondContact O-N 2.9Å; C414-F421 HydrophobicContact CB-CE2 4.37Å; K419-F421 HydrophobicContact CB-CE2 3.85Å; K419-F421 HydrophobicContact CB-CZ 3.95Å; F421-P426 HydrophobicContact CD1-CB 3.87Å; F421-P426 HydrophobicContact CE1-CB 4.46Å; F421-L427 HydrophobicContact CB-CB 4.12Å; F421-L427 HydrophobicContact CD2-CB 3.74Å; F421-L427 HydrophobicContact CD2-CD1 3.64Å; F421-L427 HydrophobicContact CD2-CG 4.27Å; F421-L427 HydrophobicContact CE2-CB 4.44Å; F421-L427 HydrophobicContact CE2-CD1 3.8Å; F421-L427 HydrophobicContact CG-CB 3.99Å; F421-H430 HydrophobicContact CE1-CB 3.95Å; F421-H430 HydrophobicContact CE2-CB 4Å; F421-H430 AromaticContact CE2-CD2 3.55Å; F421-H430 AromaticContact CE2-CG 3.86Å; F421-H430 HydrophobicContact CZ-CB 3.39Å; F421-H430 AromaticContact CZ-CD2 3.46Å; F421-H430 VanDerWaalsContact CZ-CD2 3.46Å; F421-H430 WeakPolarHBondContact CZ-CD2 3.44Å; F421-H430 AromaticContact CZ-CG 3.3Å
422	K	79.6	Confident	85	Confident	47 Å²	47	71.3 Å²	71.3	20%	0.204	35%	0.354	C	S	.	.	S	Bend	trans	-76.1	-24.1	176	-67.7	-164.2	173.2	-149.1	0	113.3	M405 T407 K410 Y412	M405-K422 PolarHBondContact O-NZ 3.26Å; M405-K422 HydrophobicContact SD-CD 3.83Å; T407-K422 PolarHBondContact O-NZ 3.01Å; K410-K422 HydrophobicContact CG-CG 3.88Å; Y412-K422 WeakPolarHBondContact CD2-O 3.45Å; Y412-K422 WeakPolarHBondContact CE2-O 3.43Å
423	Y	81.2	Confident	85.2	Confident	62 Å²	62	72.4 Å²	72.4	24%	0.243	37%	0.365	C	S	.	.	S	Bend	trans	-134.5	158.6	-176.4	-53.9	-67.6	0	0	0	111	K401 I404 M405 P426	K401-Y423 HydrophobicContact CB-CE1 4.09Å; K401-Y423 HydrophobicContact CG-CE1 4.22Å; K401-Y423 PolarHBondContact O-OH 2.94Å; I404-Y423 HydrophobicContact CD1-CE1 4.47Å; M405-Y423 WeakPolarHBondContact CG-OH 3.39Å; M405-Y423 HydrophobicContact SD-CE2 4.2Å; M405-Y423 PolarHBondContact SD-OH 3.39Å; Y423-P426 WeakPolarHBondContact O-CD 3.28Å
424	P	82.9	Confident	85.2	Confident	65 Å²	65	70.6 Å²	70.6	42%	0.422	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-36.4	175.2	-20.5	30.4	0	0	0	114.1	Y412 L427 V428	Y412-P424 HydrophobicContact CD1-CG 4.09Å; Y412-P424 HydrophobicContact CE1-CB 4.46Å; Y412-P424 HydrophobicContact CE1-CG 3.6Å; Y412-P424 HydrophobicContact CE2-CG 4.23Å; P424-L427 WeakPolarHBondContact O-CB 3.36Å; P424-L427 PolarHBondContact O-N 3.42Å; P424-V428 WeakPolarHBondContact O-CG2 3.37Å; P424-V428 PolarHBondContact O-N 3.03Å
425	S	84.5	Confident	85.1	Confident	89 Å²	89	74.1 Å²	74.1	62%	0.622	38%	0.38	S	S	*	.	H	α-helix	trans	-66	-41.6	-171.9	62.1	0	0	0	0	114.3	L427 Q429	S425-L427 VanDerWaalsContact C-N 3.34Å; S425-Q429 PolarHBondContact O-N 3.23Å; S425-Q429 VanDerWaalsContact O-N 3.08Å
426	P	85.4	Confident	84.9	Confident	49 Å²	49	67.8 Å²	67.8	32%	0.318	37%	0.366	S	S	.	.	H	α-helix	trans	-69.9	-30.6	173.3	-18.5	35.4	0	0	0	112.6	F421 Y423 Q429 H430	F421-P426 HydrophobicContact CD1-CB 3.87Å; F421-P426 HydrophobicContact CE1-CB 4.46Å; Y423-P426 WeakPolarHBondContact O-CD 3.28Å; P426-Q429 PolarHBondContact O-N 2.93Å; P426-H430 VanDerWaalsContact O-CB 3.23Å; P426-H430 WeakPolarHBondContact O-CB 3.38Å; P426-H430 PolarHBondContact O-N 2.97Å
427	L	86.7	Confident	84.9	Confident	19 Å²	19	67.5 Å²	67.5	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-52.1	173.1	169.6	61.8	0	0	0	110.3	C414 F421 P424 S425 Q429 H430 E431	C414-L427 HydrophobicContact CB-CD1 3.77Å; F421-L427 HydrophobicContact CB-CB 4.12Å; F421-L427 HydrophobicContact CD2-CB 3.74Å; F421-L427 HydrophobicContact CD2-CD1 3.64Å; F421-L427 HydrophobicContact CD2-CG 4.27Å; F421-L427 HydrophobicContact CE2-CB 4.44Å; F421-L427 HydrophobicContact CE2-CD1 3.8Å; F421-L427 HydrophobicContact CG-CB 3.99Å; P424-L427 WeakPolarHBondContact O-CB 3.36Å; P424-L427 PolarHBondContact O-N 3.42Å; S425-L427 VanDerWaalsContact C-N 3.34Å; L427-Q429 VanDerWaalsContact C-N 3.29Å; L427-Q429 PolarHBondContact O-N 3.1Å; L427-H430 CarbonylContact O-C 3.58Å; L427-H430 WeakPolarHBondContact O-CA 3.42Å; L427-H430 WeakPolarHBondContact O-CB 3.22Å; L427-H430 PolarHBondContact O-N 3.48Å; L427-E431 HydrophobicContact CD1-CG 3.91Å; L427-E431 HydrophobicContact CG-CG 4.41Å; L427-E431 WeakPolarHBondContact O-CG 3.42Å; L427-E431 PolarHBondContact O-N 3.42Å
428	V	85.5	Confident	84.7	Confident	70 Å²	70	73 Å²	73	42%	0.424	38%	0.381	S	S	.	.	H	α-helix	trans	-59.5	-41.1	178.1	173.2	0	0	0	0	111.3	P424 H430 E431 R432	P424-V428 WeakPolarHBondContact O-CG2 3.37Å; P424-V428 PolarHBondContact O-N 3.03Å; V428-H430 VanDerWaalsContact C-N 3.31Å; V428-H430 PolarHBondContact O-N 3.11Å; V428-E431 PolarHBondContact O-N 3.15Å; V428-R432 WeakPolarHBondContact O-CG 3.44Å; V428-R432 PolarHBondContact O-N 3.12Å
429	Q	84.4	Confident	84.8	Confident	76 Å²	76	70.2 Å²	70.2	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-65.2	-35.5	175.3	-176.1	-177.4	-8.3	0	0	112.3	S425 P426 L427 R432 S451	S425-Q429 PolarHBondContact O-N 3.23Å; S425-Q429 VanDerWaalsContact O-N 3.08Å; P426-Q429 PolarHBondContact O-N 2.93Å; L427-Q429 VanDerWaalsContact C-N 3.29Å; L427-Q429 PolarHBondContact O-N 3.1Å; Q429-R432 WeakPolarHBondContact O-CB 3.34Å; Q429-S451 VanDerWaalsContact NE2-CB 3.27Å; Q429-S451 PolarHBondContact NE2-OG 3.07Å
430	H	86.5	Confident	85	Confident	18 Å²	18	67.9 Å²	67.9	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-71	-40.3	176.4	171.7	64.3	0	0	0	112	C417 F421 P426 L427 V428 R432 I433 H434	C417-H430 PolarHBondContact SG-NE2 3.38Å; F421-H430 HydrophobicContact CE1-CB 3.95Å; F421-H430 HydrophobicContact CE2-CB 4Å; F421-H430 AromaticContact CE2-CD2 3.55Å; F421-H430 AromaticContact CE2-CG 3.86Å; F421-H430 HydrophobicContact CZ-CB 3.39Å; F421-H430 AromaticContact CZ-CD2 3.46Å; F421-H430 VanDerWaalsContact CZ-CD2 3.46Å; F421-H430 WeakPolarHBondContact CZ-CD2 3.44Å; F421-H430 AromaticContact CZ-CG 3.3Å; P426-H430 VanDerWaalsContact O-CB 3.23Å; P426-H430 WeakPolarHBondContact O-CB 3.38Å; P426-H430 PolarHBondContact O-N 2.97Å; L427-H430 CarbonylContact O-C 3.58Å; L427-H430 WeakPolarHBondContact O-CA 3.42Å; L427-H430 WeakPolarHBondContact O-CB 3.22Å; L427-H430 PolarHBondContact O-N 3.48Å; V428-H430 VanDerWaalsContact C-N 3.31Å; V428-H430 PolarHBondContact O-N 3.11Å; H430-R432 PolarHBondContact O-N 3.49Å; H430-I433 WeakPolarHBondContact O-CB 3.43Å; H430-I433 WeakPolarHBondContact O-CG1 3.47Å; H430-I433 PolarHBondContact O-N 3.43Å; H430-H434 AromaticContact CD2-NE2 3.95Å; H430-H434 AromaticContact CE1-NE2 3.57Å; H430-H434 AromaticContact NE2-CD2 3.79Å; H430-H434 AromaticContact NE2-NE2 3.08Å; H430-H434 PolarHBondContact NE2-NE2 2.93Å
431	E	86.5	Confident	85	Confident	46 Å²	46	72.5 Å²	72.5	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-59.6	-29.6	177.6	-74.6	177.3	154.2	0	0	112.4	L427 V428 I433 H434 T435	L427-E431 HydrophobicContact CD1-CG 3.91Å; L427-E431 HydrophobicContact CG-CG 4.41Å; L427-E431 WeakPolarHBondContact O-CG 3.42Å; L427-E431 PolarHBondContact O-N 3.42Å; V428-E431 PolarHBondContact O-N 3.15Å; E431-I433 PolarHBondContact O-N 3.1Å; E431-I433 VanDerWaalsContact O-N 3.13Å; E431-H434 WeakPolarHBondContact O-CB 3.35Å; E431-H434 PolarHBondContact O-N 2.97Å; E431-T435 PolarHBondContact O-N 3.49Å
432	R	88.4	Confident	85.3	Confident	50 Å²	50	70.8 Å²	70.8	19%	0.189	37%	0.367	C	S	.	.	H	α-helix	trans	-60.1	-19.7	171.4	-68	175.8	-176.8	168.1	0.6	114.6	V428 Q429 H430 T435 G436 E437 T450	V428-R432 WeakPolarHBondContact O-CG 3.44Å; V428-R432 PolarHBondContact O-N 3.12Å; Q429-R432 WeakPolarHBondContact O-CB 3.34Å; H430-R432 PolarHBondContact O-N 3.49Å; R432-T435 WeakPolarHBondContact CA-OG1 3.36Å; R432-G436 CarbonylContact O-C 3.59Å; R432-G436 WeakPolarHBondContact O-CA 3.43Å; R432-G436 PolarHBondContact O-N 2.87Å; R432-E437 HydrophobicContact CB-CB 4.48Å; R432-E437 HydrophobicContact CG-CB 4.23Å; R432-E437 PolarHBondContact O-N 3.47Å; R432-T450 HydrophobicContact CB-CG2 4.35Å; R432-T450 WeakPolarHBondContact CD-O 3.43Å; R432-T450 PolarHBondContact NH1-O 3.07Å
433	I	84.7	Confident	85.6	Confident	113 Å²	113	78.1 Å²	78.1	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-72.7	-37.2	173.9	-57.6	173.6	0	0	0	109.8	H430 E431	H430-I433 WeakPolarHBondContact O-CB 3.43Å; H430-I433 WeakPolarHBondContact O-CG1 3.47Å; H430-I433 PolarHBondContact O-N 3.43Å; E431-I433 PolarHBondContact O-N 3.1Å; E431-I433 VanDerWaalsContact O-N 3.13Å
434	H	86	Confident	85.8	Confident	81 Å²	81	79.8 Å²	79.8	38%	0.375	42%	0.418	S	S	.	.	H	α-helix	trans	-76.4	-39.6	178.1	-61.1	-65.6	0	0	0	111.7	H416 C417 H430 E431 G436	H416-H434 HydrophobicContact CB-CB 4.12Å; C417-H434 PolarHBondContact SG-NE2 2.83Å; H430-H434 AromaticContact CD2-NE2 3.95Å; H430-H434 AromaticContact CE1-NE2 3.57Å; H430-H434 AromaticContact NE2-CD2 3.79Å; H430-H434 AromaticContact NE2-NE2 3.08Å; H430-H434 PolarHBondContact NE2-NE2 2.93Å; E431-H434 WeakPolarHBondContact O-CB 3.35Å; E431-H434 PolarHBondContact O-N 2.97Å; H434-G436 VanDerWaalsContact C-N 3.34Å
435	T	85.1	Confident	86	Confident	79 Å²	79	79.3 Å²	79.3	49%	0.485	42%	0.416	S	S	.	.	H	α-helix	trans	-82	-12.7	178.9	65.5	0	0	0	0	113.6	E431 R432 E437	E431-T435 PolarHBondContact O-N 3.49Å; R432-T435 WeakPolarHBondContact CA-OG1 3.36Å; T435-E437 PolarHBondContact O-N 3.38Å; T435-E437 WeakPolarHBondContact OG1-CG 3.41Å; T435-E437 PolarHBondContact OG1-N 3.31Å
436	G	82	Confident	86	Confident	50 Å²	50	77.7 Å²	77.7	52%	0.515	41%	0.413	S	S	.	.			trans	70.6	2.9	-174.5	0	0	0	0	0	114.6	R432 H434 R438	R432-G436 CarbonylContact O-C 3.59Å; R432-G436 WeakPolarHBondContact O-CA 3.43Å; R432-G436 PolarHBondContact O-N 2.87Å; H434-G436 VanDerWaalsContact C-N 3.34Å; G436-R438 PolarHBondContact O-N 3.44Å
437	E	86.1	Confident	86	Confident	115 Å²	115	81.6 Å²	81.6	54%	0.537	43%	0.425	S	S	.	.			trans	-63.2	123.7	-177.7	-76	-175.4	179	0	0	112.2	R432 T435 P439	R432-E437 HydrophobicContact CB-CB 4.48Å; R432-E437 HydrophobicContact CG-CB 4.23Å; R432-E437 PolarHBondContact O-N 3.47Å; T435-E437 PolarHBondContact O-N 3.38Å; T435-E437 WeakPolarHBondContact OG1-CG 3.41Å; T435-E437 PolarHBondContact OG1-N 3.31Å; E437-P439 WeakPolarHBondContact O-CD 2.88Å
438	R	86.3	Confident	86.1	Confident	152 Å²	152	81.9 Å²	81.9	57%	0.574	43%	0.43	S	S	*	.			trans	-124.3	78.2	175.5	-69	175.5	167.4	-167.6	3.1	110.6	G436 Y440 A448 F449 T450	G436-R438 PolarHBondContact O-N 3.44Å; R438-Y440 PolarHBondContact O-N 3.18Å; R438-A448 HydrophobicContact CB-CB 3.56Å; R438-A448 WeakPolarHBondContact CD-O 3.22Å; R438-A448 HydrophobicContact CG-CB 4.47Å; R438-F449 CarbonylContact C-O 3.52Å; R438-F449 WeakPolarHBondContact CA-O 3.32Å; R438-T450 HydrophobicContact CG-CG2 4.02Å
439	P	87.1	Confident	86.2	Confident	72 Å²	72	80.5 Å²	80.5	47%	0.468	42%	0.419	S	S	.	.			trans	-67.7	-21.5	-172.4	-20.8	33.5	0	0	0	114.1	E437	E437-P439 WeakPolarHBondContact O-CD 2.88Å
440	Y	87.9	Confident	86.2	Confident	79 Å²	79	78.2 Å²	78.2	31%	0.31	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	98	-172.8	-56.7	-77.7	0	0	0	110.3	R438 A448 F449 S451	R438-Y440 PolarHBondContact O-N 3.18Å; Y440-A448 CarbonylContact O-C 3.43Å; Y440-A448 WeakPolarHBondContact O-CA 3.35Å; Y440-F449 PolarHBondContact N-O 3.17Å; Y440-F449 PolarHBondContact O-N 2.96Å; Y440-S451 VanDerWaalsContact CD2-CA 3.46Å
441	K	85.8	Confident	86.1	Confident	151 Å²	151	77.8 Å²	77.8	66%	0.657	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.4	179.3	-63.4	-177.9	179.6	-180	0	110.8	A448	K441-A448 HydrophobicContact CG-CB 3.95Å
442	C	89	Confident	86.1	Confident	4 Å²	4	78.6 Å²	78.6	3%	0.027	42%	0.42	C	S	.	.			trans	-79.9	122.2	169.3	-177.5	0	0	0	0	109.3	V444 C445 G446 K447 F449 L455	C442-V444 VanDerWaalsContact C-N 3.27Å; C442-V444 PolarHBondContact O-N 3.45Å; C442-C445 VanDerWaalsContact SG-SG 3.65Å; C442-G446 WeakPolarHBondContact O-CA 3.45Å; C442-G446 PolarHBondContact O-N 3.2Å; C442-K447 WeakPolarHBondContact CB-O 3.45Å; C442-K447 PolarHBondContact N-O 2.99Å; C442-F449 HydrophobicContact CB-CE2 4.39Å; C442-L455 HydrophobicContact CB-CD1 3.65Å
443	E	85.8	Confident	86	Confident	201 Å²	201	80.3 Å²	80.3	94%	0.939	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-27.1	179.7	-65.1	174.1	178.5	0	0	112.5
444	V	84.3	Confident	86	Confident	96 Å²	96	78.3 Å²	78.3	58%	0.582	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-40.4	-176.8	-176.8	0	0	0	0	112.4	C442	C442-V444 VanDerWaalsContact C-N 3.27Å; C442-V444 PolarHBondContact O-N 3.45Å
445	C	87.8	Confident	86	Confident	56 Å²	56	76.2 Å²	76.2	38%	0.378	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	6.6	-173.1	73.8	0	0	0	0	114.4	C442 K447 H458	C442-C445 VanDerWaalsContact SG-SG 3.65Å; C445-K447 PolarHBondContact O-N 2.87Å; C445-H458 PolarHBondContact SG-NE2 3.42Å
446	G	83.9	Confident	86	Confident	55 Å²	55	78.7 Å²	78.7	57%	0.567	43%	0.425	S	S	*	.			trans	70.7	-7.9	178.9	0	0	0	0	0	115.9	C442 A448	C442-G446 WeakPolarHBondContact O-CA 3.45Å; C442-G446 PolarHBondContact O-N 3.2Å; G446-A448 PolarHBondContact O-N 3.43Å
447	K	87.3	Confident	86.1	Confident	130 Å²	130	80.5 Å²	80.5	57%	0.565	42%	0.417	S	S	*	.			trans	-62.6	129.9	-177.9	-71.7	-176.4	-179.2	179.4	0	111.4	C442 C445 F449	C442-K447 WeakPolarHBondContact CB-O 3.45Å; C442-K447 PolarHBondContact N-O 2.99Å; C445-K447 PolarHBondContact O-N 2.87Å; K447-F449 HydrophobicContact CB-CE2 3.89Å; K447-F449 HydrophobicContact CB-CZ 3.95Å; K447-F449 VanDerWaalsContact O-CE2 3.29Å; K447-F449 WeakPolarHBondContact O-CE2 3.39Å
448	A	87.9	Confident	86	Confident	25 Å²	25	75.9 Å²	75.9	21%	0.207	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	141.6	-178.2	0	0	0	0	0	112.1	R438 Y440 K441 G446	R438-A448 HydrophobicContact CB-CB 3.56Å; R438-A448 WeakPolarHBondContact CD-O 3.22Å; R438-A448 HydrophobicContact CG-CB 4.47Å; Y440-A448 CarbonylContact O-C 3.43Å; Y440-A448 WeakPolarHBondContact O-CA 3.35Å; K441-A448 HydrophobicContact CG-CB 3.95Å; G446-A448 PolarHBondContact O-N 3.43Å
449	F	86.7	Confident	85.9	Confident	42 Å²	42	74.8 Å²	74.8	18%	0.184	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	153.5	-174.9	-58.4	-88	0	0	0	111.8	R438 Y440 C442 K447 N454 L455 H458	R438-F449 CarbonylContact C-O 3.52Å; R438-F449 WeakPolarHBondContact CA-O 3.32Å; Y440-F449 PolarHBondContact N-O 3.17Å; Y440-F449 PolarHBondContact O-N 2.96Å; C442-F449 HydrophobicContact CB-CE2 4.39Å; K447-F449 HydrophobicContact CB-CE2 3.89Å; K447-F449 HydrophobicContact CB-CZ 3.95Å; K447-F449 VanDerWaalsContact O-CE2 3.29Å; K447-F449 WeakPolarHBondContact O-CE2 3.39Å; F449-N454 HydrophobicContact CB-CB 4.04Å; F449-N454 HydrophobicContact CD1-CB 3.95Å; F449-N454 HydrophobicContact CG-CB 4.23Å; F449-L455 HydrophobicContact CB-CB 4.47Å; F449-L455 HydrophobicContact CD2-CB 3.99Å; F449-L455 HydrophobicContact CD2-CD1 3.8Å; F449-L455 HydrophobicContact CE2-CD1 3.93Å; F449-L455 HydrophobicContact CG-CB 4.43Å; F449-H458 HydrophobicContact CE1-CB 3.98Å; F449-H458 HydrophobicContact CE2-CB 3.79Å; F449-H458 AromaticContact CE2-CD2 3.61Å; F449-H458 AromaticContact CE2-CG 3.62Å; F449-H458 HydrophobicContact CZ-CB 3.4Å; F449-H458 AromaticContact CZ-CD2 3.65Å; F449-H458 AromaticContact CZ-CG 3.22Å; F449-H458 AromaticContact CZ-ND1 3.62Å
450	T	84.8	Confident	85.7	Confident	28 Å²	28	72.6 Å²	72.6	17%	0.172	37%	0.374	C	S	.	.	S	Bend	trans	-79.5	-15.5	178.8	55.7	0	0	0	0	113.5	R432 R438	R432-T450 HydrophobicContact CB-CG2 4.35Å; R432-T450 WeakPolarHBondContact CD-O 3.43Å; R432-T450 PolarHBondContact NH1-O 3.07Å; R438-T450 HydrophobicContact CG-CG2 4.02Å
451	S	85.7	Confident	85.4	Confident	9 Å²	9	72.6 Å²	72.6	6%	0.063	38%	0.379	C	S	.	.	S	Bend	trans	-141.6	152.1	178.4	75.2	0	0	0	0	113.3	Q429 Y440 S453 N454 L455	Q429-S451 VanDerWaalsContact NE2-CB 3.27Å; Q429-S451 PolarHBondContact NE2-OG 3.07Å; Y440-S451 VanDerWaalsContact CD2-CA 3.46Å; S451-S453 VanDerWaalsContact C-N 3.32Å; S451-S453 PolarHBondContact O-N 3.04Å; S451-N454 PolarHBondContact O-N 3.18Å; S451-N454 WeakPolarHBondContact OG-CB 2.95Å; S451-N454 PolarHBondContact OG-N 3.47Å; S451-N454 PolarHBondContact OG-ND2 2.87Å; S451-N454 PolarHBondContact OG-OD1 3.3Å; S451-L455 PolarHBondContact O-N 3.3Å
452	S	86.4	Confident	85.3	Confident	63 Å²	63	69.2 Å²	69.2	44%	0.441	37%	0.365	S	S	.	.	H	α-helix	trans	-66.3	-33.2	177.3	58.9	0	0	0	0	112.6	N454 L455 K456	S452-N454 VanDerWaalsContact C-N 3.33Å; S452-N454 PolarHBondContact O-N 3.09Å; S452-L455 PolarHBondContact O-N 3.47Å; S452-K456 WeakPolarHBondContact O-CB 3.46Å; S452-K456 PolarHBondContact O-N 2.78Å
453	S	84.8	Confident	84.9	Confident	86 Å²	86	72.2 Å²	72.2	60%	0.601	38%	0.383	S	S	*	.	H	α-helix	trans	-62.5	-40.1	174.6	-55.8	0	0	0	0	111.8	S451 K456 Y457	S451-S453 VanDerWaalsContact C-N 3.32Å; S451-S453 PolarHBondContact O-N 3.04Å; S453-K456 PolarHBondContact O-N 3.43Å; S453-Y457 PolarHBondContact O-N 3.43Å
454	N	85.4	Confident	84.5	Confident	71 Å²	71	64.5 Å²	64.5	38%	0.38	36%	0.358	S	S	.	.	H	α-helix	trans	-66.6	-42.6	176.5	-71.2	-0.4	0	0	0	111.1	F449 S451 S452 Y457 H458	F449-N454 HydrophobicContact CB-CB 4.04Å; F449-N454 HydrophobicContact CD1-CB 3.95Å; F449-N454 HydrophobicContact CG-CB 4.23Å; S451-N454 PolarHBondContact O-N 3.18Å; S451-N454 WeakPolarHBondContact OG-CB 2.95Å; S451-N454 PolarHBondContact OG-N 3.47Å; S451-N454 PolarHBondContact OG-ND2 2.87Å; S451-N454 PolarHBondContact OG-OD1 3.3Å; S452-N454 VanDerWaalsContact C-N 3.33Å; S452-N454 PolarHBondContact O-N 3.09Å; N454-Y457 PolarHBondContact O-N 3.49Å; N454-H458 WeakPolarHBondContact O-CB 3.3Å; N454-H458 PolarHBondContact O-N 2.82Å
455	L	86.7	Confident	84.4	Confident	36 Å²	36	64.5 Å²	64.5	19%	0.188	35%	0.352	C	S	.	.	H	α-helix	trans	-61.7	-44.3	173.5	176.2	61.4	0	0	0	111.5	C442 F449 S451 S452 Y457 H458 W459	C442-L455 HydrophobicContact CB-CD1 3.65Å; F449-L455 HydrophobicContact CB-CB 4.47Å; F449-L455 HydrophobicContact CD2-CB 3.99Å; F449-L455 HydrophobicContact CD2-CD1 3.8Å; F449-L455 HydrophobicContact CE2-CD1 3.93Å; F449-L455 HydrophobicContact CG-CB 4.43Å; S451-L455 PolarHBondContact O-N 3.3Å; S452-L455 PolarHBondContact O-N 3.47Å; L455-Y457 VanDerWaalsContact C-N 3.34Å; L455-Y457 PolarHBondContact O-N 2.85Å; L455-H458 CarbonylContact O-C 3.56Å; L455-H458 WeakPolarHBondContact O-CB 3.48Å; L455-H458 PolarHBondContact O-N 3.41Å; L455-W459 WeakPolarHBondContact O-CB 3.46Å; L455-W459 PolarHBondContact O-N 3.47Å
456	K	85.1	Confident	84.3	Confident	131 Å²	131	67 Å²	67	57%	0.57	36%	0.356	S	S	*	.	H	α-helix	trans	-61.7	-40.9	178.1	-171.9	172.8	-174.1	172.5	0	112	S452 S453 W459 R460	S452-K456 WeakPolarHBondContact O-CB 3.46Å; S452-K456 PolarHBondContact O-N 2.78Å; S453-K456 PolarHBondContact O-N 3.43Å; K456-W459 PolarHBondContact O-N 3.06Å; K456-R460 WeakPolarHBondContact O-CG 3.42Å; K456-R460 PolarHBondContact O-N 3.4Å
457	Y	83	Confident	84.2	Confident	89 Å²	89	67 Å²	67	35%	0.349	35%	0.346	S	S	.	.	H	α-helix	trans	-64.7	-44.7	173.7	172.2	-102.1	0	0	0	111.7	S453 N454 L455 W459 R460 K478 N479	S453-Y457 PolarHBondContact O-N 3.43Å; N454-Y457 PolarHBondContact O-N 3.49Å; L455-Y457 VanDerWaalsContact C-N 3.34Å; L455-Y457 PolarHBondContact O-N 2.85Å; Y457-W459 VanDerWaalsContact C-N 3.29Å; Y457-W459 PolarHBondContact O-N 2.84Å; Y457-R460 WeakPolarHBondContact O-CB 3.43Å; Y457-R460 PolarHBondContact O-N 2.8Å; Y457-K478 HydrophobicContact CE2-CB 4.15Å; Y457-N479 HydrophobicContact CD2-CB 4.18Å; Y457-N479 HydrophobicContact CE2-CB 3.93Å
458	H	85.4	Confident	83.9	Confident	18 Å²	18	64.5 Å²	64.5	8%	0.083	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-39.7	176	175.2	71.4	0	0	0	112	C445 F449 N454 L455 R460 L461 H462	C445-H458 PolarHBondContact SG-NE2 3.42Å; F449-H458 HydrophobicContact CE1-CB 3.98Å; F449-H458 HydrophobicContact CE2-CB 3.79Å; F449-H458 AromaticContact CE2-CD2 3.61Å; F449-H458 AromaticContact CE2-CG 3.62Å; F449-H458 HydrophobicContact CZ-CB 3.4Å; F449-H458 AromaticContact CZ-CD2 3.65Å; F449-H458 AromaticContact CZ-CG 3.22Å; F449-H458 AromaticContact CZ-ND1 3.62Å; N454-H458 WeakPolarHBondContact O-CB 3.3Å; N454-H458 PolarHBondContact O-N 2.82Å; L455-H458 CarbonylContact O-C 3.56Å; L455-H458 WeakPolarHBondContact O-CB 3.48Å; L455-H458 PolarHBondContact O-N 3.41Å; H458-R460 VanDerWaalsContact C-N 3.25Å; H458-R460 PolarHBondContact O-N 3.39Å; H458-L461 WeakPolarHBondContact O-CA 3.24Å; H458-L461 WeakPolarHBondContact O-CB 3.46Å; H458-L461 PolarHBondContact O-N 3.27Å; H458-H462 AromaticContact CD2-NE2 3.87Å; H458-H462 AromaticContact CE1-NE2 3.79Å; H458-H462 AromaticContact NE2-CD2 3.79Å; H458-H462 AromaticContact NE2-NE2 3.08Å; H458-H462 PolarHBondContact NE2-NE2 3.49Å
459	W	82.2	Confident	83.7	Confident	128 Å²	128	70.4 Å²	70.4	49%	0.485	36%	0.355	S	S	.	.	H	α-helix	trans	-61.9	-32.8	178	-163.7	72.3	0	0	0	112.6	L455 K456 Y457 L461 H462 T463	L455-W459 WeakPolarHBondContact O-CB 3.46Å; L455-W459 PolarHBondContact O-N 3.47Å; K456-W459 PolarHBondContact O-N 3.06Å; Y457-W459 VanDerWaalsContact C-N 3.29Å; Y457-W459 PolarHBondContact O-N 2.84Å; W459-L461 PolarHBondContact O-N 3.09Å; W459-H462 WeakPolarHBondContact O-CB 3.4Å; W459-H462 PolarHBondContact O-N 3.34Å; W459-T463 HydrophobicContact CD2-CG2 4.04Å; W459-T463 HydrophobicContact CE3-CG2 3.95Å; W459-T463 HydrophobicContact CH2-CG2 3.85Å; W459-T463 HydrophobicContact CZ2-CG2 3.93Å; W459-T463 HydrophobicContact CZ3-CG2 3.85Å; W459-T463 PolarHBondContact O-N 3.04Å; W459-T463 VanDerWaalsContact O-N 3.13Å
460	R	84.8	Confident	83.7	Confident	26 Å²	26	68.4 Å²	68.4	10%	0.098	35%	0.346	C	S	.	.	H	α-helix	trans	-66.1	-13.3	171.1	-63.3	173.3	-176.8	156.4	-1.4	114.1	K456 Y457 H458 G464 E465 K478	K456-R460 WeakPolarHBondContact O-CG 3.42Å; K456-R460 PolarHBondContact O-N 3.4Å; Y457-R460 WeakPolarHBondContact O-CB 3.43Å; Y457-R460 PolarHBondContact O-N 2.8Å; H458-R460 VanDerWaalsContact C-N 3.25Å; H458-R460 PolarHBondContact O-N 3.39Å; R460-G464 PolarHBondContact O-N 3.35Å; R460-E465 HydrophobicContact CG-CB 4.47Å; R460-K478 WeakPolarHBondContact CD-O 3.39Å; R460-K478 PolarHBondContact NH1-O 3.42Å
461	L	81.6	Confident	83.6	Confident	80 Å²	80	75.7 Å²	75.7	42%	0.419	38%	0.378	S	S	.	.	H	α-helix	trans	-75.3	-36.2	170.7	-58.2	176.5	0	0	0	111	H458 W459 K478	H458-L461 WeakPolarHBondContact O-CA 3.24Å; H458-L461 WeakPolarHBondContact O-CB 3.46Å; H458-L461 PolarHBondContact O-N 3.27Å; W459-L461 PolarHBondContact O-N 3.09Å; L461-K478 HydrophobicContact CD2-CD 3.85Å
462	H	82.8	Confident	83.4	Confident	79 Å²	79	81 Å²	81	37%	0.366	40%	0.402	S	S	.	.	H	α-helix	trans	-72.6	-45.4	175.6	-65	-58.2	0	0	0	111.9	H458 W459 G464	H458-H462 AromaticContact CD2-NE2 3.87Å; H458-H462 AromaticContact CE1-NE2 3.79Å; H458-H462 AromaticContact NE2-CD2 3.79Å; H458-H462 AromaticContact NE2-NE2 3.08Å; H458-H462 PolarHBondContact NE2-NE2 3.49Å; W459-H462 WeakPolarHBondContact O-CB 3.4Å; W459-H462 PolarHBondContact O-N 3.34Å; H462-G464 VanDerWaalsContact C-N 3.35Å; H462-G464 PolarHBondContact O-N 3.18Å
463	T	81.1	Confident	83.4	Confident	67 Å²	67	80.7 Å²	80.7	41%	0.411	40%	0.399	S	S	.	.	H	α-helix	trans	-82.3	-11.7	-176.4	63.5	0	0	0	0	114	W459 E465	W459-T463 HydrophobicContact CD2-CG2 4.04Å; W459-T463 HydrophobicContact CE3-CG2 3.95Å; W459-T463 HydrophobicContact CH2-CG2 3.85Å; W459-T463 HydrophobicContact CZ2-CG2 3.93Å; W459-T463 HydrophobicContact CZ3-CG2 3.85Å; W459-T463 PolarHBondContact O-N 3.04Å; W459-T463 VanDerWaalsContact O-N 3.13Å; T463-E465 PolarHBondContact O-N 3.18Å; T463-E465 VanDerWaalsContact O-N 3.1Å; T463-E465 WeakPolarHBondContact OG1-CB 3.37Å; T463-E465 PolarHBondContact OG1-N 3.27Å
464	G	78.1	Confident	83.2	Confident	40 Å²	40	79.1 Å²	79.1	41%	0.412	40%	0.396	S	S	.	.			trans	68.5	1.1	-174.3	0	0	0	0	0	114.8	R460 H462 K466	R460-G464 PolarHBondContact O-N 3.35Å; H462-G464 VanDerWaalsContact C-N 3.35Å; H462-G464 PolarHBondContact O-N 3.18Å; G464-K466 PolarHBondContact O-N 3.19Å
465	E	82	Confident	83.1	Confident	96 Å²	96	81.7 Å²	81.7	45%	0.449	40%	0.404	S	S	.	.			trans	-59.9	126.9	-174	-163.7	-166.7	166.3	0	0	111.7	R460 T463 P467	R460-E465 HydrophobicContact CG-CB 4.47Å; T463-E465 PolarHBondContact O-N 3.18Å; T463-E465 VanDerWaalsContact O-N 3.1Å; T463-E465 WeakPolarHBondContact OG1-CB 3.37Å; T463-E465 PolarHBondContact OG1-N 3.27Å; E465-P467 HydrophobicContact CG-CG 4.06Å; E465-P467 WeakPolarHBondContact O-CD 3.34Å
466	K	83.8	Confident	83	Confident	108 Å²	108	81.7 Å²	81.7	47%	0.47	41%	0.409	S	S	.	.			trans	-120.8	78.7	178.5	-71.4	170.8	176	-174.2	0	110.2	G464 Y468 A476 F477 K478	G464-K466 PolarHBondContact O-N 3.19Å; K466-Y468 VanDerWaalsContact C-N 3.27Å; K466-Y468 PolarHBondContact O-N 2.83Å; K466-A476 HydrophobicContact CB-CB 3.68Å; K466-A476 HydrophobicContact CD-CB 4.14Å; K466-A476 WeakPolarHBondContact CD-O 3.48Å; K466-F477 CarbonylContact C-O 3.25Å; K466-F477 WeakPolarHBondContact CA-O 3.5Å; K466-K478 HydrophobicContact CG-CG 3.73Å
467	P	82.5	Confident	82.9	Confident	56 Å²	56	77.4 Å²	77.4	36%	0.364	39%	0.391	S	S	.	.			trans	-71.7	-19.8	-170.5	-14.8	28.8	0	0	0	114.1	E465	E465-P467 HydrophobicContact CG-CG 4.06Å; E465-P467 WeakPolarHBondContact O-CD 3.34Å
468	Y	82.3	Confident	82.7	Confident	77 Å²	77	75.7 Å²	75.7	30%	0.302	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	106.1	-172.3	-56.1	-84.2	0	0	0	109.5	K466 A476 F477 N479	K466-Y468 VanDerWaalsContact C-N 3.27Å; K466-Y468 PolarHBondContact O-N 2.83Å; Y468-A476 CarbonylContact O-C 3.53Å; Y468-A476 WeakPolarHBondContact O-CA 3.28Å; Y468-F477 PolarHBondContact N-O 2.97Å; Y468-F477 VanDerWaalsContact N-O 3.16Å; Y468-F477 PolarHBondContact O-N 2.95Å; Y468-N479 VanDerWaalsContact CD2-C 3.46Å
469	K	83.6	Confident	82.5	Confident	148 Å²	148	77 Å²	77	64%	0.643	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.1	177.8	-62	-177.3	-178.7	-179	0	110.2	K475 A476	K469-K475 CarbonylContact C-O 3.53Å; K469-A476 HydrophobicContact CG-CB 4.07Å
470	C	86.4	Confident	82.4	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.007	39%	0.386	C	S	.	.			trans	-77.9	122.3	168	-178.5	0	0	0	0	108.4	Q472 C473 G474 K475 F477 V483 H486 Y487	C470-Q472 VanDerWaalsContact C-N 3.3Å; C470-C473 PolarHBondContact SG-SG 3.46Å; C470-G474 WeakPolarHBondContact O-CA 3.49Å; C470-G474 PolarHBondContact O-N 2.91Å; C470-K475 HydrophobicContact CB-CB 4.43Å; C470-K475 WeakPolarHBondContact CB-O 3.15Å; C470-K475 PolarHBondContact N-O 3.33Å; C470-F477 HydrophobicContact CB-CE2 4.26Å; C470-V483 HydrophobicContact CB-CG2 4.19Å; C470-H486 VanDerWaalsContact SG-CD2 3.58Å; C470-Y487 WeakPolarHBondContact CA-OH 3.47Å; C470-Y487 WeakPolarHBondContact SG-CE1 3.34Å
471	E	82.3	Confident	82.3	Confident	181 Å²	181	75.5 Å²	75.5	85%	0.846	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-29.2	-178.7	-69	177	177.3	0	0	111.5	Y487	E471-Y487 PolarHBondContact N-OH 3.44Å
472	Q	80.9	Confident	82.4	Confident	121 Å²	121	73.9 Å²	73.9	57%	0.565	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-28.4	-178.4	-74.6	172.4	-31.5	0	0	114.2	C470 Y487 H490	C470-Q472 VanDerWaalsContact C-N 3.3Å; Q472-Y487 HydrophobicContact CG-CE1 4.5Å; Q472-H490 PolarHBondContact OE1-CD2 3.49Å; Q472-H490 VanDerWaalsContact OE1-CD2 3.22Å
473	C	85.8	Confident	82.4	Confident	55 Å²	55	70.8 Å²	70.8	37%	0.372	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.6	9.2	-176.6	70.6	0	0	0	0	114.5	C470 K475 H486 H490	C470-C473 PolarHBondContact SG-SG 3.46Å; C473-K475 PolarHBondContact O-N 3.07Å; C473-H486 PolarHBondContact SG-NE2 2.92Å; C473-H490 PolarHBondContact SG-NE2 3.5Å
474	G	81.1	Confident	82.5	Confident	53 Å²	53	71.3 Å²	71.3	55%	0.546	39%	0.387	S	S	.	.			trans	69.6	-7.8	178.1	0	0	0	0	0	116	C470 A476	C470-G474 WeakPolarHBondContact O-CA 3.49Å; C470-G474 PolarHBondContact O-N 2.91Å; G474-A476 PolarHBondContact O-N 2.81Å
475	K	84.8	Confident	82.7	Confident	126 Å²	126	77.3 Å²	77.3	55%	0.548	40%	0.397	S	S	.	.			trans	-59.7	127.4	-176.4	-74.7	-178	-179.8	174.6	0	111.4	K469 C470 C473 F477	K469-K475 CarbonylContact C-O 3.53Å; C470-K475 HydrophobicContact CB-CB 4.43Å; C470-K475 WeakPolarHBondContact CB-O 3.15Å; C470-K475 PolarHBondContact N-O 3.33Å; C473-K475 PolarHBondContact O-N 3.07Å; K475-F477 HydrophobicContact CB-CE2 3.62Å; K475-F477 HydrophobicContact CB-CZ 3.91Å; K475-F477 VanDerWaalsContact O-CD2 3.24Å; K475-F477 WeakPolarHBondContact O-CD2 3.39Å; K475-F477 WeakPolarHBondContact O-CE2 3.34Å
476	A	84.3	Confident	82.8	Confident	35 Å²	35	73.7 Å²	73.7	29%	0.289	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	138	-178.1	0	0	0	0	0	112.2	K466 Y468 K469 G474	K466-A476 HydrophobicContact CB-CB 3.68Å; K466-A476 HydrophobicContact CD-CB 4.14Å; K466-A476 WeakPolarHBondContact CD-O 3.48Å; Y468-A476 CarbonylContact O-C 3.53Å; Y468-A476 WeakPolarHBondContact O-CA 3.28Å; K469-A476 HydrophobicContact CG-CB 4.07Å; G474-A476 PolarHBondContact O-N 2.81Å
477	F	81.8	Confident	82.7	Confident	42 Å²	42	71.3 Å²	71.3	18%	0.184	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.3	-174.4	-60.1	-94.4	0	0	0	111.3	K466 Y468 C470 K475 N482 V483 H486	K466-F477 CarbonylContact C-O 3.25Å; K466-F477 WeakPolarHBondContact CA-O 3.5Å; Y468-F477 PolarHBondContact N-O 2.97Å; Y468-F477 VanDerWaalsContact N-O 3.16Å; Y468-F477 PolarHBondContact O-N 2.95Å; C470-F477 HydrophobicContact CB-CE2 4.26Å; K475-F477 HydrophobicContact CB-CE2 3.62Å; K475-F477 HydrophobicContact CB-CZ 3.91Å; K475-F477 VanDerWaalsContact O-CD2 3.24Å; K475-F477 WeakPolarHBondContact O-CD2 3.39Å; K475-F477 WeakPolarHBondContact O-CE2 3.34Å; F477-N482 HydrophobicContact CB-CB 4.22Å; F477-N482 HydrophobicContact CD1-CB 3.93Å; F477-N482 HydrophobicContact CG-CB 4.37Å; F477-V483 HydrophobicContact CB-CB 4.38Å; F477-V483 HydrophobicContact CD2-CB 3.99Å; F477-V483 HydrophobicContact CD2-CG2 3.51Å; F477-V483 HydrophobicContact CE2-CG2 3.94Å; F477-V483 HydrophobicContact CG-CB 4.32Å; F477-V483 HydrophobicContact CG-CG2 4.32Å; F477-H486 HydrophobicContact CE1-CB 3.98Å; F477-H486 HydrophobicContact CE2-CB 4.04Å; F477-H486 AromaticContact CE2-CD2 3.48Å; F477-H486 VanDerWaalsContact CE2-CD2 3.48Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.3Å; F477-H486 AromaticContact CE2-CG 3.76Å; F477-H486 HydrophobicContact CZ-CB 3.5Å; F477-H486 AromaticContact CZ-CD2 3.45Å; F477-H486 VanDerWaalsContact CZ-CD2 3.45Å; F477-H486 WeakPolarHBondContact CZ-CD2 3.41Å; F477-H486 AromaticContact CZ-CG 3.25Å; F477-H486 AromaticContact CZ-ND1 3.79Å
478	K	78.9	Confident	82.6	Confident	53 Å²	53	74.8 Å²	74.8	23%	0.23	38%	0.379	C	S	.	.	S	Bend	trans	-80.2	-14.7	-179.7	-56.9	-172.8	-179.8	-172.3	0	113.9	Y457 R460 L461 K466	Y457-K478 HydrophobicContact CE2-CB 4.15Å; R460-K478 WeakPolarHBondContact CD-O 3.39Å; R460-K478 PolarHBondContact NH1-O 3.42Å; L461-K478 HydrophobicContact CD2-CD 3.85Å; K466-K478 HydrophobicContact CG-CG 3.73Å
479	N	81	Confident	82.6	Confident	45 Å²	45	76.5 Å²	76.5	24%	0.241	39%	0.392	C	S	.	.	S	Bend	trans	-141.8	146.5	-177.9	-173.3	16	0	0	0	111.5	Y457 Y468 S481 N482 V483	Y457-N479 HydrophobicContact CD2-CB 4.18Å; Y457-N479 HydrophobicContact CE2-CB 3.93Å; Y468-N479 VanDerWaalsContact CD2-C 3.46Å; N479-S481 PolarHBondContact ND2-OG 2.98Å; N479-N482 PolarHBondContact O-N 2.93Å; N479-V483 PolarHBondContact O-N 2.99Å
480	S	81.7	Confident	82.3	Confident	49 Å²	49	72.8 Å²	72.8	34%	0.343	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-38.9	175.7	59.1	0	0	0	0	112	N482 V483 T484	S480-N482 PolarHBondContact O-N 3.12Å; S480-V483 WeakPolarHBondContact O-CG1 3.24Å; S480-V483 PolarHBondContact O-N 3.26Å; S480-V483 VanDerWaalsContact O-N 3.09Å; S480-T484 PolarHBondContact O-N 3.35Å; S480-T484 PolarHBondContact O-OG1 3.48Å
481	S	82.6	Confident	81.5	Confident	73 Å²	73	77.7 Å²	77.7	51%	0.51	41%	0.406	S	S	.	.	H	α-helix	trans	-59.5	-34.3	177.2	-46.3	0	0	0	0	112.5	N479 R485	N479-S481 PolarHBondContact ND2-OG 2.98Å; S481-R485 WeakPolarHBondContact O-CB 3.27Å; S481-R485 PolarHBondContact O-N 3.31Å
482	N	82.9	Confident	80.7	Confident	47 Å²	47	78.6 Å²	78.6	25%	0.251	40%	0.402	S	S	.	.	H	α-helix	trans	-71.9	-40.1	176.9	-71	-8.1	0	0	0	111.4	F477 N479 S480 R485 H486	F477-N482 HydrophobicContact CB-CB 4.22Å; F477-N482 HydrophobicContact CD1-CB 3.93Å; F477-N482 HydrophobicContact CG-CB 4.37Å; N479-N482 PolarHBondContact O-N 2.93Å; S480-N482 PolarHBondContact O-N 3.12Å; N482-R485 PolarHBondContact O-N 3.18Å; N482-R485 PolarHBondContact OD1-NH2 3.34Å; N482-H486 VanDerWaalsContact O-CB 3.29Å; N482-H486 WeakPolarHBondContact O-CB 3.41Å; N482-H486 PolarHBondContact O-N 3.33Å
483	V	82.9	Confident	79.2	Confident	13 Å²	13	81.3 Å²	81.3	8%	0.079	42%	0.415	C	S	.	.	H	α-helix	trans	-66.9	-42.3	175.3	95.9	0	0	0	0	110.7	C470 F477 N479 S480 R485 H486 Y487	C470-V483 HydrophobicContact CB-CG2 4.19Å; F477-V483 HydrophobicContact CB-CB 4.38Å; F477-V483 HydrophobicContact CD2-CB 3.99Å; F477-V483 HydrophobicContact CD2-CG2 3.51Å; F477-V483 HydrophobicContact CE2-CG2 3.94Å; F477-V483 HydrophobicContact CG-CB 4.32Å; F477-V483 HydrophobicContact CG-CG2 4.32Å; N479-V483 PolarHBondContact O-N 2.99Å; S480-V483 WeakPolarHBondContact O-CG1 3.24Å; S480-V483 PolarHBondContact O-N 3.26Å; S480-V483 VanDerWaalsContact O-N 3.09Å; V483-R485 PolarHBondContact O-N 3.35Å; V483-H486 CarbonylContact O-C 3.52Å; V483-H486 WeakPolarHBondContact O-CB 3.39Å; V483-H486 PolarHBondContact O-N 2.93Å; V483-H486 VanDerWaalsContact O-N 3.12Å; V483-Y487 HydrophobicContact CB-CE2 4.46Å; V483-Y487 HydrophobicContact CG1-CD2 4.12Å; V483-Y487 HydrophobicContact CG1-CE2 3.93Å; V483-Y487 HydrophobicContact CG2-CD2 4.18Å; V483-Y487 HydrophobicContact CG2-CE2 3.82Å; V483-Y487 WeakPolarHBondContact O-CD2 3.3Å; V483-Y487 PolarHBondContact O-N 3.21Å
484	T	82.1	Confident	76.9	Confident	79 Å²	79	85.2 Å²	85.2	49%	0.485	43%	0.432	S	S	.	.	H	α-helix	trans	-62	-42	176.1	-53.5	0	0	0	0	111.8	S480 H486 Y487 K488	S480-T484 PolarHBondContact O-N 3.35Å; S480-T484 PolarHBondContact O-OG1 3.48Å; T484-H486 VanDerWaalsContact C-N 3.31Å; T484-Y487 PolarHBondContact O-N 3.46Å; T484-K488 PolarHBondContact O-N 3.03Å
485	R	83.2	Confident	75.2	Confident	165 Å²	165	88.5 Å²	88.5	62%	0.623	44%	0.443	S	S	*	.	H	α-helix	trans	-64.6	-38.3	173.9	179.2	171.3	59.5	-174.4	-1.8	111.7	S481 N482 V483 K488	S481-R485 WeakPolarHBondContact O-CB 3.27Å; S481-R485 PolarHBondContact O-N 3.31Å; N482-R485 PolarHBondContact O-N 3.18Å; N482-R485 PolarHBondContact OD1-NH2 3.34Å; V483-R485 PolarHBondContact O-N 3.35Å; R485-K488 WeakPolarHBondContact O-CB 3.22Å; R485-K488 PolarHBondContact O-N 3.15Å
486	H	84.1	Confident	73	Confident	20 Å²	20	93 Å²	93	9%	0.093	47%	0.473	C	S	.	.	H	α-helix	trans	-69	-38.7	177	172.8	66.9	0	0	0	112.5	C470 C473 F477 N482 V483 T484 K488 I489 H490	C470-H486 VanDerWaalsContact SG-CD2 3.58Å; C473-H486 PolarHBondContact SG-NE2 2.92Å; F477-H486 HydrophobicContact CE1-CB 3.98Å; F477-H486 HydrophobicContact CE2-CB 4.04Å; F477-H486 AromaticContact CE2-CD2 3.48Å; F477-H486 VanDerWaalsContact CE2-CD2 3.48Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.3Å; F477-H486 AromaticContact CE2-CG 3.76Å; F477-H486 HydrophobicContact CZ-CB 3.5Å; F477-H486 AromaticContact CZ-CD2 3.45Å; F477-H486 VanDerWaalsContact CZ-CD2 3.45Å; F477-H486 WeakPolarHBondContact CZ-CD2 3.41Å; F477-H486 AromaticContact CZ-CG 3.25Å; F477-H486 AromaticContact CZ-ND1 3.79Å; N482-H486 VanDerWaalsContact O-CB 3.29Å; N482-H486 WeakPolarHBondContact O-CB 3.41Å; N482-H486 PolarHBondContact O-N 3.33Å; V483-H486 CarbonylContact O-C 3.52Å; V483-H486 WeakPolarHBondContact O-CB 3.39Å; V483-H486 PolarHBondContact O-N 2.93Å; V483-H486 VanDerWaalsContact O-N 3.12Å; T484-H486 VanDerWaalsContact C-N 3.31Å; H486-K488 PolarHBondContact O-N 3.11Å; H486-I489 VanDerWaalsContact O-CB 3.25Å; H486-I489 WeakPolarHBondContact O-CB 3.44Å; H486-I489 WeakPolarHBondContact O-CG1 3.49Å; H486-I489 PolarHBondContact O-N 3.49Å; H486-H490 AromaticContact CD2-NE2 3.81Å; H486-H490 AromaticContact CE1-NE2 3.46Å; H486-H490 PolarHBondContact CE1-NE2 2.88Å; H486-H490 AromaticContact NE2-CD2 3.86Å; H486-H490 AromaticContact NE2-CE1 3.96Å; H486-H490 AromaticContact NE2-NE2 3.02Å; H486-H490 PolarHBondContact NE2-NE2 3.4Å
487	Y	80.7	Confident	72.4	Confident	59 Å²	59	95.9 Å²	95.9	23%	0.231	48%	0.483	C	S	.	.	H	α-helix	trans	-57.5	-32.1	172.4	-83.7	-63.8	0	0	0	112.4	C470 E471 Q472 V483 T484 I489 H490 T491	C470-Y487 WeakPolarHBondContact CA-OH 3.47Å; C470-Y487 WeakPolarHBondContact SG-CE1 3.34Å; E471-Y487 PolarHBondContact N-OH 3.44Å; Q472-Y487 HydrophobicContact CG-CE1 4.5Å; V483-Y487 HydrophobicContact CB-CE2 4.46Å; V483-Y487 HydrophobicContact CG1-CD2 4.12Å; V483-Y487 HydrophobicContact CG1-CE2 3.93Å; V483-Y487 HydrophobicContact CG2-CD2 4.18Å; V483-Y487 HydrophobicContact CG2-CE2 3.82Å; V483-Y487 WeakPolarHBondContact O-CD2 3.3Å; V483-Y487 PolarHBondContact O-N 3.21Å; T484-Y487 PolarHBondContact O-N 3.46Å; Y487-I489 PolarHBondContact O-N 3.13Å; Y487-H490 PolarHBondContact O-N 3.25Å; Y487-H490 VanDerWaalsContact O-N 3.11Å; Y487-T491 PolarHBondContact O-N 3.47Å
488	K	81.8	Confident	71.9	Confident	129 Å²	129	98.7 Å²	98.7	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-64.8	-17.4	175.4	-66.8	-178	179.5	-169.3	0	114.3	T484 R485 H486 T491 R492	T484-K488 PolarHBondContact O-N 3.03Å; R485-K488 WeakPolarHBondContact O-CB 3.22Å; R485-K488 PolarHBondContact O-N 3.15Å; H486-K488 PolarHBondContact O-N 3.11Å; K488-T491 WeakPolarHBondContact CA-OG1 3.37Å; K488-T491 PolarHBondContact O-OG1 3.26Å; K488-R492 WeakPolarHBondContact O-CG 3.41Å; K488-R492 PolarHBondContact O-N 3.43Å
489	I	81.3	Confident	71.5	Confident	113 Å²	113	101.2 Å²	101.2	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-75.4	-40.9	174.7	-56.5	173.7	0	0	0	109.1	H486 Y487 T491 R492	H486-I489 VanDerWaalsContact O-CB 3.25Å; H486-I489 WeakPolarHBondContact O-CB 3.44Å; H486-I489 WeakPolarHBondContact O-CG1 3.49Å; H486-I489 PolarHBondContact O-N 3.49Å; Y487-I489 PolarHBondContact O-N 3.13Å; I489-T491 PolarHBondContact O-N 3.34Å; I489-R492 PolarHBondContact O-N 3.34Å
490	H	77.6	Confident	71	Confident	70 Å²	70	104.5 Å²	104.5	32%	0.324	53%	0.529	S	S	.	.	H	α-helix	trans	-70.3	-19.7	175.4	-60	-56.6	0	0	0	113.4	Q472 C473 H486 Y487	Q472-H490 PolarHBondContact OE1-CD2 3.49Å; Q472-H490 VanDerWaalsContact OE1-CD2 3.22Å; C473-H490 PolarHBondContact SG-NE2 3.5Å; H486-H490 AromaticContact CD2-NE2 3.81Å; H486-H490 AromaticContact CE1-NE2 3.46Å; H486-H490 PolarHBondContact CE1-NE2 2.88Å; H486-H490 AromaticContact NE2-CD2 3.86Å; H486-H490 AromaticContact NE2-CE1 3.96Å; H486-H490 AromaticContact NE2-NE2 3.02Å; H486-H490 PolarHBondContact NE2-NE2 3.4Å; Y487-H490 PolarHBondContact O-N 3.25Å; Y487-H490 VanDerWaalsContact O-N 3.11Å
491	T	69.8	Low	70.3	Confident	103 Å²	103	108 Å²	108	63%	0.632	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	8.6	176.8	67.3	0	0	0	0	113.2	Y487 K488 I489	Y487-T491 PolarHBondContact O-N 3.47Å; K488-T491 WeakPolarHBondContact CA-OG1 3.37Å; K488-T491 PolarHBondContact O-OG1 3.26Å; I489-T491 PolarHBondContact O-N 3.34Å
492	R	66.3	Low	69.5	Low	201 Å²	201	110.3 Å²	110.3	76%	0.758	54%	0.543	S	S	*	.	S	Bend	trans	-116.8	91.7	175.7	-83.3	-177.8	169.6	-171	-5.5	108.6	K488 I489	K488-R492 WeakPolarHBondContact O-CG 3.41Å; K488-R492 PolarHBondContact O-N 3.43Å; I489-R492 PolarHBondContact O-N 3.34Å
493	E	48.5	Very low	68.5	Low	178 Å²	178	114.9 Å²	114.9	83%	0.832	56%	0.564	S	S	*	*			trans	136.1	105	171.9	-80.9	167.6	-161.8	0	0	106.4
494	N	37	Very low	67.4	Low	137 Å²	137	122.7 Å²	122.7	73%	0.733	60%	0.601	S	S	*	*				-137.5	129.9	51.8	-95.3	-4.7	0	0	0	113.1
495	P	46.1	Very low	66.2	Low	121 Å²	121	126.3 Å²	126.3	79%	0.786	61%	0.611	S	S	*	*			trans	-88.6	112.7	140	28.7	-14.8	0	0	0	108.8
496	D	38.2	Very low	64.7	Low	220 Å²	220	122.8 Å²	122.8	100%	1.176	61%	0.61	S	S	*	*			trans	-86.9	0	151.2	-82.6	-45.2	0	0	0	108.6

Retrieved 496 of 496 residues in 89.2 ms (Link to these results)

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