X5DNC0_HUMAN Loading...

Succinate-semialdehyde dehydrogenase, mitochondrial

AlphaFold DB , UniProt , Accession X5DNC0, Species HUMAN (Homo sapiens, Human), Gene ALDH5A1, Length 516 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	32	Very low	26.2	Very low	241 Å²	241	146.4 Å²	146.4	100%	1.187	83%	0.827	S	S	*	*				0	94.6	0	-74.4	174.4	-178.2	0	0	106.1
2	A	27.8	Very low	26.4	Very low	93 Å²	93	142.8 Å²	142.8	77%	0.769	83%	0.829	S	S	*	*				75.6	127.1	93.4	0	0	0	0	0	109.6
3	T	28.3	Very low	26.3	Very low	125 Å²	125	150.2 Å²	150.2	77%	0.767	84%	0.835	S	S	*	*			cis	-165.9	144.2	27.9	-31.5	0	0	0	0	109.8
4	C	22.7	Very low	26.3	Very low	115 Å²	115	157.2 Å²	157.2	78%	0.777	84%	0.842	S	S	*	*			trans	-65.2	-174.1	160.6	-67.4	0	0	0	0	113
5	I	27.9	Very low	26.4	Very low	134 Å²	134	158.2 Å²	158.2	69%	0.687	85%	0.846	S	S	*	*			trans	100.9	111.8	163.2	-45.9	159.3	0	0	0	110.5
6	W	23.9	Very low	26.3	Very low	197 Å²	197	152.9 Å²	152.9	75%	0.746	84%	0.841	S	S	*	*				-147.6	121.7	67.1	-93.4	74.9	0	0	0	114.6	R8	W6-R8 HydrophobicContact CE3-CB 4.45Å; W6-R8 HydrophobicContact CE3-CG 3.84Å; W6-R8 HydrophobicContact CZ3-CG 3.69Å
7	L	23.4	Very low	26.3	Very low	169 Å²	169	151.1 Å²	151.1	89%	0.885	84%	0.842	S	S	*	*			trans	-85.5	132	149	-88.7	150.6	0	0	0	108
8	R	26.4	Very low	26.3	Very low	213 Å²	213	150 Å²	150	80%	0.804	84%	0.84	S	S	*	*			trans	-143.6	141.4	145.2	-89.6	-156.7	-174.2	-168.2	-0.6	112.1	W6	W6-R8 HydrophobicContact CE3-CB 4.45Å; W6-R8 HydrophobicContact CE3-CG 3.84Å; W6-R8 HydrophobicContact CZ3-CG 3.69Å
9	S	26.9	Very low	26.4	Very low	115 Å²	115	152.2 Å²	152.2	80%	0.804	84%	0.84	S	S	*	*			trans	-89.1	163	-162.7	37.3	0	0	0	0	114.9
10	C	23.7	Very low	26.7	Very low	134 Å²	134	151.3 Å²	151.3	91%	0.905	84%	0.841	S	S	*	*			trans	-38.1	144.2	165.3	-66.8	0	0	0	0	115.5
11	G	25.5	Very low	26.6	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	84%	0.835	S	S	*	*			trans	-153.8	91.3	164.4	0	0	0	0	0	111.2
12	A	27.8	Very low	26.2	Very low	104 Å²	104	142.3 Å²	142.3	86%	0.86	82%	0.822	S	S	*	*			trans	-70.9	133.5	166.3	0	0	0	0	0	109.8
13	R	25.5	Very low	26.1	Very low	239 Å²	239	149.4 Å²	149.4	90%	0.902	83%	0.829	S	S	*	*			trans	-117.7	111.6	164.2	-78.3	-170.8	-171.9	-157.5	2.1	110
14	R	26	Very low	26	Very low	248 Å²	248	152.1 Å²	152.1	94%	0.936	84%	0.838	S	S	*	*			trans	-77.1	132.9	156.2	-70.7	-179.6	-177.6	-158.2	0.1	107.8
15	L	28.3	Very low	26.3	Very low	172 Å²	172	158.2 Å²	158.2	90%	0.901	84%	0.844	S	S	*	*			trans	-134.9	113.1	157.2	-84.3	166.1	0	0	0	107.3
16	G	23.9	Very low	26.4	Very low	74 Å²	74	157.3 Å²	157.3	76%	0.763	85%	0.847	S	S	*	*			trans	-121.2	137.8	160.9	0	0	0	0	0	107.8
17	S	26.8	Very low	26.5	Very low	122 Å²	122	159.9 Å²	159.9	85%	0.853	86%	0.857	S	S	*	*			trans	-161	141.4	150.9	54	0	0	0	0	110.1
18	T	27	Very low	26.9	Very low	131 Å²	131	157.1 Å²	157.1	80%	0.804	86%	0.859	S	S	*	*			trans	-78.9	149.7	-167.5	39.2	0	0	0	0	115.9
19	F	27.4	Very low	27	Very low	192 Å²	192	150.3 Å²	150.3	84%	0.842	85%	0.854	S	S	*	*			trans	2.9	153.2	144.7	-75.8	-82	0	0	0	122.1
20	P	32.1	Very low	26.9	Very low	133 Å²	133	148.4 Å²	148.4	86%	0.864	85%	0.853	S	S	*	*				-129.2	152.7	91.4	36.7	-25.9	0	0	0	110.8
21	G	25	Very low	27.1	Very low	70 Å²	70	150.2 Å²	150.2	72%	0.722	85%	0.853	S	S	*	*			cis	114.1	80.2	32.4	0	0	0	0	0	108.9
22	C	24.3	Very low	27.4	Very low	135 Å²	135	152.3 Å²	152.3	91%	0.912	85%	0.85	S	S	*	*			trans	-143	114.6	165.6	-146.4	0	0	0	0	110.5
23	R	25.1	Very low	27.5	Very low	242 Å²	242	152.9 Å²	152.9	91%	0.913	85%	0.846	S	S	*	*			trans	-85.7	129.3	179.2	-70.6	177.5	179.7	-168	0.3	109.9
24	L	26.8	Very low	27.5	Very low	181 Å²	181	146.2 Å²	146.2	95%	0.948	84%	0.841	S	S	*	*			trans	-141.6	127.8	148.4	-82.8	171.8	0	0	0	109
25	R	28.7	Very low	27.6	Very low	243 Å²	243	139.8 Å²	139.8	92%	0.917	84%	0.835	S	S	*	*			trans	-86.4	170.2	-179	-105.7	-165.4	-175.1	-162.7	2.8	111
26	P	29.6	Very low	27.7	Very low	116 Å²	116	134.2 Å²	134.2	75%	0.753	82%	0.818	S	S	*	*			trans	-94.1	150.7	-131	37.2	-36.8	0	0	0	113.6
27	R	26.3	Very low	27.8	Very low	250 Å²	250	136.7 Å²	136.7	94%	0.943	82%	0.821	S	S	*	*			trans	-107	123.2	155.8	-92	-173	174.6	-173.7	-1	109.2
28	A	32	Very low	27.9	Very low	112 Å²	112	134.8 Å²	134.8	93%	0.926	81%	0.813	S	S	*	*			trans	-58.7	128.6	171.8	0	0	0	0	0	110.3
29	G	27.3	Very low	28.1	Very low	69 Å²	69	134.8 Å²	134.8	71%	0.711	82%	0.815	S	S	*	*			trans	-161.2	70.6	174.3	0	0	0	0	0	107.1	L31	G29-L31 PolarHBondContact O-N 3.31Å; G29-L31 VanDerWaalsContact O-N 3.1Å
30	G	26.4	Very low	28.1	Very low	75 Å²	75	128.2 Å²	128.2	77%	0.773	80%	0.801	S	S	*	*			trans	-65.4	105.5	178.8	0	0	0	0	0	110.2	V32	G30-V32 PolarHBondContact O-N 3.47Å
31	L	28.1	Very low	28.1	Very low	172 Å²	172	127.9 Å²	127.9	90%	0.901	80%	0.799	S	S	*	*			trans	-85	91.4	157.3	-84.1	158.6	0	0	0	106.9	G29	G29-L31 PolarHBondContact O-N 3.31Å; G29-L31 VanDerWaalsContact O-N 3.1Å
32	V	30.7	Very low	28.5	Very low	118 Å²	118	128.3 Å²	128.3	72%	0.715	80%	0.796	S	S	*	*			trans	-53.8	122	163.9	178	0	0	0	0	107.1	G30 A34	G30-V32 PolarHBondContact O-N 3.47Å; V32-A34 PolarHBondContact O-N 3.18Å
33	P	29.5	Very low	28.9	Very low	117 Å²	117	129.8 Å²	129.8	76%	0.76	79%	0.79	S	S	*	*			trans	-64.7	114.7	163.5	24.2	-23	0	0	0	105.3	S35	P33-S35 PolarHBondContact O-N 3.39Å
34	A	26.4	Very low	29.5	Very low	98 Å²	98	123.4 Å²	123.4	81%	0.81	77%	0.773	S	S	*	*			trans	-52.6	106.1	174.3	0	0	0	0	0	107.6	V32 G36	V32-A34 PolarHBondContact O-N 3.18Å; A34-G36 PolarHBondContact O-N 2.97Å
35	S	28.3	Very low	30.1	Very low	114 Å²	114	123.5 Å²	123.5	80%	0.797	76%	0.761	S	S	*	*			trans	-64.6	86.2	167.1	51.1	0	0	0	0	106.3	P33	P33-S35 PolarHBondContact O-N 3.39Å
36	G	29.7	Very low	30.4	Very low	54 Å²	54	118.6 Å²	118.6	56%	0.557	76%	0.762	S	S	*	*			trans	-55.4	144	162	0	0	0	0	0	108	A34 A38	A34-G36 PolarHBondContact O-N 2.97Å; G36-A38 PolarHBondContact O-N 2.82Å
37	P	27.1	Very low	31.1	Very low	126 Å²	126	117 Å²	117	82%	0.818	74%	0.742	S	S	*	*			trans	-55.9	135.1	-179.3	24.8	-31.5	0	0	0	108.3
38	A	28.6	Very low	31.8	Very low	83 Å²	83	107 Å²	107	69%	0.686	71%	0.712	S	S	*	*			trans	-45.2	134.9	164.1	0	0	0	0	0	107.7	G36 G40	G36-A38 PolarHBondContact O-N 2.82Å; A38-G40 PolarHBondContact O-N 2.73Å
39	P	31.3	Very low	32.4	Very low	130 Å²	130	105.1 Å²	105.1	84%	0.844	70%	0.704	S	S	*	*			trans	-56.7	113.1	176.1	23	-29.5	0	0	0	106.4
40	G	26.4	Very low	33.6	Very low	54 Å²	54	112.3 Å²	112.3	56%	0.557	71%	0.71	S	S	*	*			trans	-56.7	158.3	176	0	0	0	0	0	109.2	A38 A42	A38-G40 PolarHBondContact O-N 2.73Å; G40-A42 PolarHBondContact O-N 2.85Å
41	P	32.9	Very low	34.8	Very low	126 Å²	126	110.1 Å²	110.1	82%	0.818	68%	0.68	S	S	*	*			trans	-51	119	174.7	22.1	-30.7	0	0	0	107.5	Q43	P41-Q43 PolarHBondContact O-N 2.53Å
42	A	33.9	Very low	35.9	Very low	80 Å²	80	105.7 Å²	105.7	66%	0.661	67%	0.668	S	S	*	*			trans	-50.1	112.2	170.1	0	0	0	0	0	105.6	G40 L44	G40-A42 PolarHBondContact O-N 2.85Å; A42-L44 PolarHBondContact O-N 2.65Å
43	Q	32.3	Very low	37.2	Very low	166 Å²	166	103 Å²	103	78%	0.776	66%	0.664	S	S	*	*			trans	-56.1	112.2	-177.3	-79.3	177.8	-20.2	0	0	106.6	P41 R45	P41-Q43 PolarHBondContact O-N 2.53Å; Q43-R45 PolarHBondContact O-N 3.02Å
44	L	38.1	Very low	39.1	Very low	108 Å²	108	98.4 Å²	98.4	57%	0.565	63%	0.633	S	S	*	*			trans	-54.2	83.6	153.6	-80.5	150.2	0	0	0	105.4	A42 C46	A42-L44 PolarHBondContact O-N 2.65Å; L44-C46 PolarHBondContact O-N 2.81Å
45	R	37.6	Very low	41.5	Very low	182 Å²	182	96 Å²	96	69%	0.687	61%	0.61	S	S	*	*			trans	-54.1	130.6	167.2	-76.8	-174.2	174.7	-146.6	-1	104.9	Q43 Y47	Q43-R45 PolarHBondContact O-N 3.02Å; R45-Y47 VanDerWaalsContact C-N 3.34Å; R45-Y47 HydrophobicContact CB-CE2 4.14Å; R45-Y47 WeakPolarHBondContact O-CD2 3.24Å; R45-Y47 VanDerWaalsContact O-CE2 3.28Å; R45-Y47 WeakPolarHBondContact O-CE2 3.17Å; R45-Y47 PolarHBondContact O-N 2.83Å
46	C	37	Very low	43.7	Very low	140 Å²	140	93.8 Å²	93.8	95%	0.946	60%	0.599	S	S	*	*			trans	-46.4	95	-176.1	-72.5	0	0	0	0	111.7	L44	L44-C46 PolarHBondContact O-N 2.81Å
47	Y	43	Very low	46.4	Very low	82 Å²	82	92.6 Å²	92.6	32%	0.322	58%	0.584	S	S	.	*			trans	-92	124.3	171.3	-69.4	-73.1	0	0	0	106.3	R45 A86 L87	R45-Y47 VanDerWaalsContact C-N 3.34Å; R45-Y47 HydrophobicContact CB-CE2 4.14Å; R45-Y47 WeakPolarHBondContact O-CD2 3.24Å; R45-Y47 VanDerWaalsContact O-CE2 3.28Å; R45-Y47 WeakPolarHBondContact O-CE2 3.17Å; R45-Y47 PolarHBondContact O-N 2.83Å; Y47-A86 HydrophobicContact CD1-CB 4.26Å; Y47-L87 WeakPolarHBondContact CB-O 3.35Å
48	A	41.7	Very low	49.4	Very low	40 Å²	40	86.6 Å²	86.6	33%	0.331	55%	0.545	S	S	.	.			trans	23.4	116.4	178.6	0	0	0	0	0	117.4	R50 L51 A85	A48-R50 PolarHBondContact O-N 3.31Å; A48-L51 PolarHBondContact O-N 3.41Å; A48-L51 VanDerWaalsContact O-N 3.17Å; A48-A85 HydrophobicContact CB-CB 4.21Å
49	G	43.7	Very low	52.3	Low	73 Å²	73	84 Å²	84	75%	0.753	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	13.9	-177.9	0	0	0	0	0	118.3
50	R	53.2	Low	55.2	Low	220 Å²	220	81.1 Å²	81.1	83%	0.83	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-16.2	175.4	-61.6	-173.2	-165.1	-155.4	3.7	114.6	A48 A52	A48-R50 PolarHBondContact O-N 3.31Å; R50-A52 VanDerWaalsContact C-N 3.32Å
51	L	52.3	Low	58.5	Low	30 Å²	30	80.6 Å²	80.6	16%	0.157	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.6	158.8	-66.5	-175.4	0	0	0	112	A48 G53 L54 L59 L87	A48-L51 PolarHBondContact O-N 3.41Å; A48-L51 VanDerWaalsContact O-N 3.17Å; L51-G53 VanDerWaalsContact C-N 3.28Å; L51-G53 PolarHBondContact O-N 2.77Å; L51-L54 HydrophobicContact CB-CD1 4.21Å; L51-L54 HydrophobicContact CD2-CD1 3.64Å; L51-L54 HydrophobicContact CG-CD1 4.36Å; L51-L54 PolarHBondContact O-N 2.89Å; L51-L54 VanDerWaalsContact O-N 3.09Å; L51-L59 HydrophobicContact CD1-CD2 4.28Å; L51-L87 HydrophobicContact CD1-CB 4.43Å; L51-L87 HydrophobicContact CD1-CD2 3.68Å; L51-L87 HydrophobicContact CG-CD2 4.42Å
52	A	50.5	Low	61.6	Low	78 Å²	78	76.7 Å²	76.7	65%	0.645	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	85.3	172.5	0	0	0	0	0	109.7	R50	R50-A52 VanDerWaalsContact C-N 3.32Å
53	G	58.6	Low	64.7	Low	61 Å²	61	73 Å²	73	63%	0.629	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.9	-12	-173.6	0	0	0	0	0	113.8	L51	L51-G53 VanDerWaalsContact C-N 3.28Å; L51-G53 PolarHBondContact O-N 2.77Å
54	L	68.9	Low	67.9	Low	21 Å²	21	65.6 Å²	65.6	11%	0.11	39%	0.385	C	S	.	.	S	Bend	trans	-67.9	147.8	167.3	-74.6	174.1	0	0	0	111	L51 A56 D137 R140 I141	L51-L54 HydrophobicContact CB-CD1 4.21Å; L51-L54 HydrophobicContact CD2-CD1 3.64Å; L51-L54 HydrophobicContact CG-CD1 4.36Å; L51-L54 PolarHBondContact O-N 2.89Å; L51-L54 VanDerWaalsContact O-N 3.09Å; L54-A56 PolarHBondContact O-N 2.89Å; L54-D137 HydrophobicContact CD2-CB 3.79Å; L54-R140 HydrophobicContact CD2-CB 3.79Å; L54-I141 HydrophobicContact CD1-CD1 4.1Å; L54-I141 HydrophobicContact CD1-CG1 3.86Å; L54-I141 HydrophobicContact CD2-CD1 4.49Å; L54-I141 HydrophobicContact CD2-CG1 4.4Å
55	S	76.4	Confident	70.8	Confident	47 Å²	47	61 Å²	61	33%	0.329	36%	0.361	S	S	.	.			trans	-51.5	116.9	166.1	177.4	0	0	0	0	110.4	A57 L58 D137	S55-A57 PolarHBondContact O-N 3.48Å; S55-L58 PolarHBondContact O-N 3.23Å; S55-D137 WeakPolarHBondContact CB-OD2 3.33Å; S55-D137 PolarHBondContact N-OD2 3.3Å
56	A	74.8	Confident	73.7	Confident	68 Å²	68	53.4 Å²	53.4	56%	0.562	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.1	-177.5	0	0	0	0	0	113.1	L54	L54-A56 PolarHBondContact O-N 2.89Å
57	A	86.1	Confident	76.6	Confident	29 Å²	29	48.2 Å²	48.2	24%	0.24	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-29.6	176.4	0	0	0	0	0	113.2	S55 R60 E223	S55-A57 PolarHBondContact O-N 3.48Å; A57-R60 WeakPolarHBondContact O-CG 3.41Å; A57-R60 PolarHBondContact O-NE 3.02Å; A57-E223 HydrophobicContact CB-CG 4.24Å; A57-E223 VanDerWaalsContact O-CG 3.3Å; A57-E223 WeakPolarHBondContact O-CG 3.48Å
58	L	89.1	Confident	79.2	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-34.4	-175.9	-65	178	0	0	0	112.7	S55 R60 N134 D137 I141 A220 E223 L224	S55-L58 PolarHBondContact O-N 3.23Å; L58-R60 PolarHBondContact O-N 3.38Å; L58-N134 HydrophobicContact CD1-CB 4Å; L58-D137 HydrophobicContact CD1-CB 3.79Å; L58-I141 HydrophobicContact CB-CD1 4.09Å; L58-A220 HydrophobicContact CB-CB 4.37Å; L58-A220 WeakPolarHBondContact O-CA 2.87Å; L58-A220 WeakPolarHBondContact O-CB 3.36Å; L58-E223 HydrophobicContact CD2-CB 4.43Å; L58-E223 HydrophobicContact CD2-CG 4.13Å; L58-L224 HydrophobicContact CD2-CD1 4.4Å; L58-L224 HydrophobicContact CD2-CD2 3.63Å; L58-L224 HydrophobicContact CD2-CG 3.84Å
59	L	89.4	Confident	81.9	Confident	27 Å²	27	53.7 Å²	53.7	14%	0.141	32%	0.321	C	S	.	.	S	Bend	trans	-84.7	100.6	176.6	-172.2	65.2	0	0	0	110	L51 F216	L51-L59 HydrophobicContact CD1-CD2 4.28Å; L59-F216 HydrophobicContact CD1-CB 4.21Å; L59-F216 HydrophobicContact CD1-CD1 3.62Å; L59-F216 HydrophobicContact CD1-CD2 4.21Å; L59-F216 HydrophobicContact CD1-CE1 3.97Å; L59-F216 HydrophobicContact CD1-CG 3.76Å; L59-F216 HydrophobicContact CD1-CZ 4.41Å
60	R	93.6	Very high	84.6	Confident	70 Å²	70	53.7 Å²	53.7	26%	0.264	30%	0.303	S	S	.	.			trans	-117	148.6	-174.6	-66.1	-71.7	-167.9	170.7	3.8	111.6	A57 L58 W69 F216 L219 E223	A57-R60 WeakPolarHBondContact O-CG 3.41Å; A57-R60 PolarHBondContact O-NE 3.02Å; L58-R60 PolarHBondContact O-N 3.38Å; R60-W69 HydrophobicContact CB-CE3 4.28Å; R60-W69 HydrophobicContact CB-CH2 3.84Å; R60-W69 HydrophobicContact CB-CZ2 4.45Å; R60-W69 HydrophobicContact CB-CZ3 3.72Å; R60-W69 HydrophobicContact CG-CE3 4.4Å; R60-W69 HydrophobicContact CG-CH2 3.57Å; R60-W69 HydrophobicContact CG-CZ2 3.73Å; R60-W69 HydrophobicContact CG-CZ3 3.91Å; R60-F216 WeakPolarHBondContact O-CD1 3.36Å; R60-F216 WeakPolarHBondContact O-CE1 3.29Å; R60-L219 HydrophobicContact CB-CB 3.87Å; R60-L219 HydrophobicContact CB-CD1 4.34Å; R60-L219 WeakPolarHBondContact O-CD1 3.34Å; R60-E223 IonicContact CZ-OE2 3.45Å; R60-E223 IonicContact NE-OE2 3.36Å; R60-E223 PolarHBondContact NE-OE2 2.92Å; R60-E223 IonicContact NH2-OE2 2.73Å; R60-E223 PolarHBondContact NH2-OE2 2.9Å
61	T	95.8	Very high	86.7	Confident	43 Å²	43	47.7 Å²	47.7	26%	0.264	29%	0.293	S	S	.	.			trans	-114.6	-21.5	179.8	48.2	0	0	0	0	113.5	M89 V90 A91 F216	T61-M89 WeakPolarHBondContact CB-O 3.39Å; T61-M89 VanDerWaalsContact CG2-O 3.29Å; T61-M89 WeakPolarHBondContact CG2-O 3.48Å; T61-V90 CarbonylContact O-C 3.58Å; T61-V90 WeakPolarHBondContact O-CA 3.26Å; T61-A91 PolarHBondContact O-N 3.42Å; T61-F216 HydrophobicContact CG2-CE1 4.42Å
62	D	98.4	Very high	88.9	Confident	45 Å²	45	47.1 Å²	47.1	24%	0.241	29%	0.293	C	S	.	.	S	Bend	trans	-83.3	157.6	-179.4	-65.7	-34.1	0	0	0	111.6	W69 L219	D62-W69 HydrophobicContact CB-CB 4.11Å; D62-W69 HydrophobicContact CB-CE3 4.21Å; D62-L219 WeakPolarHBondContact O-CD2 3.47Å
63	S	98.7	Very high	91.1	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	157.7	167.5	70.5	0	0	0	0	110.7	W69 L70 C93 V237	S63-W69 CarbonylContact O-C 3.45Å; S63-W69 VanDerWaalsContact O-CA 3.32Å; S63-W69 WeakPolarHBondContact O-CA 3.35Å; S63-L70 PolarHBondContact N-O 2.85Å; S63-L70 PolarHBondContact O-N 2.96Å; S63-L70 PolarHBondContact OG-O 2.99Å; S63-C93 VanDerWaalsContact CB-SG 3.6Å; S63-V237 WeakPolarHBondContact CB-O 3.16Å
64	F	98.8	Very high	92.9	Very high	10 Å²	10	48 Å²	48	4%	0.044	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	107.9	177.7	-172.2	-104.3	0	0	0	110.1	R68 W69 A222 Y235 N236 V237	F64-R68 WeakPolarHBondContact CA-O 3.49Å; F64-W69 HydrophobicContact CB-CE3 4.09Å; F64-W69 HydrophobicContact CB-CH2 4.2Å; F64-W69 HydrophobicContact CB-CZ3 3.81Å; F64-W69 AromaticContact CD2-CD2 3.84Å; F64-W69 HydrophobicContact CD2-CD2 3.84Å; F64-W69 AromaticContact CD2-CE2 3.74Å; F64-W69 HydrophobicContact CD2-CE3 4.02Å; F64-W69 HydrophobicContact CD2-CG 4.43Å; F64-W69 HydrophobicContact CD2-CH2 4.01Å; F64-W69 AromaticContact CD2-CZ2 3.84Å; F64-W69 HydrophobicContact CD2-CZ2 3.84Å; F64-W69 HydrophobicContact CD2-CZ3 4.11Å; F64-W69 HydrophobicContact CE2-CZ2 4.28Å; F64-W69 HydrophobicContact CG-CH2 4.39Å; F64-W69 HydrophobicContact CG-CZ3 4.38Å; F64-A222 HydrophobicContact CB-CB 3.73Å; F64-A222 HydrophobicContact CD1-CB 3.59Å; F64-A222 HydrophobicContact CD2-CB 4.08Å; F64-A222 HydrophobicContact CE1-CB 4.14Å; F64-A222 HydrophobicContact CG-CB 3.53Å; F64-Y235 HydrophobicContact CD1-CD1 4.44Å; F64-Y235 VanDerWaalsContact CD1-O 3.31Å; F64-Y235 WeakPolarHBondContact CD1-O 3.42Å; F64-Y235 WeakPolarHBondContact CE1-O 3.47Å; F64-N236 CarbonylContact O-C 3.12Å; F64-N236 WeakPolarHBondContact O-CA 3.49Å; F64-V237 HydrophobicContact CB-CB 4.32Å; F64-V237 PolarHBondContact N-O 3.09Å; F64-V237 PolarHBondContact O-N 3.07Å
65	V	98.9	Very high	94.3	Very high	13 Å²	13	50.6 Å²	50.6	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.1	-175.2	179.6	0	0	0	0	110.2	G67 R68 L70 A101 A104 I238	V65-G67 PolarHBondContact O-N 3.08Å; V65-R68 PolarHBondContact N-O 3.28Å; V65-R68 PolarHBondContact O-N 3.43Å; V65-L70 HydrophobicContact CB-CD1 3.89Å; V65-A101 HydrophobicContact CG1-CB 3.98Å; V65-A101 HydrophobicContact CG2-CB 3.94Å; V65-A104 HydrophobicContact CG1-CB 4.09Å; V65-I238 HydrophobicContact CG2-CG2 3.99Å
66	G	98.3	Very high	95.3	Very high	22 Å²	22	49 Å²	49	23%	0.227	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	62	28.3	178	0	0	0	0	0	113.4	R68 S232 N236	G66-R68 VanDerWaalsContact C-N 3.35Å; G66-S232 VanDerWaalsContact O-CB 3.25Å; G66-S232 WeakPolarHBondContact O-CB 3.39Å; G66-S232 PolarHBondContact O-OG 3.01Å; G66-N236 PolarHBondContact N-OD1 2.85Å
67	G	98.1	Very high	96.3	Very high	30 Å²	30	49.5 Å²	49.5	31%	0.309	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	17.8	-175.9	0	0	0	0	0	114.6	V65	V65-G67 PolarHBondContact O-N 3.08Å
68	R	98.6	Very high	96.5	Very high	180 Å²	180	48.3 Å²	48.3	68%	0.679	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.5	-179.9	-61.8	179.6	-176.8	-93.4	-0.9	111	F64 V65 G66 L70	F64-R68 WeakPolarHBondContact CA-O 3.49Å; V65-R68 PolarHBondContact N-O 3.28Å; V65-R68 PolarHBondContact O-N 3.43Å; G66-R68 VanDerWaalsContact C-N 3.35Å; R68-L70 HydrophobicContact CB-CD2 4.18Å; R68-L70 HydrophobicContact CB-CG 4.44Å
69	W	98.7	Very high	96.3	Very high	57 Å²	57	54 Å²	54	22%	0.216	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.6	168.7	-64.1	108.5	0	0	0	109.5	R60 D62 S63 F64 L219 A222 E223	R60-W69 HydrophobicContact CB-CE3 4.28Å; R60-W69 HydrophobicContact CB-CH2 3.84Å; R60-W69 HydrophobicContact CB-CZ2 4.45Å; R60-W69 HydrophobicContact CB-CZ3 3.72Å; R60-W69 HydrophobicContact CG-CE3 4.4Å; R60-W69 HydrophobicContact CG-CH2 3.57Å; R60-W69 HydrophobicContact CG-CZ2 3.73Å; R60-W69 HydrophobicContact CG-CZ3 3.91Å; D62-W69 HydrophobicContact CB-CB 4.11Å; D62-W69 HydrophobicContact CB-CE3 4.21Å; S63-W69 CarbonylContact O-C 3.45Å; S63-W69 VanDerWaalsContact O-CA 3.32Å; S63-W69 WeakPolarHBondContact O-CA 3.35Å; F64-W69 HydrophobicContact CB-CE3 4.09Å; F64-W69 HydrophobicContact CB-CH2 4.2Å; F64-W69 HydrophobicContact CB-CZ3 3.81Å; F64-W69 AromaticContact CD2-CD2 3.84Å; F64-W69 HydrophobicContact CD2-CD2 3.84Å; F64-W69 AromaticContact CD2-CE2 3.74Å; F64-W69 HydrophobicContact CD2-CE3 4.02Å; F64-W69 HydrophobicContact CD2-CG 4.43Å; F64-W69 HydrophobicContact CD2-CH2 4.01Å; F64-W69 AromaticContact CD2-CZ2 3.84Å; F64-W69 HydrophobicContact CD2-CZ2 3.84Å; F64-W69 HydrophobicContact CD2-CZ3 4.11Å; F64-W69 HydrophobicContact CE2-CZ2 4.28Å; F64-W69 HydrophobicContact CG-CH2 4.39Å; F64-W69 HydrophobicContact CG-CZ3 4.38Å; W69-L219 HydrophobicContact CH2-CB 4.19Å; W69-L219 WeakPolarHBondContact CH2-O 3.06Å; W69-L219 HydrophobicContact CZ3-CB 4.13Å; W69-L219 HydrophobicContact CZ3-CD2 4.02Å; W69-A222 HydrophobicContact CH2-CB 3.71Å; W69-A222 HydrophobicContact CZ2-CB 4.28Å; W69-A222 HydrophobicContact CZ3-CB 4.46Å; W69-E223 HydrophobicContact CZ2-CB 4.01Å
70	L	98.4	Very high	95.8	Very high	73 Å²	73	53.9 Å²	53.9	38%	0.382	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.6	-176.9	-57.7	-179.1	0	0	0	110.7	S63 V65 R68	S63-L70 PolarHBondContact N-O 2.85Å; S63-L70 PolarHBondContact O-N 2.96Å; S63-L70 PolarHBondContact OG-O 2.99Å; V65-L70 HydrophobicContact CB-CD1 3.89Å; R68-L70 HydrophobicContact CB-CD2 4.18Å; R68-L70 HydrophobicContact CB-CG 4.44Å
71	P	98.1	Very high	95.1	Very high	94 Å²	94	52.9 Å²	52.9	61%	0.61	31%	0.314	S	S	*	.			trans	-70.8	162.3	169.3	31.8	-35.2	0	0	0	110.5
72	A	97.6	Very high	94.2	Very high	19 Å²	19	51.1 Å²	51.1	16%	0.157	30%	0.304	C	S	.	.			trans	-109.2	169	169.5	0	0	0	0	0	110.6	A74 A91	A72-A74 PolarHBondContact O-N 3.08Å; A72-A91 HydrophobicContact CB-CB 3.93Å
73	A	97.1	Very high	93.2	Very high	108 Å²	108	51 Å²	51	89%	0.893	31%	0.307	S	S	*	.	S	Bend	trans	-64.7	-27.3	178	0	0	0	0	0	113.2
74	A	98	Very high	92.2	Very high	50 Å²	50	53 Å²	53	41%	0.413	33%	0.327	S	S	.	.	S	Bend	trans	-124.1	164.5	176.3	0	0	0	0	0	110.5	A72 D92	A72-A74 PolarHBondContact O-N 3.08Å; A74-D92 HydrophobicContact CB-CB 4.08Å; A74-D92 PolarHBondContact O-N 3.32Å
75	T	98.3	Very high	91.2	Very high	74 Å²	74	54.1 Å²	54.1	45%	0.454	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	157.8	173.8	54.7	0	0	0	0	110.3	M89 V90	T75-M89 WeakPolarHBondContact OG1-CE 3.38Å; T75-V90 CarbonylContact C-O 3.2Å; T75-V90 WeakPolarHBondContact CA-O 3.34Å; T75-V90 VanDerWaalsContact CB-O 3.24Å; T75-V90 WeakPolarHBondContact CB-O 3.29Å
76	F	97.4	Very high	90.6	Very high	13 Å²	13	55.7 Å²	55.7	6%	0.057	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.9	173	66.4	-90.1	0	0	0	111.2	V78 M89 V90 A91 D92 E212 P215 P239	F76-V78 HydrophobicContact CD2-CG2 4.17Å; F76-V78 HydrophobicContact CE2-CG2 3.76Å; F76-M89 WeakPolarHBondContact O-CA 3.35Å; F76-V90 HydrophobicContact CE1-CB 4Å; F76-V90 HydrophobicContact CE1-CG1 3.94Å; F76-V90 HydrophobicContact CE2-CB 4.13Å; F76-V90 HydrophobicContact CZ-CB 3.8Å; F76-V90 HydrophobicContact CZ-CG1 3.79Å; F76-V90 PolarHBondContact N-O 3.47Å; F76-V90 PolarHBondContact O-N 3.29Å; F76-A91 WeakPolarHBondContact CE1-O 3.43Å; F76-D92 HydrophobicContact CD1-CB 3.87Å; F76-E212 HydrophobicContact CE2-CB 4.09Å; F76-E212 VanDerWaalsContact CE2-O 3.29Å; F76-E212 WeakPolarHBondContact CE2-O 3.41Å; F76-E212 HydrophobicContact CZ-CB 4.43Å; F76-P215 HydrophobicContact CE2-CG 4.11Å; F76-P215 HydrophobicContact CZ-CB 4.35Å; F76-P215 HydrophobicContact CZ-CG 4.05Å; F76-P239 HydrophobicContact CE1-CB 4.05Å; F76-P239 HydrophobicContact CZ-CB 4.09Å
77	P	95.2	Very high	89.9	Confident	79 Å²	79	56.2 Å²	56.2	51%	0.513	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	140.8	178.5	31.1	-33.8	0	0	0	110.7	M89	P77-M89 HydrophobicContact CB-SD 3.8Å
78	V	89	Confident	89.4	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.03	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	133.8	166.5	-173.4	0	0	0	0	108.1	F76 L87 G88 V90 P215 F216	F76-V78 HydrophobicContact CD2-CG2 4.17Å; F76-V78 HydrophobicContact CE2-CG2 3.76Å; V78-L87 HydrophobicContact CG1-CD1 4.22Å; V78-L87 WeakPolarHBondContact O-CB 3.4Å; V78-L87 PolarHBondContact O-N 3.42Å; V78-G88 PolarHBondContact N-O 2.61Å; V78-V90 HydrophobicContact CG2-CB 4.37Å; V78-V90 HydrophobicContact CG2-CG2 3.68Å; V78-P215 HydrophobicContact CG2-CG 3.68Å; V78-F216 HydrophobicContact CB-CE2 3.65Å; V78-F216 HydrophobicContact CB-CZ 4.02Å; V78-F216 HydrophobicContact CG1-CD2 4.15Å; V78-F216 HydrophobicContact CG1-CE2 3.6Å; V78-F216 HydrophobicContact CG1-CZ 4.44Å; V78-F216 HydrophobicContact CG2-CE2 4.04Å; V78-F216 HydrophobicContact CG2-CZ 4.12Å
79	Q	84.9	Confident	89.2	Confident	119 Å²	119	49.5 Å²	49.5	56%	0.556	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.7	-176.4	-67	177.2	-9.6	0	0	110.9	P81 A85	Q79-P81 WeakPolarHBondContact O-CD 3.24Å; Q79-A85 CarbonylContact C-O 3.58Å; Q79-A85 VanDerWaalsContact CA-O 3.29Å; Q79-A85 WeakPolarHBondContact CA-O 3.44Å
80	D	80.8	Confident	89.1	Confident	26 Å²	26	46.8 Å²	46.8	14%	0.139	31%	0.31	C	S	.	.			trans	-68.7	119.9	168.6	175.4	-17.4	0	0	0	109.1	A82 S83 G84 A85 L87	D80-A82 PolarHBondContact O-N 2.92Å; D80-A82 WeakPolarHBondContact OD1-CA 3.42Å; D80-A82 VanDerWaalsContact OD1-CB 3.31Å; D80-A82 WeakPolarHBondContact OD1-CB 3.15Å; D80-A82 PolarHBondContact OD1-N 3.23Å; D80-S83 VanDerWaalsContact CB-OG 3.26Å; D80-S83 WeakPolarHBondContact CB-OG 3.41Å; D80-S83 PolarHBondContact OD1-N 2.93Å; D80-S83 WeakPolarHBondContact OD2-CB 3.47Å; D80-S83 PolarHBondContact OD2-OG 3.18Å; D80-G84 VanDerWaalsContact O-CA 3.26Å; D80-G84 WeakPolarHBondContact O-CA 3.48Å; D80-G84 PolarHBondContact O-N 3.46Å; D80-A85 PolarHBondContact N-O 2.77Å; D80-L87 HydrophobicContact CB-CD1 4.49Å; D80-L87 HydrophobicContact CB-CD2 3.95Å; D80-L87 HydrophobicContact CB-CG 4.31Å
81	P	78.6	Confident	89.1	Confident	48 Å²	48	43.4 Å²	43.4	31%	0.312	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.1	-176.9	27.9	-35.2	0	0	0	113.8	Q79 P363 N399	Q79-P81 WeakPolarHBondContact O-CD 3.24Å; P81-P363 HydrophobicContact CB-CG 4.04Å; P81-P363 HydrophobicContact CG-CG 4.11Å; P81-N399 PolarHBondContact O-ND2 3.24Å
82	A	75.7	Confident	89.1	Confident	6 Å²	6	39.8 Å²	39.8	5%	0.05	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-49	178.1	0	0	0	0	0	111.5	D80 N353 P363 K398 F400	D80-A82 PolarHBondContact O-N 2.92Å; D80-A82 WeakPolarHBondContact OD1-CA 3.42Å; D80-A82 VanDerWaalsContact OD1-CB 3.31Å; D80-A82 WeakPolarHBondContact OD1-CB 3.15Å; D80-A82 PolarHBondContact OD1-N 3.23Å; A82-N353 WeakPolarHBondContact CB-ND2 3.41Å; A82-P363 HydrophobicContact CB-CG 3.81Å; A82-K398 WeakPolarHBondContact O-CD 3.1Å; A82-K398 PolarHBondContact O-NZ 2.91Å; A82-F400 HydrophobicContact CB-CE2 4.45Å; A82-F400 HydrophobicContact CB-CZ 3.82Å
83	S	78.1	Confident	89.1	Confident	44 Å²	44	38.9 Å²	38.9	31%	0.308	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-28.1	-173.7	68.9	0	0	0	0	113.3	D80 A85 K398	D80-S83 VanDerWaalsContact CB-OG 3.26Å; D80-S83 WeakPolarHBondContact CB-OG 3.41Å; D80-S83 PolarHBondContact OD1-N 2.93Å; D80-S83 WeakPolarHBondContact OD2-CB 3.47Å; D80-S83 PolarHBondContact OD2-OG 3.18Å; S83-A85 VanDerWaalsContact OG-CB 3.26Å; S83-A85 WeakPolarHBondContact OG-CB 3.3Å; S83-A85 PolarHBondContact OG-N 3.49Å; S83-A85 VanDerWaalsContact OG-N 3.17Å; S83-K398 PolarHBondContact O-NZ 3.23Å
84	G	76.9	Confident	89.2	Confident	43 Å²	43	34.4 Å²	34.4	44%	0.443	23%	0.225	S	C	.	.			trans	78.8	3.4	-167.5	0	0	0	0	0	113.4	D80	D80-G84 VanDerWaalsContact O-CA 3.26Å; D80-G84 WeakPolarHBondContact O-CA 3.48Å; D80-G84 PolarHBondContact O-N 3.46Å
85	A	78.9	Confident	89.3	Confident	33 Å²	33	33.8 Å²	33.8	27%	0.273	22%	0.215	S	C	.	.			trans	-68.8	141.7	-179.7	0	0	0	0	0	111.2	A48 Q79 D80 S83 L87	A48-A85 HydrophobicContact CB-CB 4.21Å; Q79-A85 CarbonylContact C-O 3.58Å; Q79-A85 VanDerWaalsContact CA-O 3.29Å; Q79-A85 WeakPolarHBondContact CA-O 3.44Å; D80-A85 PolarHBondContact N-O 2.77Å; S83-A85 VanDerWaalsContact OG-CB 3.26Å; S83-A85 WeakPolarHBondContact OG-CB 3.3Å; S83-A85 PolarHBondContact OG-N 3.49Å; S83-A85 VanDerWaalsContact OG-N 3.17Å; A85-L87 PolarHBondContact O-N 2.99Å
86	A	85	Confident	89.3	Confident	47 Å²	47	39.6 Å²	39.6	39%	0.388	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.6	173.5	0	0	0	0	0	110.6	Y47	Y47-A86 HydrophobicContact CD1-CB 4.26Å
87	L	83.4	Confident	89.3	Confident	33 Å²	33	41.1 Å²	41.1	17%	0.173	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-37.3	177	-59.6	-175.7	0	0	0	111.9	Y47 L51 V78 D80 A85 F216	Y47-L87 WeakPolarHBondContact CB-O 3.35Å; L51-L87 HydrophobicContact CD1-CB 4.43Å; L51-L87 HydrophobicContact CD1-CD2 3.68Å; L51-L87 HydrophobicContact CG-CD2 4.42Å; V78-L87 HydrophobicContact CG1-CD1 4.22Å; V78-L87 WeakPolarHBondContact O-CB 3.4Å; V78-L87 PolarHBondContact O-N 3.42Å; D80-L87 HydrophobicContact CB-CD1 4.49Å; D80-L87 HydrophobicContact CB-CD2 3.95Å; D80-L87 HydrophobicContact CB-CG 4.31Å; A85-L87 PolarHBondContact O-N 2.99Å; L87-F216 HydrophobicContact CB-CE2 3.74Å; L87-F216 HydrophobicContact CB-CZ 4.33Å; L87-F216 HydrophobicContact CD1-CE2 4.33Å
88	G	87.6	Confident	89.5	Confident	2 Å²	2	37.3 Å²	37.3	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.9	171.2	177.6	0	0	0	0	0	113.2	V78	V78-G88 PolarHBondContact N-O 2.61Å
89	M	94.9	Very high	90	Very high	67 Å²	67	43.3 Å²	43.3	33%	0.33	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	111.7	174.2	-65.8	-61.3	-62.3	0	0	108.8	T61 T75 F76 P77	T61-M89 WeakPolarHBondContact CB-O 3.39Å; T61-M89 VanDerWaalsContact CG2-O 3.29Å; T61-M89 WeakPolarHBondContact CG2-O 3.48Å; T75-M89 WeakPolarHBondContact OG1-CE 3.38Å; F76-M89 WeakPolarHBondContact O-CA 3.35Å; P77-M89 HydrophobicContact CB-SD 3.8Å
90	V	96.4	Very high	90.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	144	-175.9	179.2	0	0	0	0	110.1	T61 T75 F76 V78 D92 P215 F216 L219 P239	T61-V90 CarbonylContact O-C 3.58Å; T61-V90 WeakPolarHBondContact O-CA 3.26Å; T75-V90 CarbonylContact C-O 3.2Å; T75-V90 WeakPolarHBondContact CA-O 3.34Å; T75-V90 VanDerWaalsContact CB-O 3.24Å; T75-V90 WeakPolarHBondContact CB-O 3.29Å; F76-V90 HydrophobicContact CE1-CB 4Å; F76-V90 HydrophobicContact CE1-CG1 3.94Å; F76-V90 HydrophobicContact CE2-CB 4.13Å; F76-V90 HydrophobicContact CZ-CB 3.8Å; F76-V90 HydrophobicContact CZ-CG1 3.79Å; F76-V90 PolarHBondContact N-O 3.47Å; F76-V90 PolarHBondContact O-N 3.29Å; V78-V90 HydrophobicContact CG2-CB 4.37Å; V78-V90 HydrophobicContact CG2-CG2 3.68Å; V90-D92 PolarHBondContact O-N 3.21Å; V90-P215 HydrophobicContact CB-CG 4.3Å; V90-P215 HydrophobicContact CG1-CB 4.16Å; V90-P215 HydrophobicContact CG1-CG 4.11Å; V90-P215 HydrophobicContact CG2-CG 3.85Å; V90-F216 HydrophobicContact CG2-CD1 4.23Å; V90-F216 HydrophobicContact CG2-CE1 3.44Å; V90-F216 VanDerWaalsContact CG2-CE1 3.44Å; V90-F216 HydrophobicContact CG2-CZ 3.65Å; V90-L219 HydrophobicContact CG1-CD1 4.28Å; V90-P239 HydrophobicContact CG1-CB 3.56Å; V90-P239 HydrophobicContact CG1-CG 3.82Å
91	A	98.4	Very high	91.5	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	128.2	175.4	0	0	0	0	0	111.2	T61 A72 F76 P239	T61-A91 PolarHBondContact O-N 3.42Å; A72-A91 HydrophobicContact CB-CB 3.93Å; F76-A91 WeakPolarHBondContact CE1-O 3.43Å; A91-P239 CarbonylContact O-C 3.53Å
92	D	98.6	Very high	92.5	Very high	18 Å²	18	35.9 Å²	35.9	10%	0.096	20%	0.201	C	C	.	.			trans	-100.2	84.5	176.6	-163	-1.5	0	0	0	109.6	A74 F76 V90 C240 S241 N244	A74-D92 HydrophobicContact CB-CB 4.08Å; A74-D92 PolarHBondContact O-N 3.32Å; F76-D92 HydrophobicContact CD1-CB 3.87Å; V90-D92 PolarHBondContact O-N 3.21Å; D92-C240 VanDerWaalsContact OD1-CA 3.27Å; D92-C240 WeakPolarHBondContact OD1-CA 3.14Å; D92-C240 WeakPolarHBondContact OD1-CB 3.41Å; D92-S241 PolarHBondContact OD1-N 3.1Å; D92-S241 PolarHBondContact OD1-OG 3.11Å; D92-S241 VanDerWaalsContact OD2-CB 3.24Å; D92-S241 WeakPolarHBondContact OD2-CB 3.49Å; D92-S241 PolarHBondContact OD2-OG 2.91Å; D92-N244 PolarHBondContact OD1-ND2 3.26Å; D92-N244 PolarHBondContact OD2-ND2 2.73Å
93	C	98.8	Very high	93.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.			trans	-63.4	140.8	-179.3	-67.1	0	0	0	0	111.4	S63 E97 I238 P239 C240 N244 V248	S63-C93 VanDerWaalsContact CB-SG 3.6Å; C93-E97 HydrophobicContact CB-CB 3.85Å; C93-E97 HydrophobicContact CB-CG 4.39Å; C93-I238 HydrophobicContact CB-CB 4.17Å; C93-P239 VanDerWaalsContact CB-O 3.24Å; C93-P239 WeakPolarHBondContact CB-O 3.2Å; C93-P239 PolarHBondContact N-O 3.36Å; C93-P239 PolarHBondContact SG-O 2.9Å; C93-C240 HydrophobicContact CB-CB 4.48Å; C93-C240 WeakPolarHBondContact O-CB 3.44Å; C93-N244 PolarHBondContact O-ND2 3.31Å; C93-V248 VanDerWaalsContact O-CG2 3.29Å; C93-V248 WeakPolarHBondContact O-CG2 3.45Å
94	G	98.8	Very high	94.6	Very high	15 Å²	15	40.1 Å²	40.1	16%	0.155	21%	0.213	C	C	.	.			trans	-107.3	-167.4	169.9	0	0	0	0	0	112.2	R96 E97 A98	G94-R96 PolarHBondContact O-N 3.14Å; G94-E97 WeakPolarHBondContact CA-OE2 3.2Å; G94-E97 PolarHBondContact N-OE2 2.88Å; G94-E97 PolarHBondContact O-N 3.42Å; G94-A98 WeakPolarHBondContact O-CB 3.4Å; G94-A98 PolarHBondContact O-N 2.92Å
95	V	98.8	Very high	95.6	Very high	36 Å²	36	38.1 Å²	38.1	22%	0.218	19%	0.192	C	C	.	.	H	α-helix	trans	-57.4	-32.9	178.9	176.7	0	0	0	0	112.8	R99 E247 A251	V95-R99 HydrophobicContact CG1-CG 4.46Å; V95-R99 WeakPolarHBondContact O-CG 3.4Å; V95-R99 PolarHBondContact O-N 2.94Å; V95-E247 HydrophobicContact CG2-CB 3.77Å; V95-A251 HydrophobicContact CB-CB 4.49Å; V95-A251 HydrophobicContact CG1-CB 3.96Å; V95-A251 HydrophobicContact CG2-CB 4.39Å
96	R	98.7	Very high	96.6	Very high	196 Å²	196	41.2 Å²	41.2	74%	0.74	20%	0.197	S	C	*	.	H	α-helix	trans	-66.5	-50.5	-178.1	-173.7	-170.2	-57.1	169.9	4.2	111.2	G94 A98 R99 A100	G94-R96 PolarHBondContact O-N 3.14Å; R96-A98 VanDerWaalsContact C-N 3.32Å; R96-R99 PolarHBondContact O-N 3.3Å; R96-A100 PolarHBondContact O-N 3.12Å
97	E	98.8	Very high	97.2	Very high	45 Å²	45	44.2 Å²	44.2	21%	0.21	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-40.7	177.7	-66.2	72.4	-158	0	0	110.3	C93 G94 R99 A100 A101	C93-E97 HydrophobicContact CB-CB 3.85Å; C93-E97 HydrophobicContact CB-CG 4.39Å; G94-E97 WeakPolarHBondContact CA-OE2 3.2Å; G94-E97 PolarHBondContact N-OE2 2.88Å; G94-E97 PolarHBondContact O-N 3.42Å; E97-R99 PolarHBondContact O-N 3.1Å; E97-A100 WeakPolarHBondContact O-CB 3.24Å; E97-A100 PolarHBondContact O-N 3.46Å; E97-A101 PolarHBondContact O-N 3.25Å
98	A	98.8	Very high	97.9	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-50.9	175.9	0	0	0	0	0	112.5	G94 R96 A100 A101 V102 I238 V248 A251 I252	G94-A98 WeakPolarHBondContact O-CB 3.4Å; G94-A98 PolarHBondContact O-N 2.92Å; R96-A98 VanDerWaalsContact C-N 3.32Å; A98-A100 VanDerWaalsContact C-N 3.3Å; A98-A100 PolarHBondContact O-N 2.71Å; A98-A101 PolarHBondContact O-N 3.46Å; A98-V102 WeakPolarHBondContact O-CG2 3.35Å; A98-V102 PolarHBondContact O-N 3.13Å; A98-I238 HydrophobicContact CB-CD1 3.95Å; A98-V248 HydrophobicContact CB-CG1 4.18Å; A98-A251 HydrophobicContact CB-CB 4.26Å; A98-I252 HydrophobicContact CB-CG2 3.85Å
99	R	98.8	Very high	98.5	Very high	130 Å²	130	43.6 Å²	43.6	49%	0.491	20%	0.2	S	C	.	.	H	α-helix	trans	-64.2	-34	176.8	-70.2	176.7	-179.8	147.8	2.6	112.5	V95 R96 E97 V102 R103	V95-R99 HydrophobicContact CG1-CG 4.46Å; V95-R99 WeakPolarHBondContact O-CG 3.4Å; V95-R99 PolarHBondContact O-N 2.94Å; R96-R99 PolarHBondContact O-N 3.3Å; E97-R99 PolarHBondContact O-N 3.1Å; R99-V102 PolarHBondContact O-N 2.91Å; R99-R103 PolarHBondContact O-N 2.79Å; R99-R103 VanDerWaalsContact O-N 3.1Å; R99-R103 PolarHBondContact O-NH1 3.05Å
100	A	98.8	Very high	98.6	Very high	38 Å²	38	43.4 Å²	43.4	31%	0.314	20%	0.204	S	C	.	.	H	α-helix	trans	-65.8	-41.8	174.7	0	0	0	0	0	111.8	R96 E97 A98 R103 A104	R96-A100 PolarHBondContact O-N 3.12Å; E97-A100 WeakPolarHBondContact O-CB 3.24Å; E97-A100 PolarHBondContact O-N 3.46Å; A98-A100 VanDerWaalsContact C-N 3.3Å; A98-A100 PolarHBondContact O-N 2.71Å; A100-R103 PolarHBondContact O-N 3.34Å; A100-A104 PolarHBondContact O-N 3.33Å
101	A	98.9	Very high	98.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-40.5	175.1	0	0	0	0	0	112.4	V65 E97 A98 A104 A105 V207 N236 I238	V65-A101 HydrophobicContact CG1-CB 3.98Å; V65-A101 HydrophobicContact CG2-CB 3.94Å; E97-A101 PolarHBondContact O-N 3.25Å; A98-A101 PolarHBondContact O-N 3.46Å; A101-A104 PolarHBondContact O-N 3.19Å; A101-A105 WeakPolarHBondContact O-CB 3.22Å; A101-A105 PolarHBondContact O-N 3.3Å; A101-V207 HydrophobicContact CB-CG1 3.89Å; A101-V207 HydrophobicContact CB-CG2 4.28Å; A101-N236 HydrophobicContact CB-CB 4.42Å; A101-I238 HydrophobicContact CB-CG2 3.76Å
102	V	98.9	Very high	98.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-45	174.8	171.4	0	0	0	0	111.6	A98 R99 A105 Y106 V207 I252 D255 L257 V258	A98-V102 WeakPolarHBondContact O-CG2 3.35Å; A98-V102 PolarHBondContact O-N 3.13Å; R99-V102 PolarHBondContact O-N 2.91Å; V102-A105 PolarHBondContact O-N 3.31Å; V102-Y106 WeakPolarHBondContact O-CB 3.35Å; V102-Y106 PolarHBondContact O-N 3.04Å; V102-V207 HydrophobicContact CG2-CG2 4.18Å; V102-I252 HydrophobicContact CG2-CB 4.43Å; V102-I252 HydrophobicContact CG2-CG2 4.02Å; V102-D255 HydrophobicContact CG1-CB 4.18Å; V102-L257 HydrophobicContact CG1-CB 3.72Å; V102-L257 HydrophobicContact CG1-CD1 4.44Å; V102-V258 HydrophobicContact CB-CG2 4.44Å; V102-V258 HydrophobicContact CG1-CG2 3.71Å; V102-V258 HydrophobicContact CG2-CG2 3.81Å
103	R	98.9	Very high	98.7	Very high	119 Å²	119	55 Å²	55	45%	0.449	25%	0.247	S	C	.	.	H	α-helix	trans	-61.4	-45.6	176	-73.8	-172.4	-62.5	-82.3	1.4	112.3	R99 A100 A105 Y106 E107 L257	R99-R103 PolarHBondContact O-N 2.79Å; R99-R103 VanDerWaalsContact O-N 3.1Å; R99-R103 PolarHBondContact O-NH1 3.05Å; A100-R103 PolarHBondContact O-N 3.34Å; R103-A105 VanDerWaalsContact C-N 3.29Å; R103-A105 PolarHBondContact O-N 3.07Å; R103-Y106 PolarHBondContact O-N 3.41Å; R103-E107 WeakPolarHBondContact O-CG 3.27Å; R103-E107 PolarHBondContact O-N 3.43Å; R103-L257 HydrophobicContact CG-CD1 4.09Å
104	A	98.8	Very high	98.7	Very high	20 Å²	20	61.8 Å²	61.8	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-41.2	176.2	0	0	0	0	0	111.8	V65 A100 A101 A108	V65-A104 HydrophobicContact CG1-CB 4.09Å; A100-A104 PolarHBondContact O-N 3.33Å; A101-A104 PolarHBondContact O-N 3.19Å; A104-A108 VanDerWaalsContact O-CB 3.28Å; A104-A108 WeakPolarHBondContact O-CB 3.48Å; A104-A108 PolarHBondContact O-N 2.92Å
105	A	98.9	Very high	98.6	Very high	0 Å²	0	63 Å²	63	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-41.2	175.8	0	0	0	0	0	112.7	A101 V102 R103 A108 F109 V178 T205 V207 G233	A101-A105 WeakPolarHBondContact O-CB 3.22Å; A101-A105 PolarHBondContact O-N 3.3Å; V102-A105 PolarHBondContact O-N 3.31Å; R103-A105 VanDerWaalsContact C-N 3.29Å; R103-A105 PolarHBondContact O-N 3.07Å; A105-A108 PolarHBondContact O-N 3.35Å; A105-F109 WeakPolarHBondContact O-CB 3.4Å; A105-F109 PolarHBondContact O-N 2.95Å; A105-V178 HydrophobicContact CB-CG1 3.68Å; A105-V178 HydrophobicContact CB-CG2 4.2Å; A105-T205 PolarHBondContact O-OG1 3.36Å; A105-V207 HydrophobicContact CB-CG2 3.7Å; A105-G233 VanDerWaalsContact CA-O 3.31Å; A105-G233 WeakPolarHBondContact CA-O 3.18Å
106	Y	98.9	Very high	98.5	Very high	98 Å²	98	64.7 Å²	64.7	38%	0.384	30%	0.296	S	S	.	.	H	α-helix	trans	-67	-45	178.9	-174.4	-98.8	0	0	0	112.3	V102 R103 A108 F109 C110 V178 L257	V102-Y106 WeakPolarHBondContact O-CB 3.35Å; V102-Y106 PolarHBondContact O-N 3.04Å; R103-Y106 PolarHBondContact O-N 3.41Å; Y106-A108 VanDerWaalsContact C-N 3.29Å; Y106-A108 PolarHBondContact O-N 2.91Å; Y106-F109 WeakPolarHBondContact O-CB 3.45Å; Y106-F109 PolarHBondContact O-N 3.14Å; Y106-C110 PolarHBondContact O-N 3.25Å; Y106-C110 PolarHBondContact O-SG 3.38Å; Y106-V178 VanDerWaalsContact CA-CG2 3.47Å; Y106-V178 HydrophobicContact CD2-CG2 4.04Å; Y106-V178 HydrophobicContact CG-CG2 4.48Å; Y106-L257 HydrophobicContact CD1-CD1 4.3Å; Y106-L257 HydrophobicContact CD1-CD2 4.05Å; Y106-L257 HydrophobicContact CD2-CB 3.94Å; Y106-L257 HydrophobicContact CD2-CD2 3.94Å; Y106-L257 HydrophobicContact CD2-CG 4.4Å; Y106-L257 HydrophobicContact CE1-CD2 4.04Å; Y106-L257 HydrophobicContact CE2-CD2 3.93Å; Y106-L257 HydrophobicContact CG-CB 4.13Å; Y106-L257 HydrophobicContact CG-CD1 4.13Å; Y106-L257 HydrophobicContact CG-CD2 4Å; Y106-L257 HydrophobicContact CG-CG 4.32Å
107	E	98.8	Very high	98.2	Very high	111 Å²	111	56.9 Å²	56.9	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-34.9	175.6	-71.1	175.4	-158.4	0	0	112.7	R103 R111	R103-E107 WeakPolarHBondContact O-CG 3.27Å; R103-E107 PolarHBondContact O-N 3.43Å; E107-R111 PolarHBondContact O-NE 2.94Å
108	A	98.8	Very high	97.9	Very high	7 Å²	7	61.3 Å²	61.3	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-38.7	173.4	0	0	0	0	0	111.5	A104 A105 Y106 C110 R111 W112 T205 S232 V234	A104-A108 VanDerWaalsContact O-CB 3.28Å; A104-A108 WeakPolarHBondContact O-CB 3.48Å; A104-A108 PolarHBondContact O-N 2.92Å; A105-A108 PolarHBondContact O-N 3.35Å; Y106-A108 VanDerWaalsContact C-N 3.29Å; Y106-A108 PolarHBondContact O-N 2.91Å; A108-C110 VanDerWaalsContact C-N 3.33Å; A108-C110 PolarHBondContact O-N 2.86Å; A108-R111 PolarHBondContact O-N 2.62Å; A108-W112 VanDerWaalsContact O-CB 3.3Å; A108-W112 WeakPolarHBondContact O-CB 3.27Å; A108-W112 PolarHBondContact O-N 3.27Å; A108-T205 HydrophobicContact CB-CG2 4.14Å; A108-S232 WeakPolarHBondContact CB-O 3.42Å; A108-V234 HydrophobicContact CB-CG2 4.25Å
109	F	98.8	Very high	97.7	Very high	14 Å²	14	65.3 Å²	65.3	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-56.8	-45.4	178.7	166.4	-114	0	0	0	112.1	A105 Y106 R111 W112 R113 P175 V178 T205	A105-F109 WeakPolarHBondContact O-CB 3.4Å; A105-F109 PolarHBondContact O-N 2.95Å; Y106-F109 WeakPolarHBondContact O-CB 3.45Å; Y106-F109 PolarHBondContact O-N 3.14Å; F109-R111 PolarHBondContact O-N 3.07Å; F109-W112 PolarHBondContact O-N 3.01Å; F109-R113 HydrophobicContact CD2-CB 4.3Å; F109-R113 HydrophobicContact CE2-CB 3.89Å; F109-R113 HydrophobicContact CZ-CB 4.4Å; F109-R113 WeakPolarHBondContact O-CB 3.1Å; F109-R113 VanDerWaalsContact O-CG 3.27Å; F109-R113 WeakPolarHBondContact O-CG 2.9Å; F109-R113 PolarHBondContact O-N 3.17Å; F109-P175 HydrophobicContact CE2-CB 4.11Å; F109-P175 HydrophobicContact CE2-CG 3.98Å; F109-V178 HydrophobicContact CB-CG2 4.36Å; F109-T205 HydrophobicContact CB-CG2 3.93Å
110	C	98.3	Very high	97.6	Very high	63 Å²	63	60.2 Å²	60.2	43%	0.426	29%	0.292	S	S	.	.	H	α-helix	trans	-56.4	-26.3	178	-65.7	0	0	0	0	113.5	Y106 A108	Y106-C110 PolarHBondContact O-N 3.25Å; Y106-C110 PolarHBondContact O-SG 3.38Å; A108-C110 VanDerWaalsContact C-N 3.33Å; A108-C110 PolarHBondContact O-N 2.86Å
111	R	98.4	Very high	97.1	Very high	171 Å²	171	59.1 Å²	59.1	65%	0.645	28%	0.282	S	S	*	.	H	α-helix	trans	-95.3	-41.6	176	-70.2	176.5	-98.5	-165.7	-7.2	112	E107 A108 F109 R113 E114 V115	E107-R111 PolarHBondContact O-NE 2.94Å; A108-R111 PolarHBondContact O-N 2.62Å; F109-R111 PolarHBondContact O-N 3.07Å; R111-R113 PolarHBondContact O-N 3.07Å; R111-E114 PolarHBondContact O-N 2.64Å; R111-V115 PolarHBondContact O-N 3.45Å
112	W	98.5	Very high	96.9	Very high	3 Å²	3	61.2 Å²	61.2	1%	0.011	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-36.9	-175.7	-177.7	-119.8	0	0	0	113	A108 F109 E114 V115 R120 L123 L200 G203 C204 T205 P231 V234	A108-W112 VanDerWaalsContact O-CB 3.3Å; A108-W112 WeakPolarHBondContact O-CB 3.27Å; A108-W112 PolarHBondContact O-N 3.27Å; F109-W112 PolarHBondContact O-N 3.01Å; W112-E114 PolarHBondContact O-N 3.16Å; W112-V115 HydrophobicContact CE3-CB 4.04Å; W112-V115 HydrophobicContact CE3-CG1 4.37Å; W112-V115 HydrophobicContact CE3-CG2 3.83Å; W112-V115 HydrophobicContact CZ3-CB 4.26Å; W112-V115 HydrophobicContact CZ3-CG1 4.08Å; W112-V115 HydrophobicContact CZ3-CG2 4.26Å; W112-V115 WeakPolarHBondContact O-CB 3.42Å; W112-V115 PolarHBondContact O-N 3.05Å; W112-V115 VanDerWaalsContact O-N 3.1Å; W112-R120 HydrophobicContact CD2-CG 4.42Å; W112-R120 VanDerWaalsContact CE2-CD 3.43Å; W112-R120 HydrophobicContact CE3-CG 4.45Å; W112-R120 HydrophobicContact CH2-CB 3.86Å; W112-R120 HydrophobicContact CH2-CG 3.56Å; W112-R120 HydrophobicContact CZ2-CB 3.76Å; W112-R120 VanDerWaalsContact CZ2-CD 3.46Å; W112-R120 HydrophobicContact CZ2-CG 3.48Å; W112-R120 VanDerWaalsContact CZ2-CG 3.48Å; W112-R120 HydrophobicContact CZ3-CG 4.05Å; W112-L123 HydrophobicContact CH2-CD1 3.72Å; W112-L123 HydrophobicContact CZ3-CD1 3.65Å; W112-L200 HydrophobicContact CZ2-CB 4.35Å; W112-L200 HydrophobicContact CZ2-CG 4.33Å; W112-L200 PolarHBondContact NE1-O 3.05Å; W112-G203 VanDerWaalsContact CD1-C 3.49Å; W112-G203 VanDerWaalsContact CD1-O 3.31Å; W112-C204 PolarHBondContact NE1-O 3.29Å; W112-T205 HydrophobicContact CB-CG2 4.11Å; W112-T205 HydrophobicContact CG-CG2 4.31Å; W112-P231 HydrophobicContact CE3-CG 4.02Å; W112-P231 HydrophobicContact CZ3-CG 3.95Å; W112-V234 HydrophobicContact CB-CG2 4.02Å; W112-V234 HydrophobicContact CD2-CG1 4.13Å; W112-V234 HydrophobicContact CD2-CG2 3.94Å; W112-V234 HydrophobicContact CE3-CG2 4.07Å; W112-V234 HydrophobicContact CG-CG1 4.31Å; W112-V234 HydrophobicContact CG-CG2 3.92Å; W112-V234 HydrophobicContact CZ2-CG1 4.39Å
113	R	97.7	Very high	96.8	Very high	90 Å²	90	61.8 Å²	61.8	34%	0.34	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.9	175.8	68.9	-179	-72.3	162.1	6.4	113.5	F109 R111 P175	F109-R113 HydrophobicContact CD2-CB 4.3Å; F109-R113 HydrophobicContact CE2-CB 3.89Å; F109-R113 HydrophobicContact CZ-CB 4.4Å; F109-R113 WeakPolarHBondContact O-CB 3.1Å; F109-R113 VanDerWaalsContact O-CG 3.27Å; F109-R113 WeakPolarHBondContact O-CG 2.9Å; F109-R113 PolarHBondContact O-N 3.17Å; R111-R113 PolarHBondContact O-N 3.07Å; R113-P175 HydrophobicContact CB-CG 4.14Å
114	E	97.9	Very high	96.5	Very high	142 Å²	142	56.4 Å²	56.4	66%	0.664	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-16.7	179.2	-58.2	-56.3	129	0	0	112.4	R111 W112 S116	R111-E114 PolarHBondContact O-N 2.64Å; W112-E114 PolarHBondContact O-N 3.16Å; E114-S116 PolarHBondContact O-N 2.87Å
115	V	97.1	Very high	96.2	Very high	39 Å²	39	60.4 Å²	60.4	24%	0.236	29%	0.29	C	S	.	.	S	Bend	trans	-65.7	126.4	173.8	178.1	0	0	0	0	108.5	R111 W112 E119 R120	R111-V115 PolarHBondContact O-N 3.45Å; W112-V115 HydrophobicContact CE3-CB 4.04Å; W112-V115 HydrophobicContact CE3-CG1 4.37Å; W112-V115 HydrophobicContact CE3-CG2 3.83Å; W112-V115 HydrophobicContact CZ3-CB 4.26Å; W112-V115 HydrophobicContact CZ3-CG1 4.08Å; W112-V115 HydrophobicContact CZ3-CG2 4.26Å; W112-V115 WeakPolarHBondContact O-CB 3.42Å; W112-V115 PolarHBondContact O-N 3.05Å; W112-V115 VanDerWaalsContact O-N 3.1Å; V115-E119 HydrophobicContact CG1-CB 3.71Å; V115-E119 HydrophobicContact CG1-CG 3.69Å; V115-R120 HydrophobicContact CB-CG 4.11Å; V115-R120 HydrophobicContact CG1-CG 3.82Å; V115-R120 PolarHBondContact O-NH1 3.26Å
116	S	96.9	Very high	96.1	Very high	72 Å²	72	65.2 Å²	65.2	50%	0.503	31%	0.311	S	S	.	.			trans	-55.5	146.6	-176.9	78.8	0	0	0	0	112.3	E114 K118 E119 R120	E114-S116 PolarHBondContact O-N 2.87Å; S116-K118 PolarHBondContact O-N 3.14Å; S116-K118 VanDerWaalsContact O-N 3.14Å; S116-E119 PolarHBondContact O-N 2.78Å; S116-E119 PolarHBondContact OG-N 2.94Å; S116-R120 WeakPolarHBondContact O-CG 3.27Å; S116-R120 PolarHBondContact O-N 3.17Å
117	A	93.6	Very high	96	Very high	33 Å²	33	61.2 Å²	61.2	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-55.3	-34.3	178.6	0	0	0	0	0	113.3	S121 A152	A117-S121 VanDerWaalsContact O-CB 3.28Å; A117-S121 WeakPolarHBondContact O-CB 3.08Å; A117-S121 PolarHBondContact O-N 2.92Å; A117-A152 WeakPolarHBondContact CB-O 3.37Å
118	K	91	Very high	95.8	Very high	137 Å²	137	59.4 Å²	59.4	60%	0.596	28%	0.284	S	S	*	.	H	α-helix	trans	-65.7	-41	175.5	178.2	177.9	168.1	64.6	0	111.9	S116 S121 S122	S116-K118 PolarHBondContact O-N 3.14Å; S116-K118 VanDerWaalsContact O-N 3.14Å; K118-S121 WeakPolarHBondContact O-CB 3.5Å; K118-S121 PolarHBondContact O-N 3.2Å; K118-S122 WeakPolarHBondContact O-CB 3.47Å; K118-S122 PolarHBondContact O-N 3.39Å
119	E	94.8	Very high	95.5	Very high	84 Å²	84	62.1 Å²	62.1	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-70.6	-42.3	178.2	-176.6	56.8	-155.6	0	0	111.3	V115 S116 S121 S122 L123	V115-E119 HydrophobicContact CG1-CB 3.71Å; V115-E119 HydrophobicContact CG1-CG 3.69Å; S116-E119 PolarHBondContact O-N 2.78Å; S116-E119 PolarHBondContact OG-N 2.94Å; E119-S121 VanDerWaalsContact C-N 3.3Å; E119-S121 PolarHBondContact O-N 3.29Å; E119-S122 WeakPolarHBondContact O-CB 3.43Å; E119-S122 PolarHBondContact O-N 2.8Å; E119-S122 VanDerWaalsContact O-N 3.13Å; E119-L123 HydrophobicContact CG-CD1 4.33Å; E119-L123 WeakPolarHBondContact O-CG 3.5Å; E119-L123 PolarHBondContact O-N 2.96Å
120	R	97.2	Very high	95.3	Very high	23 Å²	23	62.7 Å²	62.7	9%	0.087	30%	0.302	C	S	.	.	H	α-helix	trans	-57.8	-44	173.1	-58	-162.7	-57.1	-98.7	5.9	111.9	W112 V115 S116 S122 L123 L124 A201	W112-R120 HydrophobicContact CD2-CG 4.42Å; W112-R120 VanDerWaalsContact CE2-CD 3.43Å; W112-R120 HydrophobicContact CE3-CG 4.45Å; W112-R120 HydrophobicContact CH2-CB 3.86Å; W112-R120 HydrophobicContact CH2-CG 3.56Å; W112-R120 HydrophobicContact CZ2-CB 3.76Å; W112-R120 VanDerWaalsContact CZ2-CD 3.46Å; W112-R120 HydrophobicContact CZ2-CG 3.48Å; W112-R120 VanDerWaalsContact CZ2-CG 3.48Å; W112-R120 HydrophobicContact CZ3-CG 4.05Å; V115-R120 HydrophobicContact CB-CG 4.11Å; V115-R120 HydrophobicContact CG1-CG 3.82Å; V115-R120 PolarHBondContact O-NH1 3.26Å; S116-R120 WeakPolarHBondContact O-CG 3.27Å; S116-R120 PolarHBondContact O-N 3.17Å; R120-S122 PolarHBondContact O-N 2.86Å; R120-L123 PolarHBondContact O-N 2.95Å; R120-L124 WeakPolarHBondContact O-CG 3.41Å; R120-L124 PolarHBondContact O-N 3.15Å; R120-A201 PolarHBondContact NE-O 3.28Å; R120-A201 PolarHBondContact NH2-O 3.35Å; R120-A201 VanDerWaalsContact NH2-O 3.08Å
121	S	87.9	Confident	95	Very high	15 Å²	15	60.1 Å²	60.1	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-46	174	178.2	0	0	0	0	112.4	A117 K118 E119 L124 R125 S149	A117-S121 VanDerWaalsContact O-CB 3.28Å; A117-S121 WeakPolarHBondContact O-CB 3.08Å; A117-S121 PolarHBondContact O-N 2.92Å; K118-S121 WeakPolarHBondContact O-CB 3.5Å; K118-S121 PolarHBondContact O-N 3.2Å; E119-S121 VanDerWaalsContact C-N 3.3Å; E119-S121 PolarHBondContact O-N 3.29Å; S121-L124 PolarHBondContact O-N 3.12Å; S121-R125 PolarHBondContact O-N 3.41Å; S121-S149 WeakPolarHBondContact CB-O 3.44Å; S121-S149 PolarHBondContact O-OG 2.72Å; S121-S149 PolarHBondContact OG-O 3.48Å
122	S	94.3	Very high	94.7	Very high	45 Å²	45	55.5 Å²	55.5	32%	0.315	27%	0.271	S	S	.	.	H	α-helix	trans	-59.3	-47.7	177	-178.9	0	0	0	0	112	K118 E119 R120 R125 K126	K118-S122 WeakPolarHBondContact O-CB 3.47Å; K118-S122 PolarHBondContact O-N 3.39Å; E119-S122 WeakPolarHBondContact O-CB 3.43Å; E119-S122 PolarHBondContact O-N 2.8Å; E119-S122 VanDerWaalsContact O-N 3.13Å; R120-S122 PolarHBondContact O-N 2.86Å; S122-R125 PolarHBondContact O-N 3.13Å; S122-K126 WeakPolarHBondContact O-CG 3.41Å; S122-K126 PolarHBondContact O-N 3.16Å
123	L	96.5	Very high	94.4	Very high	11 Å²	11	62 Å²	62	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-44	178.1	-68.7	168.7	0	0	0	112.1	W112 E119 R120 R125 K126 W127 A228 I230	W112-L123 HydrophobicContact CH2-CD1 3.72Å; W112-L123 HydrophobicContact CZ3-CD1 3.65Å; E119-L123 HydrophobicContact CG-CD1 4.33Å; E119-L123 WeakPolarHBondContact O-CG 3.5Å; E119-L123 PolarHBondContact O-N 2.96Å; R120-L123 PolarHBondContact O-N 2.95Å; L123-R125 VanDerWaalsContact C-N 3.28Å; L123-R125 PolarHBondContact O-N 3.22Å; L123-K126 PolarHBondContact O-N 3.12Å; L123-W127 PolarHBondContact O-N 2.91Å; L123-A228 WeakPolarHBondContact CD2-O 2.95Å; L123-I230 HydrophobicContact CB-CD1 3.92Å
124	L	94.2	Very high	94.1	Very high	7 Å²	7	59.3 Å²	59.3	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-37.6	174	-74.9	170.6	0	0	0	112	R120 S121 W127 Y128 L200 A201	R120-L124 WeakPolarHBondContact O-CG 3.41Å; R120-L124 PolarHBondContact O-N 3.15Å; S121-L124 PolarHBondContact O-N 3.12Å; L124-W127 HydrophobicContact CD2-CE3 4.2Å; L124-W127 PolarHBondContact O-N 3.01Å; L124-Y128 PolarHBondContact O-N 3.39Å; L124-L200 HydrophobicContact CD1-CB 4.39Å; L124-L200 HydrophobicContact CD2-CB 3.98Å; L124-L200 HydrophobicContact CD2-CD2 4.05Å; L124-A201 HydrophobicContact CD1-CB 4.03Å
125	R	91.8	Very high	93.7	Very high	103 Å²	103	57.5 Å²	57.5	39%	0.389	28%	0.284	S	S	.	.	H	α-helix	trans	-69.6	-39.3	176	-176.4	156.3	-74.6	-95.8	5.5	112.5	S121 S122 L123 W127 Y128 N129 E150	S121-R125 PolarHBondContact O-N 3.41Å; S122-R125 PolarHBondContact O-N 3.13Å; L123-R125 VanDerWaalsContact C-N 3.28Å; L123-R125 PolarHBondContact O-N 3.22Å; R125-W127 VanDerWaalsContact C-N 3.31Å; R125-Y128 WeakPolarHBondContact O-CB 3.32Å; R125-Y128 PolarHBondContact O-N 2.94Å; R125-N129 PolarHBondContact O-N 2.69Å; R125-N129 PolarHBondContact O-ND2 3.05Å; R125-E150 IonicContact NH2-OE1 2.84Å; R125-E150 PolarHBondContact NH2-OE1 3.03Å
126	K	96.3	Very high	93.2	Very high	102 Å²	102	60.1 Å²	60.1	44%	0.443	30%	0.297	S	S	.	.	H	α-helix	trans	-60.2	-43.9	172.6	-72.5	176.8	-177.1	175.3	0	111	S122 L123 N129 L130 A228	S122-K126 WeakPolarHBondContact O-CG 3.41Å; S122-K126 PolarHBondContact O-N 3.16Å; L123-K126 PolarHBondContact O-N 3.12Å; K126-N129 PolarHBondContact O-N 2.81Å; K126-L130 PolarHBondContact O-N 2.84Å; K126-A228 HydrophobicContact CB-CB 4.17Å
127	W	97.5	Very high	92.7	Very high	14 Å²	14	58.3 Å²	58.3	5%	0.053	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-45.3	177.3	-167	11.7	0	0	0	111.9	L123 L124 R125 N129 L130 M131 V196 L200 L221 A225 A228 I230 Y235	L123-W127 PolarHBondContact O-N 2.91Å; L124-W127 HydrophobicContact CD2-CE3 4.2Å; L124-W127 PolarHBondContact O-N 3.01Å; R125-W127 VanDerWaalsContact C-N 3.31Å; W127-N129 PolarHBondContact O-N 2.95Å; W127-L130 PolarHBondContact O-N 2.86Å; W127-M131 WeakPolarHBondContact O-CG 3.43Å; W127-M131 PolarHBondContact O-N 3.06Å; W127-V196 HydrophobicContact CH2-CG1 3.95Å; W127-V196 HydrophobicContact CZ3-CG1 4.01Å; W127-L200 HydrophobicContact CE3-CD2 4.5Å; W127-L200 HydrophobicContact CZ3-CD2 3.91Å; W127-L221 HydrophobicContact CZ2-CB 4.07Å; W127-L221 HydrophobicContact CZ2-CD2 4.39Å; W127-L221 VanDerWaalsContact CZ2-O 3.28Å; W127-L221 WeakPolarHBondContact CZ2-O 3.38Å; W127-L221 PolarHBondContact NE1-O 3.34Å; W127-L221 VanDerWaalsContact NE1-O 3.15Å; W127-A225 HydrophobicContact CD2-CB 4.2Å; W127-A225 HydrophobicContact CH2-CB 4.16Å; W127-A225 HydrophobicContact CZ2-CB 3.67Å; W127-A228 HydrophobicContact CB-CB 3.69Å; W127-A228 HydrophobicContact CG-CB 4.24Å; W127-I230 HydrophobicContact CE3-CD1 4.33Å; W127-I230 HydrophobicContact CE3-CG1 4.27Å; W127-Y235 HydrophobicContact CH2-CD1 4.4Å; W127-Y235 AromaticContact CH2-CD2 3.91Å; W127-Y235 HydrophobicContact CH2-CD2 3.91Å; W127-Y235 HydrophobicContact CH2-CE2 4.07Å; W127-Y235 HydrophobicContact CH2-CG 4.08Å; W127-Y235 HydrophobicContact CZ2-CE1 4.45Å
128	Y	93.5	Very high	92.4	Very high	72 Å²	72	57 Å²	57	28%	0.282	27%	0.27	S	S	.	.	H	α-helix	trans	-55.8	-49.8	171.1	162.5	-109	0	0	0	112.9	L124 R125 L130 M131 I132 S146	L124-Y128 PolarHBondContact O-N 3.39Å; R125-Y128 WeakPolarHBondContact O-CB 3.32Å; R125-Y128 PolarHBondContact O-N 2.94Å; Y128-L130 PolarHBondContact O-N 3.49Å; Y128-M131 WeakPolarHBondContact O-CA 3.33Å; Y128-M131 WeakPolarHBondContact O-CB 3.3Å; Y128-M131 PolarHBondContact O-N 3.49Å; Y128-I132 HydrophobicContact CD2-CD1 4.35Å; Y128-I132 HydrophobicContact CD2-CG1 3.89Å; Y128-I132 HydrophobicContact CE1-CG1 4.15Å; Y128-I132 HydrophobicContact CE2-CD1 3.62Å; Y128-I132 HydrophobicContact CE2-CG1 3.38Å; Y128-I132 PolarHBondContact O-N 2.9Å; Y128-S146 VanDerWaalsContact CD2-CB 3.4Å
129	N	93.1	Very high	92	Very high	65 Å²	65	52.6 Å²	52.6	35%	0.348	26%	0.259	S	S	.	.	H	α-helix	trans	-58.9	-39.4	-179.1	-70.4	-17.6	0	0	0	111.4	R125 K126 W127 I132 Q133	R125-N129 PolarHBondContact O-N 2.69Å; R125-N129 PolarHBondContact O-ND2 3.05Å; K126-N129 PolarHBondContact O-N 2.81Å; W127-N129 PolarHBondContact O-N 2.95Å; N129-I132 PolarHBondContact O-N 2.95Å; N129-Q133 WeakPolarHBondContact O-CB 3.44Å; N129-Q133 VanDerWaalsContact O-CG 3.22Å; N129-Q133 WeakPolarHBondContact O-CG 3.34Å; N129-Q133 PolarHBondContact O-N 3.38Å
130	L	94.8	Very high	91.2	Very high	25 Å²	25	55 Å²	55	13%	0.131	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-37.8	174.9	-76.6	165.9	0	0	0	112.3	K126 W127 Y128 I132 Q133 N134 L224 Q227 A228	K126-L130 PolarHBondContact O-N 2.84Å; W127-L130 PolarHBondContact O-N 2.86Å; Y128-L130 PolarHBondContact O-N 3.49Å; L130-I132 VanDerWaalsContact C-N 3.34Å; L130-Q133 PolarHBondContact O-N 2.87Å; L130-N134 WeakPolarHBondContact O-CB 3.32Å; L130-N134 PolarHBondContact O-N 3.13Å; L130-N134 PolarHBondContact O-ND2 3.23Å; L130-L224 HydrophobicContact CB-CB 4.48Å; L130-L224 HydrophobicContact CB-CD2 4.21Å; L130-Q227 HydrophobicContact CD1-CB 3.71Å; L130-A228 HydrophobicContact CD1-CB 3.88Å
131	M	92.8	Very high	89.7	Confident	10 Å²	10	54.7 Å²	54.7	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-42.3	172.7	-66.4	169	61.7	0	0	111.6	W127 Y128 N134 K135 L138 A144 T193 L221 L224	W127-M131 WeakPolarHBondContact O-CG 3.43Å; W127-M131 PolarHBondContact O-N 3.06Å; Y128-M131 WeakPolarHBondContact O-CA 3.33Å; Y128-M131 WeakPolarHBondContact O-CB 3.3Å; Y128-M131 PolarHBondContact O-N 3.49Å; M131-N134 CarbonylContact O-C 3.52Å; M131-N134 PolarHBondContact O-N 3.01Å; M131-K135 WeakPolarHBondContact O-CA 3.31Å; M131-K135 PolarHBondContact O-N 2.82Å; M131-L138 HydrophobicContact CB-CD1 3.92Å; M131-L138 HydrophobicContact CG-CD1 4.14Å; M131-A144 HydrophobicContact CE-CB 3.39Å; M131-T193 HydrophobicContact CE-CG2 3.9Å; M131-L221 HydrophobicContact CE-CD2 3.89Å; M131-L221 HydrophobicContact CG-CD2 4.23Å; M131-L221 HydrophobicContact SD-CD2 3.85Å; M131-L224 HydrophobicContact CB-CD1 4.47Å; M131-L224 HydrophobicContact CG-CD1 3.9Å
132	I	90.7	Very high	88.4	Confident	73 Å²	73	57.3 Å²	57.3	37%	0.374	28%	0.276	S	S	.	.	H	α-helix	trans	-65.5	-42.7	176.7	-64.4	-56.9	0	0	0	111.7	Y128 N129 L130 N134 K135	Y128-I132 HydrophobicContact CD2-CD1 4.35Å; Y128-I132 HydrophobicContact CD2-CG1 3.89Å; Y128-I132 HydrophobicContact CE1-CG1 4.15Å; Y128-I132 HydrophobicContact CE2-CD1 3.62Å; Y128-I132 HydrophobicContact CE2-CG1 3.38Å; Y128-I132 PolarHBondContact O-N 2.9Å; N129-I132 PolarHBondContact O-N 2.95Å; L130-I132 VanDerWaalsContact C-N 3.34Å; I132-N134 PolarHBondContact O-N 2.86Å; I132-K135 WeakPolarHBondContact O-CB 3.32Å; I132-K135 VanDerWaalsContact O-CG 3.31Å; I132-K135 WeakPolarHBondContact O-CG 3.15Å; I132-K135 PolarHBondContact O-N 2.86Å
133	Q	92.4	Very high	85.5	Confident	139 Å²	139	59.7 Å²	59.7	65%	0.65	29%	0.289	S	S	*	.	H	α-helix	trans	-61.6	-33	176.9	-73.3	166.2	22.6	0	0	112.4	N129 L130	N129-Q133 WeakPolarHBondContact O-CB 3.44Å; N129-Q133 VanDerWaalsContact O-CG 3.22Å; N129-Q133 WeakPolarHBondContact O-CG 3.34Å; N129-Q133 PolarHBondContact O-N 3.38Å; L130-Q133 PolarHBondContact O-N 2.87Å
134	N	91.1	Very high	82.6	Confident	35 Å²	35	60.4 Å²	60.4	19%	0.187	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	16.5	-179.7	-65.4	-86.7	0	0	0	112.5	L58 L130 M131 I132 D136 D137 L138	L58-N134 HydrophobicContact CD1-CB 4Å; L130-N134 WeakPolarHBondContact O-CB 3.32Å; L130-N134 PolarHBondContact O-N 3.13Å; L130-N134 PolarHBondContact O-ND2 3.23Å; M131-N134 CarbonylContact O-C 3.52Å; M131-N134 PolarHBondContact O-N 3.01Å; I132-N134 PolarHBondContact O-N 2.86Å; N134-D136 PolarHBondContact O-N 2.84Å; N134-D136 VanDerWaalsContact O-N 3.09Å; N134-D137 PolarHBondContact O-N 2.83Å; N134-L138 HydrophobicContact CB-CD1 4.49Å; N134-L138 HydrophobicContact CB-CG 4.22Å; N134-L138 WeakPolarHBondContact O-CB 3.45Å; N134-L138 WeakPolarHBondContact O-CG 3.25Å; N134-L138 PolarHBondContact O-N 3.31Å
135	K	90.1	Very high	79.6	Confident	103 Å²	103	64.6 Å²	64.6	45%	0.448	32%	0.315	S	S	.	.	H	α-helix	trans	-58	-31	-169.1	68.5	175.2	177.3	50.7	0	114.1	M131 I132 A139	M131-K135 WeakPolarHBondContact O-CA 3.31Å; M131-K135 PolarHBondContact O-N 2.82Å; I132-K135 WeakPolarHBondContact O-CB 3.32Å; I132-K135 VanDerWaalsContact O-CG 3.31Å; I132-K135 WeakPolarHBondContact O-CG 3.15Å; I132-K135 PolarHBondContact O-N 2.86Å; K135-A139 WeakPolarHBondContact O-CB 3.4Å; K135-A139 PolarHBondContact O-N 3.5Å
136	D	87.3	Confident	77.1	Confident	95 Å²	95	62 Å²	62	51%	0.508	31%	0.314	S	S	.	.	H	α-helix	trans	-78.6	-41.6	-176.4	-61.2	-51.1	0	0	0	110.8	N134 A139 R140	N134-D136 PolarHBondContact O-N 2.84Å; N134-D136 VanDerWaalsContact O-N 3.09Å; D136-A139 PolarHBondContact O-N 3Å; D136-R140 VanDerWaalsContact O-CG 3.29Å; D136-R140 WeakPolarHBondContact O-CG 3.35Å; D136-R140 PolarHBondContact O-N 2.91Å
137	D	85.8	Confident	74.5	Confident	34 Å²	34	60.7 Å²	60.7	18%	0.182	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-41	170.9	-80.9	-4.5	0	0	0	111.3	L54 S55 L58 N134 A139 R140 I141	L54-D137 HydrophobicContact CD2-CB 3.79Å; S55-D137 WeakPolarHBondContact CB-OD2 3.33Å; S55-D137 PolarHBondContact N-OD2 3.3Å; L58-D137 HydrophobicContact CD1-CB 3.79Å; N134-D137 PolarHBondContact O-N 2.83Å; D137-A139 VanDerWaalsContact C-N 3.34Å; D137-R140 WeakPolarHBondContact O-CB 3.46Å; D137-R140 PolarHBondContact O-N 3.16Å; D137-I141 WeakPolarHBondContact O-CG1 3.32Å; D137-I141 PolarHBondContact O-N 2.84Å; D137-I141 VanDerWaalsContact O-N 3.09Å
138	L	86.5	Confident	73.1	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-39.3	172	-72.4	-177.2	0	0	0	110.9	M131 N134 R140 I141 I142 A220 L224	M131-L138 HydrophobicContact CB-CD1 3.92Å; M131-L138 HydrophobicContact CG-CD1 4.14Å; N134-L138 HydrophobicContact CB-CD1 4.49Å; N134-L138 HydrophobicContact CB-CG 4.22Å; N134-L138 WeakPolarHBondContact O-CB 3.45Å; N134-L138 WeakPolarHBondContact O-CG 3.25Å; N134-L138 PolarHBondContact O-N 3.31Å; L138-R140 VanDerWaalsContact C-N 3.33Å; L138-R140 PolarHBondContact O-N 3.28Å; L138-I141 CarbonylContact O-C 3.5Å; L138-I141 VanDerWaalsContact O-CA 3.29Å; L138-I141 WeakPolarHBondContact O-CA 3.26Å; L138-I141 PolarHBondContact O-N 3.39Å; L138-I142 CarbonylContact O-C 3.53Å; L138-I142 WeakPolarHBondContact O-CA 3.25Å; L138-I142 PolarHBondContact O-N 2.9Å; L138-A220 HydrophobicContact CD2-CB 3.77Å; L138-L224 HydrophobicContact CD1-CD1 3.81Å; L138-L224 HydrophobicContact CD2-CD1 4.22Å; L138-L224 HydrophobicContact CG-CD1 4.37Å
139	A	83	Confident	71.6	Confident	44 Å²	44	57.2 Å²	57.2	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-67.1	-35.4	177.6	0	0	0	0	0	112	K135 D136 D137 I141 I142 T143	K135-A139 WeakPolarHBondContact O-CB 3.4Å; K135-A139 PolarHBondContact O-N 3.5Å; D136-A139 PolarHBondContact O-N 3Å; D137-A139 VanDerWaalsContact C-N 3.34Å; A139-I141 PolarHBondContact O-N 3.36Å; A139-I142 WeakPolarHBondContact O-CA 3.37Å; A139-I142 PolarHBondContact O-N 2.89Å; A139-T143 WeakPolarHBondContact CB-OG1 3.41Å
140	R	78.6	Confident	70.1	Confident	135 Å²	135	57.9 Å²	57.9	51%	0.509	29%	0.294	S	S	.	.	H	α-helix	trans	-63.8	-22.5	168.8	-70.1	170	178.4	-172.1	-1.8	112.7	L54 D136 D137 L138 F355	L54-R140 HydrophobicContact CD2-CB 3.79Å; D136-R140 VanDerWaalsContact O-CG 3.29Å; D136-R140 WeakPolarHBondContact O-CG 3.35Å; D136-R140 PolarHBondContact O-N 2.91Å; D137-R140 WeakPolarHBondContact O-CB 3.46Å; D137-R140 PolarHBondContact O-N 3.16Å; L138-R140 VanDerWaalsContact C-N 3.33Å; L138-R140 PolarHBondContact O-N 3.28Å; R140-F355 HydrophobicContact CB-CE1 4.37Å; R140-F355 HydrophobicContact CG-CE1 4.22Å
141	I	66	Low	69.5	Low	15 Å²	15	57.7 Å²	57.7	8%	0.077	29%	0.293	C	S	.	.	H	α-helix	trans	-100.6	-9.8	170.3	-59.7	170.7	0	0	0	112.6	L54 L58 D137 L138 A139 F216 S217 A220	L54-I141 HydrophobicContact CD1-CD1 4.1Å; L54-I141 HydrophobicContact CD1-CG1 3.86Å; L54-I141 HydrophobicContact CD2-CD1 4.49Å; L54-I141 HydrophobicContact CD2-CG1 4.4Å; L58-I141 HydrophobicContact CB-CD1 4.09Å; D137-I141 WeakPolarHBondContact O-CG1 3.32Å; D137-I141 PolarHBondContact O-N 2.84Å; D137-I141 VanDerWaalsContact O-N 3.09Å; L138-I141 CarbonylContact O-C 3.5Å; L138-I141 VanDerWaalsContact O-CA 3.29Å; L138-I141 WeakPolarHBondContact O-CA 3.26Å; L138-I141 PolarHBondContact O-N 3.39Å; A139-I141 PolarHBondContact O-N 3.36Å; I141-F216 HydrophobicContact CG2-CB 3.92Å; I141-S217 PolarHBondContact O-OG 3.46Å; I141-A220 HydrophobicContact CD1-CB 4.38Å
142	I	60.5	Low	68.2	Low	71 Å²	71	57.3 Å²	57.3	36%	0.364	29%	0.291	S	S	.	.			trans	99.1	131.8	-170.4	-51.6	155.4	0	0	0	119.6	L138 A139 P188 S189	L138-I142 CarbonylContact O-C 3.53Å; L138-I142 WeakPolarHBondContact O-CA 3.25Å; L138-I142 PolarHBondContact O-N 2.9Å; A139-I142 WeakPolarHBondContact O-CA 3.37Å; A139-I142 PolarHBondContact O-N 2.89Å; I142-P188 HydrophobicContact CB-CG 3.85Å; I142-P188 HydrophobicContact CD1-CG 3.37Å; I142-P188 HydrophobicContact CG1-CG 4.21Å; I142-P188 HydrophobicContact CG2-CG 3.89Å; I142-S189 WeakPolarHBondContact O-CB 3.48Å
143	T	33.3	Very low	67.7	Low	94 Å²	94	61 Å²	61	58%	0.577	30%	0.3	S	S	*	.			trans	-71.4	149.6	-168.1	-50.6	0	0	0	0	118.3	A139	A139-T143 WeakPolarHBondContact CB-OG1 3.41Å
144	A	34.6	Very low	67.5	Low	26 Å²	26	59.6 Å²	59.6	22%	0.215	29%	0.289	C	S	.	.			trans	-152	165.8	174.5	0	0	0	0	0	117.3	M131 S189 T193	M131-A144 HydrophobicContact CE-CB 3.39Å; A144-S189 WeakPolarHBondContact CB-OG 3.08Å; A144-T193 HydrophobicContact CB-CG2 4.27Å
145	E	33	Very low	67.5	Low	95 Å²	95	60.1 Å²	60.1	44%	0.444	29%	0.293	S	S	.	.			trans	-128.3	159.5	-178.1	60.3	-169.2	166.9	0	0	112.3	V481	E145-V481 HydrophobicContact CB-CG1 4.39Å; E145-V481 HydrophobicContact CG-CG1 3.59Å; E145-V481 WeakPolarHBondContact OE1-CG1 3.47Å; E145-V481 WeakPolarHBondContact OE2-CG1 3.35Å
146	S	38.1	Very low	67.4	Low	50 Å²	50	62.7 Å²	62.7	35%	0.35	30%	0.301	S	S	.	.			trans	-141.5	120.3	-177.8	173.5	0	0	0	0	115	Y128	Y128-S146 VanDerWaalsContact CD2-CB 3.4Å
147	W	42.6	Very low	67.7	Low	74 Å²	74	60.1 Å²	60.1	28%	0.28	30%	0.298	S	S	.	.			trans	-114.5	-39.9	-178.6	169.7	-106.9	0	0	0	115	S149 E150 V481 E482 S498	W147-S149 VanDerWaalsContact C-N 3.27Å; W147-S149 PolarHBondContact O-N 2.85Å; W147-E150 PolarHBondContact O-N 2.91Å; W147-V481 HydrophobicContact CB-CB 3.66Å; W147-V481 HydrophobicContact CB-CG1 4.45Å; W147-V481 HydrophobicContact CB-CG2 3.68Å; W147-V481 HydrophobicContact CD2-CG2 4.03Å; W147-V481 HydrophobicContact CE3-CG2 3.9Å; W147-V481 HydrophobicContact CG-CB 4.05Å; W147-V481 HydrophobicContact CG-CG2 3.97Å; W147-E482 HydrophobicContact CD2-CB 4.44Å; W147-E482 HydrophobicContact CE3-CB 4.43Å; W147-E482 HydrophobicContact CH2-CB 3.69Å; W147-E482 HydrophobicContact CZ2-CB 3.67Å; W147-E482 HydrophobicContact CZ3-CB 4.07Å; W147-S498 PolarHBondContact NE1-O 2.96Å
148	F	67.1	Low	68.1	Low	9 Å²	9	62.6 Å²	62.6	4%	0.039	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.2	-166.4	-74.7	-73.4	0	0	0	117.2	E150 E151 A152 R194 G197 A198 A201	F148-E150 PolarHBondContact O-N 2.85Å; F148-E151 HydrophobicContact CD1-CB 4.26Å; F148-E151 HydrophobicContact CD1-CG 4.49Å; F148-E151 PolarHBondContact O-N 3.08Å; F148-A152 PolarHBondContact O-N 3.05Å; F148-R194 VanDerWaalsContact CE2-O 3.22Å; F148-R194 WeakPolarHBondContact CE2-O 3.36Å; F148-G197 VanDerWaalsContact CB-C 3.44Å; F148-G197 WeakPolarHBondContact CB-O 3.33Å; F148-A198 HydrophobicContact CD1-CB 3.94Å; F148-A198 HydrophobicContact CD2-CB 4.11Å; F148-A198 HydrophobicContact CE1-CB 3.77Å; F148-A198 HydrophobicContact CE2-CB 3.94Å; F148-A198 HydrophobicContact CG-CB 4.11Å; F148-A198 HydrophobicContact CZ-CB 3.76Å; F148-A201 HydrophobicContact CB-CB 4.22Å; F148-A201 WeakPolarHBondContact O-CB 3.21Å
149	S	63.1	Low	68.6	Low	4 Å²	4	68.8 Å²	68.8	3%	0.028	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-36.3	172.5	169.4	0	0	0	0	111.5	S121 W147	S121-S149 WeakPolarHBondContact CB-O 3.44Å; S121-S149 PolarHBondContact O-OG 2.72Å; S121-S149 PolarHBondContact OG-O 3.48Å; W147-S149 VanDerWaalsContact C-N 3.27Å; W147-S149 PolarHBondContact O-N 2.85Å
150	E	60.5	Low	69.2	Low	78 Å²	78	70.9 Å²	70.9	36%	0.364	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-38.2	-177.2	-59.6	-164.1	-175.3	0	0	112.5	R125 W147 F148 A152 R153 R154	R125-E150 IonicContact NH2-OE1 2.84Å; R125-E150 PolarHBondContact NH2-OE1 3.03Å; W147-E150 PolarHBondContact O-N 2.91Å; F148-E150 PolarHBondContact O-N 2.85Å; E150-A152 VanDerWaalsContact C-N 3.26Å; E150-A152 PolarHBondContact O-N 3.33Å; E150-R153 PolarHBondContact O-N 2.81Å; E150-R154 PolarHBondContact O-NH1 3.27Å
151	E	82.4	Confident	70.1	Confident	22 Å²	22	74.2 Å²	74.2	10%	0.103	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-68.9	-21.6	-179.6	-69.6	-57.3	94.5	0	0	113.6	F148 R153 R154 I502	F148-E151 HydrophobicContact CD1-CB 4.26Å; F148-E151 HydrophobicContact CD1-CG 4.49Å; F148-E151 PolarHBondContact O-N 3.08Å; E151-R153 PolarHBondContact O-N 3.39Å; E151-R154 PolarHBondContact O-N 3.35Å; E151-R154 IonicContact OE1-NH1 2.72Å; E151-I502 HydrophobicContact CB-CD1 4.25Å
152	A	66.3	Low	71.5	Confident	2 Å²	2	74.9 Å²	74.9	2%	0.017	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-52.3	-32	176.3	0	0	0	0	0	113.4	A117 F148 E150 A201	A117-A152 WeakPolarHBondContact CB-O 3.37Å; F148-A152 PolarHBondContact O-N 3.05Å; E150-A152 VanDerWaalsContact C-N 3.26Å; E150-A152 PolarHBondContact O-N 3.33Å; A152-A201 HydrophobicContact CB-CB 3.81Å
153	R	80.1	Confident	73.2	Confident	150 Å²	150	77.3 Å²	77.3	57%	0.566	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-93.4	-1	-178.4	-63.4	176.2	64.5	-167.1	-4	114	E150 E151	E150-R153 PolarHBondContact O-N 2.81Å; E151-R153 PolarHBondContact O-N 3.39Å
154	R	87	Confident	76.2	Confident	110 Å²	110	74.7 Å²	74.7	42%	0.415	37%	0.373	S	S	.	.			trans	-115.5	21.1	-172.8	-60.6	-168.7	178.2	90.5	-4	113.5	E150 E151 Y156	E150-R154 PolarHBondContact O-NH1 3.27Å; E151-R154 PolarHBondContact O-N 3.35Å; E151-R154 IonicContact OE1-NH1 2.72Å; R154-Y156 HydrophobicContact CB-CE2 3.95Å; R154-Y156 HydrophobicContact CG-CE2 4.49Å; R154-Y156 VanDerWaalsContact O-CD2 3.27Å; R154-Y156 WeakPolarHBondContact O-CD2 3.38Å; R154-Y156 PolarHBondContact O-N 2.66Å
155	V	91.3	Very high	79.2	Confident	46 Å²	46	82.1 Å²	82.1	28%	0.279	40%	0.401	S	S	.	.			trans	-77.9	87.5	171.2	-179.3	0	0	0	0	109.1	K173 I502 L506	V155-K173 HydrophobicContact CG1-CB 3.44Å; V155-K173 VanDerWaalsContact CG1-CB 3.44Å; V155-K173 HydrophobicContact CG1-CD 3.91Å; V155-K173 HydrophobicContact CG1-CG 4.29Å; V155-I502 HydrophobicContact CG2-CD1 3.52Å; V155-I502 HydrophobicContact CG2-CG1 4.31Å; V155-L506 HydrophobicContact CG1-CD1 3.66Å; V155-L506 HydrophobicContact CG1-CD2 4.09Å; V155-L506 HydrophobicContact CG2-CD1 4.06Å
156	Y	88.8	Confident	82.2	Confident	156 Å²	156	80.8 Å²	80.8	61%	0.612	40%	0.397	S	S	*	.			trans	-87.1	140.5	179.7	-53.3	-58.2	0	0	0	111.8	R154 K173	R154-Y156 HydrophobicContact CB-CE2 3.95Å; R154-Y156 HydrophobicContact CG-CE2 4.49Å; R154-Y156 VanDerWaalsContact O-CD2 3.27Å; R154-Y156 WeakPolarHBondContact O-CD2 3.38Å; R154-Y156 PolarHBondContact O-N 2.66Å; Y156-K173 VanDerWaalsContact O-CD 3.28Å; Y156-K173 WeakPolarHBondContact O-CD 3.26Å; Y156-K173 WeakPolarHBondContact O-CE 3.38Å
157	G	93.8	Very high	84.9	Confident	42 Å²	42	82.7 Å²	82.7	43%	0.433	40%	0.397	S	S	.	.			trans	-94	-177.2	164.2	0	0	0	0	0	111.6	V171	G157-V171 CarbonylContact C-O 3.56Å; G157-V171 WeakPolarHBondContact CA-O 3.17Å
158	D	94.5	Very high	87.4	Confident	85 Å²	85	85.3 Å²	85.3	46%	0.455	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.7	-175.6	-50.6	-80.8	0	0	0	111.8	I160 L170 V171	D158-I160 HydrophobicContact CB-CG1 4.28Å; D158-L170 CarbonylContact O-C 3.02Å; D158-L170 WeakPolarHBondContact O-CA 3.23Å; D158-V171 HydrophobicContact CB-CB 3.98Å; D158-V171 HydrophobicContact CB-CG2 4.25Å; D158-V171 PolarHBondContact N-O 3.04Å; D158-V171 PolarHBondContact O-N 3.38Å
159	I	96.7	Very high	88.8	Confident	137 Å²	137	85.1 Å²	85.1	70%	0.703	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.8	165.2	-56.3	-176.6	0	0	0	107	A169 L170	I159-A169 WeakPolarHBondContact CA-O 3.21Å; I159-L170 HydrophobicContact CB-CD2 4.47Å; I159-L170 HydrophobicContact CD1-CD2 4.22Å; I159-L170 HydrophobicContact CG1-CD2 3.81Å; I159-L170 HydrophobicContact CG2-CD2 4.25Å
160	I	96.2	Very high	90.5	Very high	88 Å²	88	87.2 Å²	87.2	45%	0.451	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.1	-172.3	-54.9	172.9	0	0	0	108.9	D158 A169 V171	D158-I160 HydrophobicContact CB-CG1 4.28Å; I160-A169 HydrophobicContact CB-CB 4.05Å; I160-A169 PolarHBondContact N-O 2.95Å; I160-V171 HydrophobicContact CD1-CG2 3.76Å
161	Y	95.7	Very high	92.3	Very high	205 Å²	205	84.4 Å²	84.4	80%	0.804	41%	0.405	S	S	*	.			trans	-70.8	132.7	173.1	-174.1	-103.7	0	0	0	110.2
162	T	96.1	Very high	93	Very high	28 Å²	28	87 Å²	87	17%	0.172	42%	0.419	C	S	.	.			trans	-119.3	148.2	176.7	57.6	0	0	0	0	110.8	A164 A169	T162-A164 VanDerWaalsContact C-N 3.27Å; T162-A164 PolarHBondContact O-N 3.13Å; T162-A164 PolarHBondContact OG1-O 3.09Å; T162-A169 HydrophobicContact CG2-CB 3.66Å
163	P	96.8	Very high	94.6	Very high	123 Å²	123	90 Å²	90	80%	0.799	43%	0.432	S	S	*	.	S	Bend	trans	-57.9	-37.2	177.4	-26.5	34.8	0	0	0	114.2	K165	P163-K165 PolarHBondContact O-N 2.94Å
164	A	95.9	Very high	95.5	Very high	38 Å²	38	85.6 Å²	85.6	31%	0.314	42%	0.418	S	S	.	.			trans	-70	126.7	179.2	0	0	0	0	0	110.7	T162 D166 R167	T162-A164 VanDerWaalsContact C-N 3.27Å; T162-A164 PolarHBondContact O-N 3.13Å; T162-A164 PolarHBondContact OG1-O 3.09Å; A164-D166 WeakPolarHBondContact CB-OD1 3.24Å; A164-R167 HydrophobicContact CB-CG 4.01Å
165	K	96.8	Very high	96	Very high	183 Å²	183	81.5 Å²	81.5	80%	0.796	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-21.2	-172.7	-62.1	-178.4	-179.3	179	0	113.7	P163 R167 R168	P163-K165 PolarHBondContact O-N 2.94Å; K165-R167 VanDerWaalsContact C-N 3.27Å; K165-R167 PolarHBondContact O-N 2.83Å; K165-R168 PolarHBondContact O-NH1 3.33Å
166	D	96.1	Very high	96.4	Very high	67 Å²	67	80.4 Å²	80.4	36%	0.358	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	5	-175.1	69.9	-29.9	0	0	0	114.1	A164 G514 G515 L516	A164-D166 WeakPolarHBondContact CB-OD1 3.24Å; D166-G514 WeakPolarHBondContact O-CA 3.35Å; D166-G515 PolarHBondContact O-N 2.89Å; D166-L516 PolarHBondContact O-N 2.91Å
167	R	95.5	Very high	96.8	Very high	90 Å²	90	73.1 Å²	73.1	34%	0.34	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	164.9	-174.4	68.7	-165.3	67.7	-160.7	-4.1	114	A164 K165 Y513	A164-R167 HydrophobicContact CB-CG 4.01Å; K165-R167 VanDerWaalsContact C-N 3.27Å; K165-R167 PolarHBondContact O-N 2.83Å; R167-Y513 CarbonylContact C-O 3.59Å; R167-Y513 WeakPolarHBondContact CA-O 2.82Å; R167-Y513 WeakPolarHBondContact CB-O 3.28Å
168	R	94.6	Very high	97.1	Very high	129 Å²	129	71.1 Å²	71.1	49%	0.487	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.6	167.9	-61.8	-64.7	178.4	-84.6	-4.4	109.7	K165 Y513 L516	K165-R168 PolarHBondContact O-NH1 3.33Å; R168-Y513 PolarHBondContact N-O 3.1Å; R168-Y513 PolarHBondContact O-N 3.13Å; R168-L516 HydrophobicContact CB-CD1 4.44Å; R168-L516 HydrophobicContact CG-CD1 3.6Å
169	A	97.7	Very high	97.3	Very high	4 Å²	4	67 Å²	67	3%	0.033	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.5	173	0	0	0	0	0	110	I159 I160 T162 Y510	I159-A169 WeakPolarHBondContact CA-O 3.21Å; I160-A169 HydrophobicContact CB-CB 4.05Å; I160-A169 PolarHBondContact N-O 2.95Å; T162-A169 HydrophobicContact CG2-CB 3.66Å; A169-Y510 HydrophobicContact CB-CD2 4.43Å; A169-Y510 HydrophobicContact CB-CE2 3.62Å
170	L	98.3	Very high	97.4	Very high	48 Å²	48	60.5 Å²	60.5	25%	0.251	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.3	172.9	-47.3	171.3	0	0	0	108.8	D158 I159 Y510 V511	D158-L170 CarbonylContact O-C 3.02Å; D158-L170 WeakPolarHBondContact O-CA 3.23Å; I159-L170 HydrophobicContact CB-CD2 4.47Å; I159-L170 HydrophobicContact CD1-CD2 4.22Å; I159-L170 HydrophobicContact CG1-CD2 3.81Å; I159-L170 HydrophobicContact CG2-CD2 4.25Å; L170-Y510 CarbonylContact O-C 3.59Å; L170-Y510 WeakPolarHBondContact O-CA 3.48Å; L170-V511 HydrophobicContact CB-CB 4.23Å; L170-V511 PolarHBondContact N-O 2.82Å; L170-V511 PolarHBondContact O-N 2.87Å
171	V	98.3	Very high	97.5	Very high	20 Å²	20	56.3 Å²	56.3	12%	0.121	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.8	169.3	-176.6	0	0	0	0	108.3	G157 D158 I160 L508 K509	G157-V171 CarbonylContact C-O 3.56Å; G157-V171 WeakPolarHBondContact CA-O 3.17Å; D158-V171 HydrophobicContact CB-CB 3.98Å; D158-V171 HydrophobicContact CB-CG2 4.25Å; D158-V171 PolarHBondContact N-O 3.04Å; D158-V171 PolarHBondContact O-N 3.38Å; I160-V171 HydrophobicContact CD1-CG2 3.76Å; V171-L508 HydrophobicContact CG1-CB 4.29Å; V171-L508 HydrophobicContact CG1-CD2 3.81Å; V171-K509 CarbonylContact C-O 3.57Å; V171-K509 WeakPolarHBondContact CA-O 3.37Å
172	L	97.7	Very high	97.7	Very high	76 Å²	76	47.3 Å²	47.3	40%	0.398	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	149.5	175.1	-51.4	179.5	0	0	0	109.8	L508 K509 V511	L172-L508 CarbonylContact O-C 3.46Å; L172-L508 WeakPolarHBondContact O-CA 3.49Å; L172-K509 HydrophobicContact CB-CB 4.35Å; L172-K509 PolarHBondContact N-O 3.07Å; L172-K509 PolarHBondContact O-N 3.19Å; L172-V511 HydrophobicContact CD1-CG2 3.98Å; L172-V511 HydrophobicContact CG-CG2 4.23Å
173	K	98.6	Very high	97.8	Very high	65 Å²	65	46.3 Å²	46.3	28%	0.283	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.9	169.2	-72.9	-171.8	-177.7	-162.5	0	109.6	V155 Y156 D503 L506 E507 L508	V155-K173 HydrophobicContact CG1-CB 3.44Å; V155-K173 VanDerWaalsContact CG1-CB 3.44Å; V155-K173 HydrophobicContact CG1-CD 3.91Å; V155-K173 HydrophobicContact CG1-CG 4.29Å; Y156-K173 VanDerWaalsContact O-CD 3.28Å; Y156-K173 WeakPolarHBondContact O-CD 3.26Å; Y156-K173 WeakPolarHBondContact O-CE 3.38Å; K173-D503 IonicContact NZ-OD1 2.72Å; K173-D503 PolarHBondContact NZ-OD1 2.94Å; K173-L506 HydrophobicContact CB-CD1 4.35Å; K173-L506 HydrophobicContact CB-CD2 4.47Å; K173-L506 HydrophobicContact CD-CD1 4.05Å; K173-E507 WeakPolarHBondContact CA-O 3.3Å; K173-L508 HydrophobicContact CD-CD2 4.32Å; K173-L508 HydrophobicContact CG-CD2 3.67Å
174	Q	98.6	Very high	97.8	Very high	58 Å²	58	41.4 Å²	41.4	27%	0.271	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149.3	-178.7	-59.6	-167.3	-80.8	0	0	111.2	L506 E507	Q174-L506 CarbonylContact O-C 3.57Å; Q174-L506 WeakPolarHBondContact O-CA 3.49Å; Q174-E507 PolarHBondContact N-O 3.28Å; Q174-E507 PolarHBondContact O-N 2.95Å
175	P	98.8	Very high	97.6	Very high	24 Å²	24	42 Å²	42	16%	0.156	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	141.1	179.1	23.9	-33.1	0	0	0	112	F109 R113 A202 Y505	F109-P175 HydrophobicContact CE2-CB 4.11Å; F109-P175 HydrophobicContact CE2-CG 3.98Å; R113-P175 HydrophobicContact CB-CG 4.14Å; P175-A202 WeakPolarHBondContact CB-O 3.33Å; P175-Y505 WeakPolarHBondContact CA-O 3.26Å
176	I	98.7	Very high	97.3	Very high	23 Å²	23	33.9 Å²	33.9	12%	0.118	16%	0.159	C	C	.	.			trans	-62.2	-44.8	-179.8	-68.6	166.9	0	0	0	111.8	K260 R283 E504 Y505 E507	I176-K260 HydrophobicContact CD1-CD 4.37Å; I176-K260 HydrophobicContact CG2-CB 4.19Å; I176-R283 HydrophobicContact CD1-CB 4.14Å; I176-R283 HydrophobicContact CD1-CG 4.05Å; I176-E504 VanDerWaalsContact CD1-O 3.26Å; I176-E504 WeakPolarHBondContact CD1-O 3.47Å; I176-Y505 VanDerWaalsContact CD1-C 3.45Å; I176-Y505 WeakPolarHBondContact CG1-O 3.33Å; I176-Y505 PolarHBondContact N-O 2.7Å; I176-E507 HydrophobicContact CG1-CG 3.93Å
177	G	98.8	Very high	97.2	Very high	2 Å²	2	33 Å²	33	2%	0.021	15%	0.152	C	C	.	.			trans	144.4	-137.3	-173.7	0	0	0	0	0	113.8	C204 T205	G177-C204 VanDerWaalsContact O-CA 3.31Å; G177-C204 WeakPolarHBondContact O-CA 3.3Å; G177-C204 WeakPolarHBondContact O-CB 3.42Å; G177-C204 PolarHBondContact O-SG 2.85Å; G177-C204 VanDerWaalsContact O-SG 3.4Å; G177-T205 PolarHBondContact O-N 3.09Å
178	V	98.9	Very high	97	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.3	173.6	-177.1	0	0	0	0	109.7	A105 Y106 F109 V207 L257 V258 S259 K260	A105-V178 HydrophobicContact CB-CG1 3.68Å; A105-V178 HydrophobicContact CB-CG2 4.2Å; Y106-V178 VanDerWaalsContact CA-CG2 3.47Å; Y106-V178 HydrophobicContact CD2-CG2 4.04Å; Y106-V178 HydrophobicContact CG-CG2 4.48Å; F109-V178 HydrophobicContact CB-CG2 4.36Å; V178-V207 HydrophobicContact CG1-CG2 4.42Å; V178-L257 WeakPolarHBondContact CB-O 3.36Å; V178-V258 HydrophobicContact CG1-CG2 4.18Å; V178-S259 PolarHBondContact O-N 3.18Å; V178-K260 PolarHBondContact O-N 3.01Å
179	A	98.9	Very high	96.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	127	173.8	0	0	0	0	0	112.2	V181 T205 V206 V207 K260 Y505	A179-V181 HydrophobicContact CB-CG2 4.48Å; A179-T205 PolarHBondContact N-O 3.4Å; A179-V206 HydrophobicContact CB-CG1 4.34Å; A179-V206 VanDerWaalsContact O-CA 3.31Å; A179-V206 WeakPolarHBondContact O-CA 3.47Å; A179-V207 PolarHBondContact O-N 3.37Å; A179-K260 CarbonylContact C-O 3.49Å; A179-K260 VanDerWaalsContact CA-O 3.24Å; A179-K260 WeakPolarHBondContact CA-O 3.33Å; A179-K260 HydrophobicContact CB-CB 3.88Å; A179-K260 HydrophobicContact CB-CG 3.99Å; A179-Y505 HydrophobicContact CB-CD1 4.39Å; A179-Y505 HydrophobicContact CB-CE1 3.99Å
180	A	98.9	Very high	96.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.3	164.4	0	0	0	0	0	109	I252 V258 K260 I261 S262	A180-I252 HydrophobicContact CB-CB 4.09Å; A180-I252 HydrophobicContact CB-CD1 4.08Å; A180-I252 HydrophobicContact CB-CG1 3.93Å; A180-V258 HydrophobicContact CB-CG1 3.84Å; A180-K260 PolarHBondContact N-O 3.43Å; A180-I261 HydrophobicContact CB-CG1 4.41Å; A180-I261 WeakPolarHBondContact O-CA 3.43Å; A180-S262 PolarHBondContact O-N 2.93Å
181	V	98.9	Very high	96.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.2	-176.9	174.8	0	0	0	0	108.7	A179 T183 K195 V196 V206 V207 V208 K209 S262	A179-V181 HydrophobicContact CB-CG2 4.48Å; V181-T183 HydrophobicContact CG1-CG2 4.02Å; V181-K195 HydrophobicContact CG1-CB 4.08Å; V181-K195 HydrophobicContact CG1-CD 3.75Å; V181-V196 HydrophobicContact CG1-CG2 4.4Å; V181-V206 HydrophobicContact CG2-CB 4.12Å; V181-V206 HydrophobicContact CG2-CG1 4.04Å; V181-V207 PolarHBondContact N-O 3.09Å; V181-V208 HydrophobicContact CB-CG2 4.09Å; V181-V208 HydrophobicContact CG1-CG1 4.4Å; V181-V208 HydrophobicContact CG1-CG2 4.24Å; V181-V208 CarbonylContact O-C 3.4Å; V181-V208 VanDerWaalsContact O-CA 3.26Å; V181-V208 WeakPolarHBondContact O-CA 3.36Å; V181-K209 PolarHBondContact O-N 2.92Å; V181-S262 WeakPolarHBondContact CA-O 3.22Å
182	I	98.9	Very high	96.5	Very high	15 Å²	15	20.1 Å²	20.1	8%	0.077	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.8	-178.2	-57.1	173.9	0	0	0	108.4	K209 I252 S262 F263 T264 L273	I182-K209 WeakPolarHBondContact CA-O 3.15Å; I182-K209 HydrophobicContact CG1-CB 4.25Å; I182-K209 HydrophobicContact CG2-CD 4.36Å; I182-I252 HydrophobicContact CD1-CD1 4.09Å; I182-I252 HydrophobicContact CD1-CG1 4.48Å; I182-I252 HydrophobicContact CG1-CD1 4.01Å; I182-S262 PolarHBondContact N-O 3.13Å; I182-F263 HydrophobicContact CB-CD2 3.8Å; I182-F263 HydrophobicContact CG2-CD2 3.67Å; I182-F263 HydrophobicContact CG2-CE2 3.94Å; I182-F263 WeakPolarHBondContact O-CA 3.36Å; I182-T264 PolarHBondContact O-N 3.27Å; I182-L273 HydrophobicContact CD1-CD1 3.81Å; I182-L273 HydrophobicContact CD1-CD2 4.4Å
183	T	98	Very high	96.4	Very high	7 Å²	7	17.6 Å²	17.6	4%	0.043	9%	0.089	C	C	.	.			trans	-124.5	149.5	-170.3	56.1	0	0	0	0	113.2	V181 M191 I192 K195 K209 A211	V181-T183 HydrophobicContact CG1-CG2 4.02Å; T183-M191 HydrophobicContact CG2-CB 4.05Å; T183-I192 HydrophobicContact CG2-CG1 3.8Å; T183-I192 WeakPolarHBondContact OG1-CG1 3.27Å; T183-K195 HydrophobicContact CG2-CD 4.07Å; T183-K209 PolarHBondContact N-O 3.15Å; T183-A211 PolarHBondContact O-N 3.21Å; T183-A211 VanDerWaalsContact O-N 3.17Å
184	P	96.2	Very high	96.2	Very high	21 Å²	21	16.7 Å²	16.7	14%	0.136	8%	0.083	C	C	.	.			trans	-82.5	-179	177.9	38.7	-39.2	0	0	0	111.5	N186 M191 T264	P184-N186 WeakPolarHBondContact CG-OD1 3.49Å; P184-M191 HydrophobicContact CG-CG 4.04Å; P184-T264 VanDerWaalsContact CD-O 3.26Å; P184-T264 WeakPolarHBondContact CD-O 3.34Å; P184-T264 HydrophobicContact CG-CG2 3.91Å
185	W	93.6	Very high	96.2	Very high	51 Å²	51	14 Å²	14	19%	0.193	7%	0.071	C	C	.	.	S	Bend	trans	-91.8	-15.2	-176.8	57.5	-99.5	0	0	0	115.2	F187 P188 A211 D213 T214 Q319 I365 F421	W185-F187 PolarHBondContact O-N 2.88Å; W185-P188 WeakPolarHBondContact O-CD 3.38Å; W185-A211 HydrophobicContact CB-CB 3.82Å; W185-D213 HydrophobicContact CB-CB 4.09Å; W185-T214 VanDerWaalsContact CA-OG1 3.26Å; W185-T214 WeakPolarHBondContact CA-OG1 3.05Å; W185-T214 HydrophobicContact CB-CG2 4.1Å; W185-T214 WeakPolarHBondContact CB-OG1 3.25Å; W185-Q319 HydrophobicContact CH2-CB 3.5Å; W185-Q319 VanDerWaalsContact CH2-CB 3.5Å; W185-Q319 VanDerWaalsContact CH2-CD 3.49Å; W185-Q319 HydrophobicContact CH2-CG 3.77Å; W185-Q319 HydrophobicContact CZ3-CB 3.87Å; W185-Q319 HydrophobicContact CZ3-CG 4.33Å; W185-I365 HydrophobicContact CD2-CB 4.14Å; W185-I365 HydrophobicContact CD2-CD1 4.08Å; W185-I365 HydrophobicContact CD2-CG1 3.72Å; W185-I365 HydrophobicContact CD2-CG2 4.38Å; W185-I365 HydrophobicContact CE3-CB 3.93Å; W185-I365 HydrophobicContact CE3-CD1 3.72Å; W185-I365 HydrophobicContact CE3-CG1 3.74Å; W185-I365 HydrophobicContact CG-CD1 4.48Å; W185-I365 HydrophobicContact CG-CG1 4.19Å; W185-I365 HydrophobicContact CH2-CB 3.62Å; W185-I365 HydrophobicContact CH2-CG1 4.3Å; W185-I365 HydrophobicContact CH2-CG2 3.61Å; W185-I365 HydrophobicContact CZ2-CB 3.87Å; W185-I365 HydrophobicContact CZ2-CG1 4.33Å; W185-I365 HydrophobicContact CZ2-CG2 3.44Å; W185-I365 VanDerWaalsContact CZ2-CG2 3.44Å; W185-I365 HydrophobicContact CZ3-CB 3.67Å; W185-I365 HydrophobicContact CZ3-CD1 4.19Å; W185-I365 HydrophobicContact CZ3-CG1 4.05Å; W185-I365 HydrophobicContact CZ3-CG2 4.19Å; W185-F421 HydrophobicContact CZ2-CD2 4.32Å
186	N	90.3	Very high	96.2	Very high	11 Å²	11	12.9 Å²	12.9	6%	0.059	6%	0.064	C	C	.	.	S	Bend	trans	-67.1	-39.2	-170.5	59.1	-21.3	0	0	0	113.5	P184 N316 Q319	P184-N186 WeakPolarHBondContact CG-OD1 3.49Å; N186-N316 PolarHBondContact O-ND2 3.49Å; N186-N316 VanDerWaalsContact O-ND2 3.07Å; N186-Q319 WeakPolarHBondContact CB-O 3Å
187	F	92.7	Very high	96.1	Very high	49 Å²	49	12.3 Å²	12.3	22%	0.215	6%	0.063	C	C	.	.	S	Bend	trans	-131.8	77.6	170.9	-61.9	-88.7	0	0	0	109.4	W185 S189 A190 M191 T320	W185-F187 PolarHBondContact O-N 2.88Å; F187-S189 PolarHBondContact O-N 3.09Å; F187-S189 VanDerWaalsContact O-N 3.08Å; F187-A190 HydrophobicContact CB-CB 4.18Å; F187-A190 PolarHBondContact O-N 2.75Å; F187-M191 HydrophobicContact CB-CE 4.45Å; F187-M191 HydrophobicContact CB-CG 4.04Å; F187-M191 HydrophobicContact CD2-CE 4.15Å; F187-M191 WeakPolarHBondContact O-CB 3.41Å; F187-M191 WeakPolarHBondContact O-CG 3.35Å; F187-M191 PolarHBondContact O-N 2.85Å; F187-T320 HydrophobicContact CE2-CG2 3.41Å; F187-T320 VanDerWaalsContact CE2-CG2 3.41Å; F187-T320 WeakPolarHBondContact CE2-OG1 3.47Å; F187-T320 HydrophobicContact CZ-CG2 3.87Å; F187-T320 WeakPolarHBondContact CZ-OG1 2.92Å
188	P	92	Very high	96	Very high	3 Å²	3	12.3 Å²	12.3	2%	0.019	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-12.6	-165.7	28.2	-34.3	0	0	0	114.1	I142 W185 I192 T214 S217	I142-P188 HydrophobicContact CB-CG 3.85Å; I142-P188 HydrophobicContact CD1-CG 3.37Å; I142-P188 HydrophobicContact CG1-CG 4.21Å; I142-P188 HydrophobicContact CG2-CG 3.89Å; W185-P188 WeakPolarHBondContact O-CD 3.38Å; P188-I192 WeakPolarHBondContact O-CD1 3.43Å; P188-T214 HydrophobicContact CB-CG2 4.31Å; P188-T214 WeakPolarHBondContact CB-OG1 3.49Å; P188-T214 HydrophobicContact CG-CG2 4.18Å; P188-S217 WeakPolarHBondContact CG-OG 3.39Å
189	S	92.8	Very high	96	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.014	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-55.3	171.6	-161.3	0	0	0	0	111.4	I142 A144 F187 M191 I192 T193	I142-S189 WeakPolarHBondContact O-CB 3.48Å; A144-S189 WeakPolarHBondContact CB-OG 3.08Å; F187-S189 PolarHBondContact O-N 3.09Å; F187-S189 VanDerWaalsContact O-N 3.08Å; S189-M191 VanDerWaalsContact C-N 3.34Å; S189-M191 PolarHBondContact O-N 3.12Å; S189-I192 WeakPolarHBondContact O-CB 3.5Å; S189-I192 PolarHBondContact O-N 2.87Å; S189-T193 PolarHBondContact O-N 3.36Å; S189-T193 PolarHBondContact O-OG1 3.35Å
190	A	92.5	Very high	96	Very high	12 Å²	12	12.3 Å²	12.3	10%	0.099	6%	0.063	C	C	.	.	H	α-helix	trans	-63.4	-31.6	-175.2	0	0	0	0	0	114.8	F187 I192 T193 R194	F187-A190 HydrophobicContact CB-CB 4.18Å; F187-A190 PolarHBondContact O-N 2.75Å; A190-I192 VanDerWaalsContact C-N 3.28Å; A190-I192 PolarHBondContact O-N 3.27Å; A190-T193 WeakPolarHBondContact CA-OG1 3.39Å; A190-T193 PolarHBondContact O-OG1 2.99Å; A190-R194 VanDerWaalsContact O-CG 3.32Å; A190-R194 WeakPolarHBondContact O-CG 3.45Å; A190-R194 PolarHBondContact O-N 3.29Å; A190-R194 PolarHBondContact O-NE 3.47Å
191	M	95.3	Very high	95.9	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-68.6	-29.4	175.3	-71.7	-65.4	153.2	0	0	112.5	T183 P184 F187 S189 K195 T264	T183-M191 HydrophobicContact CG2-CB 4.05Å; P184-M191 HydrophobicContact CG-CG 4.04Å; F187-M191 HydrophobicContact CB-CE 4.45Å; F187-M191 HydrophobicContact CB-CG 4.04Å; F187-M191 HydrophobicContact CD2-CE 4.15Å; F187-M191 WeakPolarHBondContact O-CB 3.41Å; F187-M191 WeakPolarHBondContact O-CG 3.35Å; F187-M191 PolarHBondContact O-N 2.85Å; S189-M191 VanDerWaalsContact C-N 3.34Å; S189-M191 PolarHBondContact O-N 3.12Å; M191-K195 WeakPolarHBondContact O-CD 3.21Å; M191-K195 WeakPolarHBondContact O-CG 3.33Å; M191-T264 HydrophobicContact SD-CG2 3.86Å
192	I	96.8	Very high	95.8	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-78	-52	175.9	-60.9	176.6	0	0	0	109.1	T183 P188 S189 A190 R194 K195 V196 V208 A218 L221 Y235	T183-I192 HydrophobicContact CG2-CG1 3.8Å; T183-I192 WeakPolarHBondContact OG1-CG1 3.27Å; P188-I192 WeakPolarHBondContact O-CD1 3.43Å; S189-I192 WeakPolarHBondContact O-CB 3.5Å; S189-I192 PolarHBondContact O-N 2.87Å; A190-I192 VanDerWaalsContact C-N 3.28Å; A190-I192 PolarHBondContact O-N 3.27Å; I192-R194 VanDerWaalsContact C-N 3.34Å; I192-R194 PolarHBondContact O-N 3.48Å; I192-K195 PolarHBondContact O-N 3.07Å; I192-K195 VanDerWaalsContact O-N 3.15Å; I192-V196 HydrophobicContact CG2-CB 4.44Å; I192-V196 HydrophobicContact CG2-CG2 3.72Å; I192-V196 WeakPolarHBondContact O-CB 3.42Å; I192-V196 VanDerWaalsContact O-CG2 3.28Å; I192-V196 WeakPolarHBondContact O-CG2 3.31Å; I192-V196 PolarHBondContact O-N 3.4Å; I192-V208 HydrophobicContact CD1-CG1 4.18Å; I192-V208 HydrophobicContact CG1-CG1 4.31Å; I192-V208 HydrophobicContact CG2-CG1 4.37Å; I192-V208 HydrophobicContact CG2-CG2 4.41Å; I192-A218 HydrophobicContact CD1-CB 3.37Å; I192-L221 HydrophobicContact CB-CD1 4.13Å; I192-L221 HydrophobicContact CD1-CD1 4.41Å; I192-L221 HydrophobicContact CG2-CD1 4.02Å; I192-Y235 HydrophobicContact CG2-CE2 4.19Å
193	T	96.1	Very high	95.8	Very high	23 Å²	23	11.7 Å²	11.7	14%	0.141	6%	0.061	C	C	.	.	H	α-helix	trans	-65.3	-34.8	-170	58.2	0	0	0	0	113	M131 A144 S189 A190 K195 G197 L221	M131-T193 HydrophobicContact CE-CG2 3.9Å; A144-T193 HydrophobicContact CB-CG2 4.27Å; S189-T193 PolarHBondContact O-N 3.36Å; S189-T193 PolarHBondContact O-OG1 3.35Å; A190-T193 WeakPolarHBondContact CA-OG1 3.39Å; A190-T193 PolarHBondContact O-OG1 2.99Å; T193-K195 PolarHBondContact O-N 3.24Å; T193-G197 WeakPolarHBondContact O-CA 3.44Å; T193-G197 PolarHBondContact O-N 2.87Å; T193-L221 HydrophobicContact CG2-CD1 3.85Å; T193-L221 HydrophobicContact CG2-CD2 3.94Å
194	R	94.2	Very high	95.8	Very high	46 Å²	46	11.4 Å²	11.4	17%	0.174	6%	0.059	C	C	.	.	H	α-helix	trans	-64.1	-37.6	175.5	70.5	177.8	61.7	-176.9	-4.6	113.1	F148 A190 I192 E287 E496	F148-R194 VanDerWaalsContact CE2-O 3.22Å; F148-R194 WeakPolarHBondContact CE2-O 3.36Å; A190-R194 VanDerWaalsContact O-CG 3.32Å; A190-R194 WeakPolarHBondContact O-CG 3.45Å; A190-R194 PolarHBondContact O-N 3.29Å; A190-R194 PolarHBondContact O-NE 3.47Å; I192-R194 VanDerWaalsContact C-N 3.34Å; I192-R194 PolarHBondContact O-N 3.48Å; R194-E287 IonicContact NH1-OE2 3.73Å; R194-E287 PolarHBondContact NH1-OE2 2.88Å; R194-E496 WeakPolarHBondContact CD-OE2 3.47Å; R194-E496 HydrophobicContact CG-CB 4.48Å; R194-E496 IonicContact NH1-OE2 3.28Å; R194-E496 PolarHBondContact NH1-OE2 3.05Å
195	K	98.4	Very high	96	Very high	1 Å²	1	10.4 Å²	10.4	0%	0.004	5%	0.052	C	C	.	.	H	α-helix	trans	-77.8	-50.1	179.6	-68.6	174.3	-171.4	-66.6	0	110.9	V181 T183 M191 I192 T193 A198 A199 S262 F263 T264 E496 Y505	V181-K195 HydrophobicContact CG1-CB 4.08Å; V181-K195 HydrophobicContact CG1-CD 3.75Å; T183-K195 HydrophobicContact CG2-CD 4.07Å; M191-K195 WeakPolarHBondContact O-CD 3.21Å; M191-K195 WeakPolarHBondContact O-CG 3.33Å; I192-K195 PolarHBondContact O-N 3.07Å; I192-K195 VanDerWaalsContact O-N 3.15Å; T193-K195 PolarHBondContact O-N 3.24Å; K195-A198 PolarHBondContact O-N 2.89Å; K195-A199 WeakPolarHBondContact O-CB 3.47Å; K195-A199 PolarHBondContact O-N 2.87Å; K195-S262 VanDerWaalsContact CD-OG 3.26Å; K195-S262 WeakPolarHBondContact CD-OG 3.46Å; K195-S262 WeakPolarHBondContact CG-OG 3.5Å; K195-S262 PolarHBondContact NZ-OG 3.28Å; K195-F263 PolarHBondContact NZ-O 3.06Å; K195-T264 WeakPolarHBondContact CE-OG1 3Å; K195-T264 PolarHBondContact NZ-OG1 3.16Å; K195-E496 VanDerWaalsContact CE-OE1 3.25Å; K195-E496 WeakPolarHBondContact CE-OE1 3.46Å; K195-E496 WeakPolarHBondContact CG-OE1 3.49Å; K195-E496 IonicContact NZ-OE1 3.47Å; K195-E496 PolarHBondContact NZ-OE1 3.22Å; K195-E496 IonicContact NZ-OE2 3.74Å; K195-Y505 PolarHBondContact O-OH 2.8Å
196	V	98.5	Very high	96.2	Very high	1 Å²	1	8 Å²	8	1%	0.006	4%	0.043	C	C	.	.	H	α-helix	trans	-71.7	-38.3	-174.2	174.3	0	0	0	0	111.1	W127 V181 I192 A198 A199 L200 V206 V208 Y235	W127-V196 HydrophobicContact CH2-CG1 3.95Å; W127-V196 HydrophobicContact CZ3-CG1 4.01Å; V181-V196 HydrophobicContact CG1-CG2 4.4Å; I192-V196 HydrophobicContact CG2-CB 4.44Å; I192-V196 HydrophobicContact CG2-CG2 3.72Å; I192-V196 WeakPolarHBondContact O-CB 3.42Å; I192-V196 VanDerWaalsContact O-CG2 3.28Å; I192-V196 WeakPolarHBondContact O-CG2 3.31Å; I192-V196 PolarHBondContact O-N 3.4Å; V196-A198 PolarHBondContact O-N 3.1Å; V196-A199 PolarHBondContact O-N 3.44Å; V196-L200 HydrophobicContact CG1-CD1 3.93Å; V196-L200 HydrophobicContact CG1-CD2 4.38Å; V196-L200 WeakPolarHBondContact O-CB 3.45Å; V196-L200 WeakPolarHBondContact O-CD1 3.33Å; V196-L200 PolarHBondContact O-N 2.8Å; V196-V206 HydrophobicContact CG1-CG2 3.99Å; V196-V206 HydrophobicContact CG2-CG1 4.43Å; V196-V206 HydrophobicContact CG2-CG2 4.03Å; V196-V208 HydrophobicContact CG2-CG2 3.95Å; V196-Y235 HydrophobicContact CG1-CD2 3.68Å; V196-Y235 HydrophobicContact CG1-CE2 3.91Å; V196-Y235 HydrophobicContact CG2-CD2 4.44Å; V196-Y235 HydrophobicContact CG2-CE2 4.07Å
197	G	97	Very high	96.6	Very high	11 Å²	11	7.5 Å²	7.5	11%	0.113	4%	0.04	C	C	.	.	H	α-helix	trans	-57.7	-49	174.2	0	0	0	0	0	111.8	F148 T193 A201	F148-G197 VanDerWaalsContact CB-C 3.44Å; F148-G197 WeakPolarHBondContact CB-O 3.33Å; T193-G197 WeakPolarHBondContact O-CA 3.44Å; T193-G197 PolarHBondContact O-N 2.87Å; G197-A201 WeakPolarHBondContact O-CB 3.23Å; G197-A201 PolarHBondContact O-N 3.39Å
198	A	97.9	Very high	96.9	Very high	2 Å²	2	5.1 Å²	5.1	2%	0.017	3%	0.03	C	C	.	.	H	α-helix	trans	-62.6	-45.6	176.3	0	0	0	0	0	112.3	F148 K195 V196 A201 A202 Y505	F148-A198 HydrophobicContact CD1-CB 3.94Å; F148-A198 HydrophobicContact CD2-CB 4.11Å; F148-A198 HydrophobicContact CE1-CB 3.77Å; F148-A198 HydrophobicContact CE2-CB 3.94Å; F148-A198 HydrophobicContact CG-CB 4.11Å; F148-A198 HydrophobicContact CZ-CB 3.76Å; K195-A198 PolarHBondContact O-N 2.89Å; V196-A198 PolarHBondContact O-N 3.1Å; A198-A201 PolarHBondContact O-N 3.1Å; A198-A202 PolarHBondContact O-N 3.27Å; A198-Y505 HydrophobicContact CB-CD2 3.71Å; A198-Y505 HydrophobicContact CB-CE2 3.63Å
199	A	98.6	Very high	97.3	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-58.3	-51.7	178.3	0	0	0	0	0	112.1	K195 V196 A201 A202 G203 C204 V206 Y505	K195-A199 WeakPolarHBondContact O-CB 3.47Å; K195-A199 PolarHBondContact O-N 2.87Å; V196-A199 PolarHBondContact O-N 3.44Å; A199-A201 VanDerWaalsContact C-N 3.35Å; A199-A201 PolarHBondContact O-N 3.32Å; A199-A202 PolarHBondContact O-N 2.84Å; A199-G203 PolarHBondContact O-N 3.34Å; A199-G203 VanDerWaalsContact O-N 3.14Å; A199-C204 HydrophobicContact CB-CB 4.14Å; A199-C204 WeakPolarHBondContact O-CA 3.06Å; A199-C204 VanDerWaalsContact O-CB 3.31Å; A199-C204 WeakPolarHBondContact O-CB 3.42Å; A199-C204 PolarHBondContact O-N 3.4Å; A199-V206 HydrophobicContact CB-CG1 3.56Å; A199-Y505 HydrophobicContact CB-CD1 3.65Å; A199-Y505 HydrophobicContact CB-CE1 3.59Å; A199-Y505 HydrophobicContact CB-CG 4.17Å
200	L	98.5	Very high	97.5	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-67.5	-36	-179.4	-91.6	58.5	0	0	0	112.1	W112 L124 W127 V196 G203 V206 I230 V234	W112-L200 HydrophobicContact CZ2-CB 4.35Å; W112-L200 HydrophobicContact CZ2-CG 4.33Å; W112-L200 PolarHBondContact NE1-O 3.05Å; L124-L200 HydrophobicContact CD1-CB 4.39Å; L124-L200 HydrophobicContact CD2-CB 3.98Å; L124-L200 HydrophobicContact CD2-CD2 4.05Å; W127-L200 HydrophobicContact CE3-CD2 4.5Å; W127-L200 HydrophobicContact CZ3-CD2 3.91Å; V196-L200 HydrophobicContact CG1-CD1 3.93Å; V196-L200 HydrophobicContact CG1-CD2 4.38Å; V196-L200 WeakPolarHBondContact O-CB 3.45Å; V196-L200 WeakPolarHBondContact O-CD1 3.33Å; V196-L200 PolarHBondContact O-N 2.8Å; L200-G203 PolarHBondContact O-N 3.49Å; L200-G203 VanDerWaalsContact O-N 3.13Å; L200-V206 HydrophobicContact CD1-CG1 4.18Å; L200-V206 HydrophobicContact CD1-CG2 4.31Å; L200-I230 HydrophobicContact CD2-CD1 4.18Å; L200-V234 HydrophobicContact CD1-CG1 3.93Å; L200-V234 HydrophobicContact CD2-CG1 3.86Å; L200-V234 HydrophobicContact CG-CG1 3.65Å
201	A	95.9	Very high	97.7	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-60.1	-46.3	175.4	0	0	0	0	0	111.3	R120 L124 F148 A152 G197 A198 A199 G203 I502	R120-A201 PolarHBondContact NE-O 3.28Å; R120-A201 PolarHBondContact NH2-O 3.35Å; R120-A201 VanDerWaalsContact NH2-O 3.08Å; L124-A201 HydrophobicContact CD1-CB 4.03Å; F148-A201 HydrophobicContact CB-CB 4.22Å; F148-A201 WeakPolarHBondContact O-CB 3.21Å; A152-A201 HydrophobicContact CB-CB 3.81Å; G197-A201 WeakPolarHBondContact O-CB 3.23Å; G197-A201 PolarHBondContact O-N 3.39Å; A198-A201 PolarHBondContact O-N 3.1Å; A199-A201 VanDerWaalsContact C-N 3.35Å; A199-A201 PolarHBondContact O-N 3.32Å; A201-G203 PolarHBondContact O-N 2.86Å; A201-I502 HydrophobicContact CB-CD1 3.88Å
202	A	98.3	Very high	97.7	Very high	3 Å²	3	7.5 Å²	7.5	3%	0.025	4%	0.04	C	C	.	.	H	α-helix	trans	-62.6	-27.9	174.9	0	0	0	0	0	113	P175 A198 A199 I502 L506	P175-A202 WeakPolarHBondContact CB-O 3.33Å; A198-A202 PolarHBondContact O-N 3.27Å; A199-A202 PolarHBondContact O-N 2.84Å; A202-I502 HydrophobicContact CB-CG1 3.97Å; A202-L506 HydrophobicContact CB-CD2 3.88Å; A202-L506 HydrophobicContact CB-CG 4.18Å
203	G	98.4	Very high	97.4	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.7	15.3	-175.6	0	0	0	0	0	113.9	W112 A199 L200 A201	W112-G203 VanDerWaalsContact CD1-C 3.49Å; W112-G203 VanDerWaalsContact CD1-O 3.31Å; A199-G203 PolarHBondContact O-N 3.34Å; A199-G203 VanDerWaalsContact O-N 3.14Å; L200-G203 PolarHBondContact O-N 3.49Å; L200-G203 VanDerWaalsContact O-N 3.13Å; A201-G203 PolarHBondContact O-N 2.86Å
204	C	98.9	Very high	97.3	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.007	6%	0.055	C	C	.	.			trans	-80.6	164.6	170.4	-64.9	0	0	0	0	111.3	W112 G177 A199 Y505	W112-C204 PolarHBondContact NE1-O 3.29Å; G177-C204 VanDerWaalsContact O-CA 3.31Å; G177-C204 WeakPolarHBondContact O-CA 3.3Å; G177-C204 WeakPolarHBondContact O-CB 3.42Å; G177-C204 PolarHBondContact O-SG 2.85Å; G177-C204 VanDerWaalsContact O-SG 3.4Å; A199-C204 HydrophobicContact CB-CB 4.14Å; A199-C204 WeakPolarHBondContact O-CA 3.06Å; A199-C204 VanDerWaalsContact O-CB 3.31Å; A199-C204 WeakPolarHBondContact O-CB 3.42Å; A199-C204 PolarHBondContact O-N 3.4Å; C204-Y505 PolarHBondContact SG-O 3.29Å; C204-Y505 VanDerWaalsContact SG-O 3.4Å
205	T	98.9	Very high	97.4	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	161.6	167.4	58.6	0	0	0	0	109.8	A105 A108 F109 W112 G177 A179 V234	A105-T205 PolarHBondContact O-OG1 3.36Å; A108-T205 HydrophobicContact CB-CG2 4.14Å; F109-T205 HydrophobicContact CB-CG2 3.93Å; W112-T205 HydrophobicContact CB-CG2 4.11Å; W112-T205 HydrophobicContact CG-CG2 4.31Å; G177-T205 PolarHBondContact O-N 3.09Å; A179-T205 PolarHBondContact N-O 3.4Å; T205-V234 HydrophobicContact CG2-CB 4.26Å; T205-V234 HydrophobicContact CG2-CG1 4.3Å; T205-V234 HydrophobicContact CG2-CG2 4.09Å
206	V	98.9	Very high	97.3	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.9	-172	-57.3	0	0	0	0	113.7	A179 V181 V196 A199 L200 V208 V234 Y235 N236	A179-V206 HydrophobicContact CB-CG1 4.34Å; A179-V206 VanDerWaalsContact O-CA 3.31Å; A179-V206 WeakPolarHBondContact O-CA 3.47Å; V181-V206 HydrophobicContact CG2-CB 4.12Å; V181-V206 HydrophobicContact CG2-CG1 4.04Å; V196-V206 HydrophobicContact CG1-CG2 3.99Å; V196-V206 HydrophobicContact CG2-CG1 4.43Å; V196-V206 HydrophobicContact CG2-CG2 4.03Å; A199-V206 HydrophobicContact CB-CG1 3.56Å; L200-V206 HydrophobicContact CD1-CG1 4.18Å; L200-V206 HydrophobicContact CD1-CG2 4.31Å; V206-V208 HydrophobicContact CG2-CG2 4.07Å; V206-V234 PolarHBondContact N-O 3.48Å; V206-Y235 HydrophobicContact CG2-CD2 3.63Å; V206-Y235 HydrophobicContact CG2-CE2 4.36Å; V206-Y235 HydrophobicContact CG2-CG 4.5Å; V206-N236 PolarHBondContact O-N 3.46Å; V206-N236 PolarHBondContact O-ND2 3.5Å
207	V	98.9	Very high	97	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.2	163.5	-178.6	0	0	0	0	107.9	A101 V102 A105 V178 A179 V181 I238 I252	A101-V207 HydrophobicContact CB-CG1 3.89Å; A101-V207 HydrophobicContact CB-CG2 4.28Å; V102-V207 HydrophobicContact CG2-CG2 4.18Å; A105-V207 HydrophobicContact CB-CG2 3.7Å; V178-V207 HydrophobicContact CG1-CG2 4.42Å; A179-V207 PolarHBondContact O-N 3.37Å; V181-V207 PolarHBondContact N-O 3.09Å; V207-I238 HydrophobicContact CG1-CD1 3.53Å; V207-I238 HydrophobicContact CG1-CG1 3.8Å; V207-I252 HydrophobicContact CG1-CG2 4.34Å
208	V	98.9	Very high	97	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.5	-177.6	-175.1	0	0	0	0	110.3	V181 I192 V196 V206 P210 Y235 N236 V237 I238	V181-V208 HydrophobicContact CB-CG2 4.09Å; V181-V208 HydrophobicContact CG1-CG1 4.4Å; V181-V208 HydrophobicContact CG1-CG2 4.24Å; V181-V208 CarbonylContact O-C 3.4Å; V181-V208 VanDerWaalsContact O-CA 3.26Å; V181-V208 WeakPolarHBondContact O-CA 3.36Å; I192-V208 HydrophobicContact CD1-CG1 4.18Å; I192-V208 HydrophobicContact CG1-CG1 4.31Å; I192-V208 HydrophobicContact CG2-CG1 4.37Å; I192-V208 HydrophobicContact CG2-CG2 4.41Å; V196-V208 HydrophobicContact CG2-CG2 3.95Å; V206-V208 HydrophobicContact CG2-CG2 4.07Å; V208-P210 WeakPolarHBondContact O-CD 3.26Å; V208-Y235 HydrophobicContact CG2-CD2 4.26Å; V208-Y235 HydrophobicContact CG2-CE2 3.64Å; V208-N236 WeakPolarHBondContact CB-O 3.38Å; V208-N236 PolarHBondContact N-O 2.74Å; V208-V237 HydrophobicContact CB-CG2 4.46Å; V208-V237 WeakPolarHBondContact O-CA 3.38Å; V208-I238 WeakPolarHBondContact O-CG1 3.3Å; V208-I238 PolarHBondContact O-N 3.22Å
209	K	98.8	Very high	97	Very high	13 Å²	13	8.2 Å²	8.2	6%	0.057	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	101.6	164.7	-171.2	-85.9	173	-157.7	0	108.1	V181 I182 T183 E212 I238 C240 V248 I252	V181-K209 PolarHBondContact O-N 2.92Å; I182-K209 WeakPolarHBondContact CA-O 3.15Å; I182-K209 HydrophobicContact CG1-CB 4.25Å; I182-K209 HydrophobicContact CG2-CD 4.36Å; T183-K209 PolarHBondContact N-O 3.15Å; K209-E212 IonicContact NZ-OE2 3.61Å; K209-E212 PolarHBondContact NZ-OE2 3.27Å; K209-I238 HydrophobicContact CB-CG1 4.38Å; K209-C240 WeakPolarHBondContact CE-SG 3.13Å; K209-V248 HydrophobicContact CG-CG1 4.02Å; K209-I252 HydrophobicContact CB-CD1 4.07Å
210	P	98.3	Very high	96.9	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.019	4%	0.044	C	C	.	.			trans	-74.9	167	177.9	32.3	-35.3	0	0	0	111.9	V208 P215 A218 V237 P239	V208-P210 WeakPolarHBondContact O-CD 3.26Å; P210-P215 HydrophobicContact CG-CB 4.27Å; P210-A218 HydrophobicContact CB-CB 3.76Å; P210-A218 HydrophobicContact CG-CB 3.94Å; P210-V237 HydrophobicContact CG-CG1 4.04Å; P210-P239 HydrophobicContact CG-CB 4.38Å; P210-P239 HydrophobicContact CG-CG 4.43Å
211	A	96.9	Very high	96.8	Very high	8 Å²	8	8.2 Å²	8.2	7%	0.066	4%	0.044	C	C	.	.			trans	-64.8	141	168.6	0	0	0	0	0	110.9	T183 W185 D213 T214	T183-A211 PolarHBondContact O-N 3.21Å; T183-A211 VanDerWaalsContact O-N 3.17Å; W185-A211 HydrophobicContact CB-CB 3.82Å; A211-D213 PolarHBondContact O-N 3.17Å; A211-T214 PolarHBondContact O-N 2.98Å
212	E	94.6	Very high	96.9	Very high	45 Å²	45	8.2 Å²	8.2	21%	0.21	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.1	178.7	55.5	-94.6	-139.5	0	0	113.5	F76 K209 T214 P215 R242	F76-E212 HydrophobicContact CE2-CB 4.09Å; F76-E212 VanDerWaalsContact CE2-O 3.29Å; F76-E212 WeakPolarHBondContact CE2-O 3.41Å; F76-E212 HydrophobicContact CZ-CB 4.43Å; K209-E212 IonicContact NZ-OE2 3.61Å; K209-E212 PolarHBondContact NZ-OE2 3.27Å; E212-T214 VanDerWaalsContact C-N 3.32Å; E212-T214 PolarHBondContact O-N 3.47Å; E212-P215 WeakPolarHBondContact O-CD 3.23Å; E212-R242 WeakPolarHBondContact OE1-CA 3.21Å; E212-R242 VanDerWaalsContact OE1-CB 3.3Å; E212-R242 WeakPolarHBondContact OE1-CB 3.39Å
213	D	90.3	Very high	96.9	Very high	60 Å²	60	8.9 Å²	8.9	32%	0.321	5%	0.047	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-22.8	179.8	-56.6	-68.7	0	0	0	112.6	W185 A211 I365	W185-D213 HydrophobicContact CB-CB 4.09Å; A211-D213 PolarHBondContact O-N 3.17Å; D213-I365 HydrophobicContact CB-CD1 4Å; D213-I365 HydrophobicContact CB-CG1 4.15Å
214	T	94.4	Very high	96.8	Very high	21 Å²	21	8.9 Å²	8.9	13%	0.129	5%	0.047	C	C	.	.	S	Bend	trans	-142.7	46.7	-170.5	48.7	0	0	0	0	114	W185 P188 A211 E212 F216	W185-T214 VanDerWaalsContact CA-OG1 3.26Å; W185-T214 WeakPolarHBondContact CA-OG1 3.05Å; W185-T214 HydrophobicContact CB-CG2 4.1Å; W185-T214 WeakPolarHBondContact CB-OG1 3.25Å; P188-T214 HydrophobicContact CB-CG2 4.31Å; P188-T214 WeakPolarHBondContact CB-OG1 3.49Å; P188-T214 HydrophobicContact CG-CG2 4.18Å; A211-T214 PolarHBondContact O-N 2.98Å; E212-T214 VanDerWaalsContact C-N 3.32Å; E212-T214 PolarHBondContact O-N 3.47Å; T214-F216 VanDerWaalsContact C-N 3.29Å; T214-F216 PolarHBondContact O-N 3.45Å
215	P	96.3	Very high	96.8	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-70.4	-24	-174.6	30.9	-38.3	0	0	0	113.4	F76 V78 V90 P210 E212 S217 A218 L219 P239	F76-P215 HydrophobicContact CE2-CG 4.11Å; F76-P215 HydrophobicContact CZ-CB 4.35Å; F76-P215 HydrophobicContact CZ-CG 4.05Å; V78-P215 HydrophobicContact CG2-CG 3.68Å; V90-P215 HydrophobicContact CB-CG 4.3Å; V90-P215 HydrophobicContact CG1-CB 4.16Å; V90-P215 HydrophobicContact CG1-CG 4.11Å; V90-P215 HydrophobicContact CG2-CG 3.85Å; P210-P215 HydrophobicContact CG-CB 4.27Å; E212-P215 WeakPolarHBondContact O-CD 3.23Å; P215-S217 VanDerWaalsContact C-N 3.33Å; P215-S217 PolarHBondContact O-N 2.89Å; P215-A218 WeakPolarHBondContact O-CB 3.07Å; P215-A218 PolarHBondContact O-N 2.98Å; P215-L219 WeakPolarHBondContact O-CG 3.47Å; P215-L219 PolarHBondContact O-N 3.31Å; P215-P239 HydrophobicContact CB-CB 4.12Å; P215-P239 HydrophobicContact CB-CG 4.47Å
216	F	95.1	Very high	96.7	Very high	15 Å²	15	11.3 Å²	11.3	7%	0.066	6%	0.063	C	C	.	.	H	α-helix	trans	-62.1	-36	-172.1	-65	-55.7	0	0	0	113.5	L59 R60 T61 V78 L87 V90 I141 T214 A218 L219 A220	L59-F216 HydrophobicContact CD1-CB 4.21Å; L59-F216 HydrophobicContact CD1-CD1 3.62Å; L59-F216 HydrophobicContact CD1-CD2 4.21Å; L59-F216 HydrophobicContact CD1-CE1 3.97Å; L59-F216 HydrophobicContact CD1-CG 3.76Å; L59-F216 HydrophobicContact CD1-CZ 4.41Å; R60-F216 WeakPolarHBondContact O-CD1 3.36Å; R60-F216 WeakPolarHBondContact O-CE1 3.29Å; T61-F216 HydrophobicContact CG2-CE1 4.42Å; V78-F216 HydrophobicContact CB-CE2 3.65Å; V78-F216 HydrophobicContact CB-CZ 4.02Å; V78-F216 HydrophobicContact CG1-CD2 4.15Å; V78-F216 HydrophobicContact CG1-CE2 3.6Å; V78-F216 HydrophobicContact CG1-CZ 4.44Å; V78-F216 HydrophobicContact CG2-CE2 4.04Å; V78-F216 HydrophobicContact CG2-CZ 4.12Å; L87-F216 HydrophobicContact CB-CE2 3.74Å; L87-F216 HydrophobicContact CB-CZ 4.33Å; L87-F216 HydrophobicContact CD1-CE2 4.33Å; V90-F216 HydrophobicContact CG2-CD1 4.23Å; V90-F216 HydrophobicContact CG2-CE1 3.44Å; V90-F216 VanDerWaalsContact CG2-CE1 3.44Å; V90-F216 HydrophobicContact CG2-CZ 3.65Å; I141-F216 HydrophobicContact CG2-CB 3.92Å; T214-F216 VanDerWaalsContact C-N 3.29Å; T214-F216 PolarHBondContact O-N 3.45Å; F216-A218 VanDerWaalsContact C-N 3.31Å; F216-A218 PolarHBondContact O-N 3.44Å; F216-L219 PolarHBondContact O-N 3.2Å; F216-A220 WeakPolarHBondContact O-CB 3.18Å; F216-A220 PolarHBondContact O-N 2.85Å
217	S	94	Very high	96.7	Very high	4 Å²	4	15.8 Å²	15.8	3%	0.028	9%	0.085	C	C	.	.	H	α-helix	trans	-65	-38.3	179.7	-34	0	0	0	0	111.3	I141 P188 P215 L219 A220 L221	I141-S217 PolarHBondContact O-OG 3.46Å; P188-S217 WeakPolarHBondContact CG-OG 3.39Å; P215-S217 VanDerWaalsContact C-N 3.33Å; P215-S217 PolarHBondContact O-N 2.89Å; S217-L219 VanDerWaalsContact C-N 3.32Å; S217-L219 PolarHBondContact O-N 3.49Å; S217-A220 PolarHBondContact O-N 3.1Å; S217-L221 VanDerWaalsContact O-CG 3.3Å; S217-L221 WeakPolarHBondContact O-CG 3.39Å; S217-L221 PolarHBondContact O-N 3.37Å
218	A	96.9	Very high	96.6	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.2	-37.1	175.9	0	0	0	0	0	112.5	I192 P210 P215 F216 L221 A222 Y235 V237	I192-A218 HydrophobicContact CD1-CB 3.37Å; P210-A218 HydrophobicContact CB-CB 3.76Å; P210-A218 HydrophobicContact CG-CB 3.94Å; P215-A218 WeakPolarHBondContact O-CB 3.07Å; P215-A218 PolarHBondContact O-N 2.98Å; F216-A218 VanDerWaalsContact C-N 3.31Å; F216-A218 PolarHBondContact O-N 3.44Å; A218-L221 WeakPolarHBondContact O-CB 3.23Å; A218-A222 PolarHBondContact O-N 2.91Å; A218-Y235 PolarHBondContact O-OH 2.8Å; A218-V237 HydrophobicContact CB-CG1 3.8Å
219	L	97.3	Very high	96.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-78.1	-38.1	179.3	-55.7	174.1	0	0	0	111.7	R60 D62 W69 V90 P215 F216 S217 L221 A222 E223 V237 P239	R60-L219 HydrophobicContact CB-CB 3.87Å; R60-L219 HydrophobicContact CB-CD1 4.34Å; R60-L219 WeakPolarHBondContact O-CD1 3.34Å; D62-L219 WeakPolarHBondContact O-CD2 3.47Å; W69-L219 HydrophobicContact CH2-CB 4.19Å; W69-L219 WeakPolarHBondContact CH2-O 3.06Å; W69-L219 HydrophobicContact CZ3-CB 4.13Å; W69-L219 HydrophobicContact CZ3-CD2 4.02Å; V90-L219 HydrophobicContact CG1-CD1 4.28Å; P215-L219 WeakPolarHBondContact O-CG 3.47Å; P215-L219 PolarHBondContact O-N 3.31Å; F216-L219 PolarHBondContact O-N 3.2Å; S217-L219 VanDerWaalsContact C-N 3.32Å; S217-L219 PolarHBondContact O-N 3.49Å; L219-L221 PolarHBondContact O-N 3.35Å; L219-A222 WeakPolarHBondContact O-CA 3.27Å; L219-A222 WeakPolarHBondContact O-CB 3.41Å; L219-A222 PolarHBondContact O-N 3.43Å; L219-E223 PolarHBondContact O-N 3.28Å; L219-V237 HydrophobicContact CD2-CB 3.85Å; L219-V237 HydrophobicContact CD2-CG1 3.56Å; L219-V237 HydrophobicContact CG-CG1 4.46Å; L219-P239 HydrophobicContact CD1-CG 4.16Å; L219-P239 HydrophobicContact CD2-CG 3.87Å; L219-P239 HydrophobicContact CG-CG 4.35Å
220	A	96.2	Very high	96.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.6	-40.1	170.6	0	0	0	0	0	111	L58 L138 I141 F216 S217 A222 E223 L224	L58-A220 HydrophobicContact CB-CB 4.37Å; L58-A220 WeakPolarHBondContact O-CA 2.87Å; L58-A220 WeakPolarHBondContact O-CB 3.36Å; L138-A220 HydrophobicContact CD2-CB 3.77Å; I141-A220 HydrophobicContact CD1-CB 4.38Å; F216-A220 WeakPolarHBondContact O-CB 3.18Å; F216-A220 PolarHBondContact O-N 2.85Å; S217-A220 PolarHBondContact O-N 3.1Å; A220-A222 VanDerWaalsContact C-N 3.31Å; A220-A222 PolarHBondContact O-N 3Å; A220-E223 PolarHBondContact O-N 3.46Å; A220-L224 WeakPolarHBondContact O-CG 3.27Å; A220-L224 PolarHBondContact O-N 3.33Å
221	L	97	Very high	96.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-36.7	171.7	-74	172.3	0	0	0	112.4	W127 M131 I192 T193 S217 A218 L219 L224 A225 Y235	W127-L221 HydrophobicContact CZ2-CB 4.07Å; W127-L221 HydrophobicContact CZ2-CD2 4.39Å; W127-L221 VanDerWaalsContact CZ2-O 3.28Å; W127-L221 WeakPolarHBondContact CZ2-O 3.38Å; W127-L221 PolarHBondContact NE1-O 3.34Å; W127-L221 VanDerWaalsContact NE1-O 3.15Å; M131-L221 HydrophobicContact CE-CD2 3.89Å; M131-L221 HydrophobicContact CG-CD2 4.23Å; M131-L221 HydrophobicContact SD-CD2 3.85Å; I192-L221 HydrophobicContact CB-CD1 4.13Å; I192-L221 HydrophobicContact CD1-CD1 4.41Å; I192-L221 HydrophobicContact CG2-CD1 4.02Å; T193-L221 HydrophobicContact CG2-CD1 3.85Å; T193-L221 HydrophobicContact CG2-CD2 3.94Å; S217-L221 VanDerWaalsContact O-CG 3.3Å; S217-L221 WeakPolarHBondContact O-CG 3.39Å; S217-L221 PolarHBondContact O-N 3.37Å; A218-L221 WeakPolarHBondContact O-CB 3.23Å; L219-L221 PolarHBondContact O-N 3.35Å; L221-L224 PolarHBondContact O-N 3.14Å; L221-A225 VanDerWaalsContact O-CB 3.32Å; L221-A225 WeakPolarHBondContact O-CB 3.44Å; L221-A225 PolarHBondContact O-N 3.42Å; L221-Y235 HydrophobicContact CB-CE1 4.4Å
222	A	98.1	Very high	96.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-43	175.1	0	0	0	0	0	112.7	F64 W69 A218 L219 A220 L224 A225 S226 Y235 V237	F64-A222 HydrophobicContact CB-CB 3.73Å; F64-A222 HydrophobicContact CD1-CB 3.59Å; F64-A222 HydrophobicContact CD2-CB 4.08Å; F64-A222 HydrophobicContact CE1-CB 4.14Å; F64-A222 HydrophobicContact CG-CB 3.53Å; W69-A222 HydrophobicContact CH2-CB 3.71Å; W69-A222 HydrophobicContact CZ2-CB 4.28Å; W69-A222 HydrophobicContact CZ3-CB 4.46Å; A218-A222 PolarHBondContact O-N 2.91Å; L219-A222 WeakPolarHBondContact O-CA 3.27Å; L219-A222 WeakPolarHBondContact O-CB 3.41Å; L219-A222 PolarHBondContact O-N 3.43Å; A220-A222 VanDerWaalsContact C-N 3.31Å; A220-A222 PolarHBondContact O-N 3Å; A222-L224 VanDerWaalsContact C-N 3.33Å; A222-L224 PolarHBondContact O-N 2.91Å; A222-A225 WeakPolarHBondContact O-CB 3.22Å; A222-A225 PolarHBondContact O-N 3.4Å; A222-S226 PolarHBondContact O-N 3.27Å; A222-Y235 VanDerWaalsContact CA-CE1 3.44Å; A222-Y235 HydrophobicContact CB-CD1 3.93Å; A222-Y235 HydrophobicContact CB-CE1 3.59Å; A222-V237 HydrophobicContact CB-CG2 4.13Å
223	E	97.8	Very high	96.8	Very high	17 Å²	17	22.1 Å²	22.1	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-56	-51.6	173.6	175.5	62.6	-151.8	0	0	110.1	A57 L58 R60 W69 L219 A220 A225 S226 Q227	A57-E223 HydrophobicContact CB-CG 4.24Å; A57-E223 VanDerWaalsContact O-CG 3.3Å; A57-E223 WeakPolarHBondContact O-CG 3.48Å; L58-E223 HydrophobicContact CD2-CB 4.43Å; L58-E223 HydrophobicContact CD2-CG 4.13Å; R60-E223 IonicContact CZ-OE2 3.45Å; R60-E223 IonicContact NE-OE2 3.36Å; R60-E223 PolarHBondContact NE-OE2 2.92Å; R60-E223 IonicContact NH2-OE2 2.73Å; R60-E223 PolarHBondContact NH2-OE2 2.9Å; W69-E223 HydrophobicContact CZ2-CB 4.01Å; L219-E223 PolarHBondContact O-N 3.28Å; A220-E223 PolarHBondContact O-N 3.46Å; E223-A225 VanDerWaalsContact C-N 3.32Å; E223-A225 PolarHBondContact O-N 3.38Å; E223-S226 WeakPolarHBondContact O-CB 3.17Å; E223-S226 PolarHBondContact O-N 3.16Å; E223-S226 VanDerWaalsContact O-N 3.15Å; E223-S226 PolarHBondContact O-OG 2.95Å; E223-Q227 WeakPolarHBondContact O-CG 3.44Å; E223-Q227 PolarHBondContact O-N 3.42Å; E223-Q227 VanDerWaalsContact O-N 3.07Å; E223-Q227 PolarHBondContact OE1-NE2 3.26Å
224	L	97.3	Very high	97.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-32.6	179.8	-63.4	-174.7	0	0	0	112.8	L58 L130 M131 L138 A220 L221 A222 S226 Q227 A228	L58-L224 HydrophobicContact CD2-CD1 4.4Å; L58-L224 HydrophobicContact CD2-CD2 3.63Å; L58-L224 HydrophobicContact CD2-CG 3.84Å; L130-L224 HydrophobicContact CB-CB 4.48Å; L130-L224 HydrophobicContact CB-CD2 4.21Å; M131-L224 HydrophobicContact CB-CD1 4.47Å; M131-L224 HydrophobicContact CG-CD1 3.9Å; L138-L224 HydrophobicContact CD1-CD1 3.81Å; L138-L224 HydrophobicContact CD2-CD1 4.22Å; L138-L224 HydrophobicContact CG-CD1 4.37Å; A220-L224 WeakPolarHBondContact O-CG 3.27Å; A220-L224 PolarHBondContact O-N 3.33Å; L221-L224 PolarHBondContact O-N 3.14Å; A222-L224 VanDerWaalsContact C-N 3.33Å; A222-L224 PolarHBondContact O-N 2.91Å; L224-S226 VanDerWaalsContact C-N 3.32Å; L224-S226 PolarHBondContact O-N 3.33Å; L224-Q227 PolarHBondContact O-N 3.18Å; L224-A228 VanDerWaalsContact O-CB 3.32Å; L224-A228 WeakPolarHBondContact O-CB 3.32Å; L224-A228 PolarHBondContact O-N 3.24Å
225	A	98.1	Very high	97.4	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-42.8	173.7	0	0	0	0	0	110.8	W127 L221 A222 E223 A228 G229 I230 Y235	W127-A225 HydrophobicContact CD2-CB 4.2Å; W127-A225 HydrophobicContact CH2-CB 4.16Å; W127-A225 HydrophobicContact CZ2-CB 3.67Å; L221-A225 VanDerWaalsContact O-CB 3.32Å; L221-A225 WeakPolarHBondContact O-CB 3.44Å; L221-A225 PolarHBondContact O-N 3.42Å; A222-A225 WeakPolarHBondContact O-CB 3.22Å; A222-A225 PolarHBondContact O-N 3.4Å; E223-A225 VanDerWaalsContact C-N 3.32Å; E223-A225 PolarHBondContact O-N 3.38Å; A225-A228 PolarHBondContact O-N 2.64Å; A225-G229 PolarHBondContact O-N 2.87Å; A225-I230 HydrophobicContact CB-CB 4.1Å; A225-I230 HydrophobicContact CB-CG1 4.04Å; A225-I230 VanDerWaalsContact O-CB 3.26Å; A225-I230 WeakPolarHBondContact O-CB 3.49Å; A225-I230 WeakPolarHBondContact O-CG1 3.42Å; A225-I230 PolarHBondContact O-N 2.79Å; A225-Y235 HydrophobicContact CB-CD1 4.1Å
226	S	97.7	Very high	97.6	Very high	50 Å²	50	18.4 Å²	18.4	35%	0.35	12%	0.119	S	C	.	.	H	α-helix	trans	-64.4	-44	177.3	79.4	0	0	0	0	111.7	A222 E223 L224 A228 G229	A222-S226 PolarHBondContact O-N 3.27Å; E223-S226 WeakPolarHBondContact O-CB 3.17Å; E223-S226 PolarHBondContact O-N 3.16Å; E223-S226 VanDerWaalsContact O-N 3.15Å; E223-S226 PolarHBondContact O-OG 2.95Å; L224-S226 VanDerWaalsContact C-N 3.32Å; L224-S226 PolarHBondContact O-N 3.33Å; S226-A228 VanDerWaalsContact C-N 3.3Å; S226-A228 PolarHBondContact O-N 3.41Å; S226-G229 PolarHBondContact O-N 3.29Å
227	Q	97.6	Very high	97.8	Very high	95 Å²	95	17.7 Å²	17.7	44%	0.444	12%	0.116	S	C	.	.	H	α-helix	trans	-64.2	-34.5	176.5	-67.9	179	21.8	0	0	112.3	L130 E223 L224 G229	L130-Q227 HydrophobicContact CD1-CB 3.71Å; E223-Q227 WeakPolarHBondContact O-CG 3.44Å; E223-Q227 PolarHBondContact O-N 3.42Å; E223-Q227 VanDerWaalsContact O-N 3.07Å; E223-Q227 PolarHBondContact OE1-NE2 3.26Å; L224-Q227 PolarHBondContact O-N 3.18Å; Q227-G229 PolarHBondContact O-N 3.2Å
228	A	96.8	Very high	98	Very high	5 Å²	5	17.5 Å²	17.5	4%	0.041	11%	0.114	C	C	.	.	H	α-helix	trans	-68.5	-15.1	175.1	0	0	0	0	0	113.3	L123 K126 W127 L130 L224 A225 S226 I230	L123-A228 WeakPolarHBondContact CD2-O 2.95Å; K126-A228 HydrophobicContact CB-CB 4.17Å; W127-A228 HydrophobicContact CB-CB 3.69Å; W127-A228 HydrophobicContact CG-CB 4.24Å; L130-A228 HydrophobicContact CD1-CB 3.88Å; L224-A228 VanDerWaalsContact O-CB 3.32Å; L224-A228 WeakPolarHBondContact O-CB 3.32Å; L224-A228 PolarHBondContact O-N 3.24Å; A225-A228 PolarHBondContact O-N 2.64Å; S226-A228 VanDerWaalsContact C-N 3.3Å; S226-A228 PolarHBondContact O-N 3.41Å; A228-I230 HydrophobicContact CB-CG1 4.32Å
229	G	98.3	Very high	98.1	Very high	41 Å²	41	17.6 Å²	17.6	42%	0.423	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	21.9	-174.5	0	0	0	0	0	113.8	A225 S226 Q227 P231	A225-G229 PolarHBondContact O-N 2.87Å; S226-G229 PolarHBondContact O-N 3.29Å; Q227-G229 PolarHBondContact O-N 3.2Å; G229-P231 WeakPolarHBondContact O-CD 3.43Å
230	I	98.4	Very high	98.1	Very high	15 Å²	15	17.6 Å²	17.6	8%	0.077	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-60	123.6	171.8	-63.2	-69.5	0	0	0	108.3	L123 W127 L200 A225 A228 V234	L123-I230 HydrophobicContact CB-CD1 3.92Å; W127-I230 HydrophobicContact CE3-CD1 4.33Å; W127-I230 HydrophobicContact CE3-CG1 4.27Å; L200-I230 HydrophobicContact CD2-CD1 4.18Å; A225-I230 HydrophobicContact CB-CB 4.1Å; A225-I230 HydrophobicContact CB-CG1 4.04Å; A225-I230 VanDerWaalsContact O-CB 3.26Å; A225-I230 WeakPolarHBondContact O-CB 3.49Å; A225-I230 WeakPolarHBondContact O-CG1 3.42Å; A225-I230 PolarHBondContact O-N 2.79Å; A228-I230 HydrophobicContact CB-CG1 4.32Å; I230-V234 HydrophobicContact CG2-CB 3.74Å; I230-V234 HydrophobicContact CG2-CG1 3.82Å
231	P	98.8	Very high	98.2	Very high	57 Å²	57	18.2 Å²	18.2	37%	0.37	12%	0.119	S	C	.	.	P	Polyproline II helix	trans	-60.3	147.3	-173.9	-26.1	34.5	0	0	0	113.4	W112 G229 G233 V234	W112-P231 HydrophobicContact CE3-CG 4.02Å; W112-P231 HydrophobicContact CZ3-CG 3.95Å; G229-P231 WeakPolarHBondContact O-CD 3.43Å; P231-G233 PolarHBondContact O-N 3.36Å; P231-V234 HydrophobicContact CB-CG2 3.91Å; P231-V234 HydrophobicContact CG-CG2 4.3Å; P231-V234 WeakPolarHBondContact O-CB 3.4Å; P231-V234 WeakPolarHBondContact O-CG2 3.36Å; P231-V234 PolarHBondContact O-N 2.97Å
232	S	98.8	Very high	98.1	Very high	82 Å²	82	26.4 Å²	26.4	57%	0.573	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.9	127.8	174.5	-71.8	0	0	0	0	112.1	G66 A108 V234	G66-S232 VanDerWaalsContact O-CB 3.25Å; G66-S232 WeakPolarHBondContact O-CB 3.39Å; G66-S232 PolarHBondContact O-OG 3.01Å; A108-S232 WeakPolarHBondContact CB-O 3.42Å; S232-V234 VanDerWaalsContact C-N 3.33Å
233	G	98.6	Very high	98.1	Very high	2 Å²	2	35.1 Å²	35.1	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-8	178.7	0	0	0	0	0	114.9	A105 P231 N236	A105-G233 VanDerWaalsContact CA-O 3.31Å; A105-G233 WeakPolarHBondContact CA-O 3.18Å; P231-G233 PolarHBondContact O-N 3.36Å; G233-N236 PolarHBondContact O-ND2 3.38Å
234	V	98.9	Very high	98.1	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-41.2	177.1	173.6	0	0	0	0	111.8	A108 W112 L200 T205 V206 I230 P231 S232	A108-V234 HydrophobicContact CB-CG2 4.25Å; W112-V234 HydrophobicContact CB-CG2 4.02Å; W112-V234 HydrophobicContact CD2-CG1 4.13Å; W112-V234 HydrophobicContact CD2-CG2 3.94Å; W112-V234 HydrophobicContact CE3-CG2 4.07Å; W112-V234 HydrophobicContact CG-CG1 4.31Å; W112-V234 HydrophobicContact CG-CG2 3.92Å; W112-V234 HydrophobicContact CZ2-CG1 4.39Å; L200-V234 HydrophobicContact CD1-CG1 3.93Å; L200-V234 HydrophobicContact CD2-CG1 3.86Å; L200-V234 HydrophobicContact CG-CG1 3.65Å; T205-V234 HydrophobicContact CG2-CB 4.26Å; T205-V234 HydrophobicContact CG2-CG1 4.3Å; T205-V234 HydrophobicContact CG2-CG2 4.09Å; V206-V234 PolarHBondContact N-O 3.48Å; I230-V234 HydrophobicContact CG2-CB 3.74Å; I230-V234 HydrophobicContact CG2-CG1 3.82Å; P231-V234 HydrophobicContact CB-CG2 3.91Å; P231-V234 HydrophobicContact CG-CG2 4.3Å; P231-V234 WeakPolarHBondContact O-CB 3.4Å; P231-V234 WeakPolarHBondContact O-CG2 3.36Å; P231-V234 PolarHBondContact O-N 2.97Å; S232-V234 VanDerWaalsContact C-N 3.33Å
235	Y	98.9	Very high	98.1	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.1	173.6	-178.9	-107.1	0	0	0	109.2	F64 W127 I192 V196 V206 V208 A218 L221 A222 A225 V237	F64-Y235 HydrophobicContact CD1-CD1 4.44Å; F64-Y235 VanDerWaalsContact CD1-O 3.31Å; F64-Y235 WeakPolarHBondContact CD1-O 3.42Å; F64-Y235 WeakPolarHBondContact CE1-O 3.47Å; W127-Y235 HydrophobicContact CH2-CD1 4.4Å; W127-Y235 AromaticContact CH2-CD2 3.91Å; W127-Y235 HydrophobicContact CH2-CD2 3.91Å; W127-Y235 HydrophobicContact CH2-CE2 4.07Å; W127-Y235 HydrophobicContact CH2-CG 4.08Å; W127-Y235 HydrophobicContact CZ2-CE1 4.45Å; I192-Y235 HydrophobicContact CG2-CE2 4.19Å; V196-Y235 HydrophobicContact CG1-CD2 3.68Å; V196-Y235 HydrophobicContact CG1-CE2 3.91Å; V196-Y235 HydrophobicContact CG2-CD2 4.44Å; V196-Y235 HydrophobicContact CG2-CE2 4.07Å; V206-Y235 HydrophobicContact CG2-CD2 3.63Å; V206-Y235 HydrophobicContact CG2-CE2 4.36Å; V206-Y235 HydrophobicContact CG2-CG 4.5Å; V208-Y235 HydrophobicContact CG2-CD2 4.26Å; V208-Y235 HydrophobicContact CG2-CE2 3.64Å; A218-Y235 PolarHBondContact O-OH 2.8Å; L221-Y235 HydrophobicContact CB-CE1 4.4Å; A222-Y235 VanDerWaalsContact CA-CE1 3.44Å; A222-Y235 HydrophobicContact CB-CD1 3.93Å; A222-Y235 HydrophobicContact CB-CE1 3.59Å; A225-Y235 HydrophobicContact CB-CD1 4.1Å; Y235-V237 HydrophobicContact CD1-CG2 4.11Å; Y235-V237 HydrophobicContact CE1-CG2 3.34Å; Y235-V237 HydrophobicContact CE2-CG2 4.4Å
236	N	98.9	Very high	98.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.3	178.7	-48.7	-90	0	0	0	109.4	F64 G66 A101 V206 V208 G233	F64-N236 CarbonylContact O-C 3.12Å; F64-N236 WeakPolarHBondContact O-CA 3.49Å; G66-N236 PolarHBondContact N-OD1 2.85Å; A101-N236 HydrophobicContact CB-CB 4.42Å; V206-N236 PolarHBondContact O-N 3.46Å; V206-N236 PolarHBondContact O-ND2 3.5Å; V208-N236 WeakPolarHBondContact CB-O 3.38Å; V208-N236 PolarHBondContact N-O 2.74Å; G233-N236 PolarHBondContact O-ND2 3.38Å
237	V	98.9	Very high	98.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.6	-179.4	-170.3	0	0	0	0	109.3	S63 F64 V208 P210 A218 L219 A222 Y235 P239	S63-V237 WeakPolarHBondContact CB-O 3.16Å; F64-V237 HydrophobicContact CB-CB 4.32Å; F64-V237 PolarHBondContact N-O 3.09Å; F64-V237 PolarHBondContact O-N 3.07Å; V208-V237 HydrophobicContact CB-CG2 4.46Å; V208-V237 WeakPolarHBondContact O-CA 3.38Å; P210-V237 HydrophobicContact CG-CG1 4.04Å; A218-V237 HydrophobicContact CB-CG1 3.8Å; L219-V237 HydrophobicContact CD2-CB 3.85Å; L219-V237 HydrophobicContact CD2-CG1 3.56Å; L219-V237 HydrophobicContact CG-CG1 4.46Å; A222-V237 HydrophobicContact CB-CG2 4.13Å; Y235-V237 HydrophobicContact CD1-CG2 4.11Å; Y235-V237 HydrophobicContact CE1-CG2 3.34Å; Y235-V237 HydrophobicContact CE2-CG2 4.4Å; V237-P239 HydrophobicContact CG1-CG 4.33Å
238	I	98.8	Very high	98.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.			trans	-123.1	82.5	-179.8	47.6	167.2	0	0	0	110	V65 C93 A98 A101 V207 V208 K209 V248 I252	V65-I238 HydrophobicContact CG2-CG2 3.99Å; C93-I238 HydrophobicContact CB-CB 4.17Å; A98-I238 HydrophobicContact CB-CD1 3.95Å; A101-I238 HydrophobicContact CB-CG2 3.76Å; V207-I238 HydrophobicContact CG1-CD1 3.53Å; V207-I238 HydrophobicContact CG1-CG1 3.8Å; V208-I238 WeakPolarHBondContact O-CG1 3.3Å; V208-I238 PolarHBondContact O-N 3.22Å; K209-I238 HydrophobicContact CB-CG1 4.38Å; I238-V248 HydrophobicContact CD1-CG1 3.92Å; I238-I252 HydrophobicContact CD1-CG2 3.9Å
239	P	98.8	Very high	98.3	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	23%	0.226	C	C	.	.			trans	-61.2	143.3	174.3	-16.9	30.9	0	0	0	110.5	F76 V90 A91 C93 P210 P215 L219 V237	F76-P239 HydrophobicContact CE1-CB 4.05Å; F76-P239 HydrophobicContact CZ-CB 4.09Å; V90-P239 HydrophobicContact CG1-CB 3.56Å; V90-P239 HydrophobicContact CG1-CG 3.82Å; A91-P239 CarbonylContact O-C 3.53Å; C93-P239 VanDerWaalsContact CB-O 3.24Å; C93-P239 WeakPolarHBondContact CB-O 3.2Å; C93-P239 PolarHBondContact N-O 3.36Å; C93-P239 PolarHBondContact SG-O 2.9Å; P210-P239 HydrophobicContact CG-CB 4.38Å; P210-P239 HydrophobicContact CG-CG 4.43Å; P215-P239 HydrophobicContact CB-CB 4.12Å; P215-P239 HydrophobicContact CB-CG 4.47Å; L219-P239 HydrophobicContact CD1-CG 4.16Å; L219-P239 HydrophobicContact CD2-CG 3.87Å; L219-P239 HydrophobicContact CG-CG 4.35Å; V237-P239 HydrophobicContact CG1-CG 4.33Å
240	C	98.4	Very high	98.3	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.007	23%	0.227	C	C	.	.			trans	-153.4	151.8	170	80.4	0	0	0	0	110.6	D92 C93 K209 N244 V248	D92-C240 VanDerWaalsContact OD1-CA 3.27Å; D92-C240 WeakPolarHBondContact OD1-CA 3.14Å; D92-C240 WeakPolarHBondContact OD1-CB 3.41Å; C93-C240 HydrophobicContact CB-CB 4.48Å; C93-C240 WeakPolarHBondContact O-CB 3.44Å; K209-C240 WeakPolarHBondContact CE-SG 3.13Å; C240-N244 HydrophobicContact CB-CB 3.82Å; C240-V248 HydrophobicContact CB-CG2 4.13Å
241	S	98	Very high	98.3	Very high	13 Å²	13	46 Å²	46	9%	0.091	23%	0.226	C	C	.	.			trans	-71.6	170.4	179.9	72.4	0	0	0	0	112	D92 K243 N244 A245	D92-S241 PolarHBondContact OD1-N 3.1Å; D92-S241 PolarHBondContact OD1-OG 3.11Å; D92-S241 VanDerWaalsContact OD2-CB 3.24Å; D92-S241 WeakPolarHBondContact OD2-CB 3.49Å; D92-S241 PolarHBondContact OD2-OG 2.91Å; S241-K243 PolarHBondContact O-N 3.02Å; S241-K243 VanDerWaalsContact O-N 3.11Å; S241-K243 PolarHBondContact OG-N 3.47Å; S241-N244 PolarHBondContact O-N 2.76Å; S241-N244 VanDerWaalsContact O-N 3.07Å; S241-A245 PolarHBondContact O-N 3.45Å
242	R	94.9	Very high	98.4	Very high	171 Å²	171	43.2 Å²	43.2	65%	0.645	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-33.1	172.8	-171.4	177.6	175.9	130.8	4.5	113.5	E212	E212-R242 WeakPolarHBondContact OE1-CA 3.21Å; E212-R242 VanDerWaalsContact OE1-CB 3.3Å; E212-R242 WeakPolarHBondContact OE1-CB 3.39Å
243	K	97	Very high	98.4	Very high	183 Å²	183	39.3 Å²	39.3	80%	0.796	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-45.8	179.5	-66.4	-178.6	179.4	179.5	0	110.8	S241	S241-K243 PolarHBondContact O-N 3.02Å; S241-K243 VanDerWaalsContact O-N 3.11Å; S241-K243 PolarHBondContact OG-N 3.47Å
244	N	98.2	Very high	98.4	Very high	34 Å²	34	41.6 Å²	41.6	18%	0.182	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-14.5	-178.3	-71.6	-7.9	0	0	0	113.3	D92 C93 C240 S241 K246 E247 V248	D92-N244 PolarHBondContact OD1-ND2 3.26Å; D92-N244 PolarHBondContact OD2-ND2 2.73Å; C93-N244 PolarHBondContact O-ND2 3.31Å; C240-N244 HydrophobicContact CB-CB 3.82Å; S241-N244 PolarHBondContact O-N 2.76Å; S241-N244 VanDerWaalsContact O-N 3.07Å; N244-K246 VanDerWaalsContact C-N 3.28Å; N244-K246 PolarHBondContact O-N 2.72Å; N244-K246 VanDerWaalsContact O-N 3.17Å; N244-E247 PolarHBondContact O-N 3.38Å; N244-V248 HydrophobicContact CB-CG2 4.17Å; N244-V248 WeakPolarHBondContact O-CB 3.41Å; N244-V248 WeakPolarHBondContact O-CG2 3.3Å; N244-V248 PolarHBondContact O-N 3.29Å
245	A	97.9	Very high	98.4	Very high	26 Å²	26	42.5 Å²	42.5	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-54.2	-39.7	-174.2	0	0	0	0	0	114	S241 G249	S241-A245 PolarHBondContact O-N 3.45Å; A245-G249 PolarHBondContact O-N 2.77Å
246	K	98.1	Very high	98.4	Very high	177 Å²	177	47.8 Å²	47.8	77%	0.77	23%	0.234	S	C	*	.	H	α-helix	trans	-66.2	-54.5	177.5	-68.6	-174.7	178.7	-176.5	0	111.4	N244 V248 G249 E250	N244-K246 VanDerWaalsContact C-N 3.28Å; N244-K246 PolarHBondContact O-N 2.72Å; N244-K246 VanDerWaalsContact O-N 3.17Å; K246-V248 PolarHBondContact O-N 3.08Å; K246-G249 PolarHBondContact O-N 3.5Å; K246-E250 WeakPolarHBondContact O-CB 3.03Å; K246-E250 PolarHBondContact O-N 2.84Å
247	E	98.5	Very high	98.4	Very high	108 Å²	108	50.1 Å²	50.1	51%	0.505	25%	0.246	S	C	.	.	H	α-helix	trans	-65.8	-40.4	-175.6	-60.4	-178.7	168.5	0	0	112.1	V95 N244 A251	V95-E247 HydrophobicContact CG2-CB 3.77Å; N244-E247 PolarHBondContact O-N 3.38Å; E247-A251 VanDerWaalsContact O-CB 3.28Å; E247-A251 WeakPolarHBondContact O-CB 3.39Å; E247-A251 PolarHBondContact O-N 2.8Å
248	V	98.8	Very high	98.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-45.2	176.3	172.6	0	0	0	0	110.9	C93 A98 K209 I238 C240 N244 K246 A251 I252	C93-V248 VanDerWaalsContact O-CG2 3.29Å; C93-V248 WeakPolarHBondContact O-CG2 3.45Å; A98-V248 HydrophobicContact CB-CG1 4.18Å; K209-V248 HydrophobicContact CG-CG1 4.02Å; I238-V248 HydrophobicContact CD1-CG1 3.92Å; C240-V248 HydrophobicContact CB-CG2 4.13Å; N244-V248 HydrophobicContact CB-CG2 4.17Å; N244-V248 WeakPolarHBondContact O-CB 3.41Å; N244-V248 WeakPolarHBondContact O-CG2 3.3Å; N244-V248 PolarHBondContact O-N 3.29Å; K246-V248 PolarHBondContact O-N 3.08Å; V248-A251 PolarHBondContact O-N 3.19Å; V248-I252 WeakPolarHBondContact O-CG1 3.25Å; V248-I252 PolarHBondContact O-N 2.83Å; V248-I252 VanDerWaalsContact O-N 3.08Å
249	G	98.6	Very high	98.4	Very high	5 Å²	5	52.3 Å²	52.3	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-46.5	177	0	0	0	0	0	111.9	A245 K246 C253	A245-G249 PolarHBondContact O-N 2.77Å; K246-G249 PolarHBondContact O-N 3.5Å; G249-C253 WeakPolarHBondContact O-CB 3.5Å; G249-C253 PolarHBondContact O-N 3.16Å; G249-C253 PolarHBondContact O-SG 3.2Å
250	E	98.8	Very high	98.4	Very high	96 Å²	96	52.3 Å²	52.3	45%	0.449	26%	0.261	S	S	.	.	H	α-helix	trans	-59.1	-48.4	173.1	178.9	175.3	177.3	0	0	111.2	K246 I252 C253 T254	K246-E250 WeakPolarHBondContact O-CB 3.03Å; K246-E250 PolarHBondContact O-N 2.84Å; E250-I252 PolarHBondContact O-N 2.78Å; E250-C253 PolarHBondContact O-N 3.18Å; E250-T254 HydrophobicContact CG-CG2 4.08Å; E250-T254 VanDerWaalsContact O-CB 3.32Å; E250-T254 WeakPolarHBondContact O-CB 3.27Å; E250-T254 VanDerWaalsContact O-CG2 3.28Å; E250-T254 WeakPolarHBondContact O-CG2 3.49Å; E250-T254 PolarHBondContact O-N 3.07Å; E250-T254 PolarHBondContact O-OG1 3.06Å
251	A	98.9	Very high	98.4	Very high	6 Å²	6	52.2 Å²	52.2	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-57.2	-50.8	-177.3	0	0	0	0	0	112.5	V95 A98 E247 V248 T254 D255	V95-A251 HydrophobicContact CB-CB 4.49Å; V95-A251 HydrophobicContact CG1-CB 3.96Å; V95-A251 HydrophobicContact CG2-CB 4.39Å; A98-A251 HydrophobicContact CB-CB 4.26Å; E247-A251 VanDerWaalsContact O-CB 3.28Å; E247-A251 WeakPolarHBondContact O-CB 3.39Å; E247-A251 PolarHBondContact O-N 2.8Å; V248-A251 PolarHBondContact O-N 3.19Å; A251-T254 PolarHBondContact O-N 3.25Å; A251-T254 PolarHBondContact O-OG1 2.94Å; A251-D255 WeakPolarHBondContact O-CB 3.35Å; A251-D255 PolarHBondContact O-N 3Å
252	I	98.8	Very high	98.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-75	-25.2	-179	67	-177.3	0	0	0	113	A98 V102 A180 I182 V207 K209 I238 V248 E250 V258	A98-I252 HydrophobicContact CB-CG2 3.85Å; V102-I252 HydrophobicContact CG2-CB 4.43Å; V102-I252 HydrophobicContact CG2-CG2 4.02Å; A180-I252 HydrophobicContact CB-CB 4.09Å; A180-I252 HydrophobicContact CB-CD1 4.08Å; A180-I252 HydrophobicContact CB-CG1 3.93Å; I182-I252 HydrophobicContact CD1-CD1 4.09Å; I182-I252 HydrophobicContact CD1-CG1 4.48Å; I182-I252 HydrophobicContact CG1-CD1 4.01Å; V207-I252 HydrophobicContact CG1-CG2 4.34Å; K209-I252 HydrophobicContact CB-CD1 4.07Å; I238-I252 HydrophobicContact CD1-CG2 3.9Å; V248-I252 WeakPolarHBondContact O-CG1 3.25Å; V248-I252 PolarHBondContact O-N 2.83Å; V248-I252 VanDerWaalsContact O-N 3.08Å; E250-I252 PolarHBondContact O-N 2.78Å; I252-V258 WeakPolarHBondContact O-CG2 3.32Å
253	C	98.8	Very high	98.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-85.9	-9.9	177.3	-69.9	0	0	0	0	113.5	G249 E250 I261 H276 K282	G249-C253 WeakPolarHBondContact O-CB 3.5Å; G249-C253 PolarHBondContact O-N 3.16Å; G249-C253 PolarHBondContact O-SG 3.2Å; E250-C253 PolarHBondContact O-N 3.18Å; C253-I261 HydrophobicContact CB-CD1 3.62Å; C253-I261 HydrophobicContact CB-CG1 4.23Å; C253-H276 HydrophobicContact CB-CB 4.01Å; C253-K282 WeakPolarHBondContact O-CD 3.37Å; C253-K282 WeakPolarHBondContact O-CE 3.42Å
254	T	98.9	Very high	98.7	Very high	50 Å²	50	35.4 Å²	35.4	31%	0.307	19%	0.191	S	C	.	.	H	α-helix	trans	-112.7	-20.4	178	57.7	0	0	0	0	113.6	E250 A251 H276	E250-T254 HydrophobicContact CG-CG2 4.08Å; E250-T254 VanDerWaalsContact O-CB 3.32Å; E250-T254 WeakPolarHBondContact O-CB 3.27Å; E250-T254 VanDerWaalsContact O-CG2 3.28Å; E250-T254 WeakPolarHBondContact O-CG2 3.49Å; E250-T254 PolarHBondContact O-N 3.07Å; E250-T254 PolarHBondContact O-OG1 3.06Å; A251-T254 PolarHBondContact O-N 3.25Å; A251-T254 PolarHBondContact O-OG1 2.94Å; T254-H276 HydrophobicContact CG2-CB 3.82Å
255	D	98.9	Very high	98.6	Very high	20 Å²	20	34.8 Å²	34.8	11%	0.107	19%	0.193	C	C	.	.			trans	-55.4	130.4	-178.3	-164.9	-63	0	0	0	111.3	V102 A251 L257 V258 K282	V102-D255 HydrophobicContact CG1-CB 4.18Å; A251-D255 WeakPolarHBondContact O-CB 3.35Å; A251-D255 PolarHBondContact O-N 3Å; D255-L257 PolarHBondContact O-N 3.39Å; D255-L257 WeakPolarHBondContact OD1-CB 3.46Å; D255-L257 PolarHBondContact OD1-N 3.32Å; D255-V258 HydrophobicContact CB-CG2 4.31Å; D255-V258 PolarHBondContact O-N 3.04Å; D255-V258 VanDerWaalsContact O-N 3.09Å; D255-K282 WeakPolarHBondContact O-CE 3.33Å; D255-K282 PolarHBondContact O-NZ 2.91Å
256	P	98.8	Very high	98.4	Very high	113 Å²	113	36.1 Å²	36.1	73%	0.734	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.7	-177	26	-36.2	0	0	0	113.9	V258	P256-V258 VanDerWaalsContact C-N 3.31Å
257	L	98.9	Very high	98.3	Very high	48 Å²	48	29 Å²	29	25%	0.251	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-11.5	176.9	-59.4	-179.5	0	0	0	113.2	V102 R103 Y106 V178 D255	V102-L257 HydrophobicContact CG1-CB 3.72Å; V102-L257 HydrophobicContact CG1-CD1 4.44Å; R103-L257 HydrophobicContact CG-CD1 4.09Å; Y106-L257 HydrophobicContact CD1-CD1 4.3Å; Y106-L257 HydrophobicContact CD1-CD2 4.05Å; Y106-L257 HydrophobicContact CD2-CB 3.94Å; Y106-L257 HydrophobicContact CD2-CD2 3.94Å; Y106-L257 HydrophobicContact CD2-CG 4.4Å; Y106-L257 HydrophobicContact CE1-CD2 4.04Å; Y106-L257 HydrophobicContact CE2-CD2 3.93Å; Y106-L257 HydrophobicContact CG-CB 4.13Å; Y106-L257 HydrophobicContact CG-CD1 4.13Å; Y106-L257 HydrophobicContact CG-CD2 4Å; Y106-L257 HydrophobicContact CG-CG 4.32Å; V178-L257 WeakPolarHBondContact CB-O 3.36Å; D255-L257 PolarHBondContact O-N 3.39Å; D255-L257 WeakPolarHBondContact OD1-CB 3.46Å; D255-L257 PolarHBondContact OD1-N 3.32Å
258	V	98.9	Very high	98.1	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.8	173.7	177.9	0	0	0	0	109.5	V102 V178 A180 I252 D255 P256 K260 K282	V102-V258 HydrophobicContact CB-CG2 4.44Å; V102-V258 HydrophobicContact CG1-CG2 3.71Å; V102-V258 HydrophobicContact CG2-CG2 3.81Å; V178-V258 HydrophobicContact CG1-CG2 4.18Å; A180-V258 HydrophobicContact CB-CG1 3.84Å; I252-V258 WeakPolarHBondContact O-CG2 3.32Å; D255-V258 HydrophobicContact CB-CG2 4.31Å; D255-V258 PolarHBondContact O-N 3.04Å; D255-V258 VanDerWaalsContact O-N 3.09Å; P256-V258 VanDerWaalsContact C-N 3.31Å; V258-K260 VanDerWaalsContact CG1-O 3.3Å; V258-K260 WeakPolarHBondContact CG1-O 3.47Å; V258-K282 HydrophobicContact CG1-CD 4.35Å; V258-K282 WeakPolarHBondContact O-CD 3.49Å; V258-K282 WeakPolarHBondContact O-CE 3.25Å; V258-K282 PolarHBondContact O-NZ 3.43Å
259	S	98.9	Very high	98.1	Very high	45 Å²	45	31.5 Å²	31.5	32%	0.315	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-16.7	-175.2	-54.2	0	0	0	0	113	V178 R283	V178-S259 PolarHBondContact O-N 3.18Å; S259-R283 PolarHBondContact O-N 2.81Å; S259-R283 VanDerWaalsContact O-N 3.08Å
260	K	98.9	Very high	98.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.8	176.3	174.6	70.4	178.6	-162.1	0	110.7	I176 V178 A179 A180 V258 R283 V284 S285 E504 Y505	I176-K260 HydrophobicContact CD1-CD 4.37Å; I176-K260 HydrophobicContact CG2-CB 4.19Å; V178-K260 PolarHBondContact O-N 3.01Å; A179-K260 CarbonylContact C-O 3.49Å; A179-K260 VanDerWaalsContact CA-O 3.24Å; A179-K260 WeakPolarHBondContact CA-O 3.33Å; A179-K260 HydrophobicContact CB-CB 3.88Å; A179-K260 HydrophobicContact CB-CG 3.99Å; A180-K260 PolarHBondContact N-O 3.43Å; V258-K260 VanDerWaalsContact CG1-O 3.3Å; V258-K260 WeakPolarHBondContact CG1-O 3.47Å; K260-R283 CarbonylContact C-O 3.53Å; K260-R283 WeakPolarHBondContact CA-O 3.48Å; K260-R283 HydrophobicContact CD-CB 3.72Å; K260-V284 PolarHBondContact NZ-O 2.94Å; K260-S285 WeakPolarHBondContact CE-OG 3.46Å; K260-S285 PolarHBondContact NZ-OG 2.9Å; K260-E504 WeakPolarHBondContact CD-O 3.21Å; K260-E504 WeakPolarHBondContact CE-O 3.22Å; K260-E504 PolarHBondContact NZ-O 3.21Å; K260-E504 IonicContact NZ-OE2 2.9Å; K260-E504 PolarHBondContact NZ-OE2 3.09Å; K260-Y505 HydrophobicContact CG-CD1 4.15Å; K260-Y505 HydrophobicContact CG-CE1 4.02Å
261	I	98.9	Very high	98	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.4	165.5	-64.7	159.7	0	0	0	108.2	A180 C253 A277 K282 R283 V284 S285	A180-I261 HydrophobicContact CB-CG1 4.41Å; A180-I261 WeakPolarHBondContact O-CA 3.43Å; C253-I261 HydrophobicContact CB-CD1 3.62Å; C253-I261 HydrophobicContact CB-CG1 4.23Å; I261-A277 HydrophobicContact CD1-CB 3.6Å; I261-K282 HydrophobicContact CD1-CB 4.37Å; I261-K282 HydrophobicContact CD1-CD 3.91Å; I261-K282 HydrophobicContact CG1-CD 4.25Å; I261-R283 PolarHBondContact N-O 2.79Å; I261-V284 HydrophobicContact CB-CG2 4.47Å; I261-V284 CarbonylContact O-C 3.5Å; I261-V284 WeakPolarHBondContact O-CA 3.47Å; I261-S285 PolarHBondContact O-N 2.85Å
262	S	98.9	Very high	98	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	114.8	169.8	-175.7	0	0	0	0	109.3	A180 V181 I182 K195 S285 Y505	A180-S262 PolarHBondContact O-N 2.93Å; V181-S262 WeakPolarHBondContact CA-O 3.22Å; I182-S262 PolarHBondContact N-O 3.13Å; K195-S262 VanDerWaalsContact CD-OG 3.26Å; K195-S262 WeakPolarHBondContact CD-OG 3.46Å; K195-S262 WeakPolarHBondContact CG-OG 3.5Å; K195-S262 PolarHBondContact NZ-OG 3.28Å; S262-S285 WeakPolarHBondContact CA-O 3.14Å; S262-Y505 WeakPolarHBondContact CB-OH 3.46Å; S262-Y505 PolarHBondContact OG-OH 3.05Å
263	F	98.8	Very high	98	Very high	10 Å²	10	35.5 Å²	35.5	4%	0.044	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.6	-175.6	170.3	-110	0	0	0	111.1	I182 K195 T269 L273 S285 M286 E287 L288	I182-F263 HydrophobicContact CB-CD2 3.8Å; I182-F263 HydrophobicContact CG2-CD2 3.67Å; I182-F263 HydrophobicContact CG2-CE2 3.94Å; I182-F263 WeakPolarHBondContact O-CA 3.36Å; K195-F263 PolarHBondContact NZ-O 3.06Å; F263-T269 HydrophobicContact CE1-CG2 4.26Å; F263-T269 HydrophobicContact CE2-CG2 3.8Å; F263-T269 HydrophobicContact CZ-CG2 3.51Å; F263-L273 HydrophobicContact CB-CD1 3.93Å; F263-L273 HydrophobicContact CD1-CD1 4.13Å; F263-L273 HydrophobicContact CD2-CD1 3.59Å; F263-L273 HydrophobicContact CE2-CD1 4.09Å; F263-L273 HydrophobicContact CG-CD1 3.6Å; F263-S285 PolarHBondContact N-O 3.01Å; F263-M286 HydrophobicContact CB-CE 4.22Å; F263-M286 HydrophobicContact CB-CG 4.19Å; F263-M286 HydrophobicContact CD1-CE 4.4Å; F263-M286 HydrophobicContact CD1-CG 4.37Å; F263-M286 HydrophobicContact CD1-SD 4.22Å; F263-M286 VanDerWaalsContact O-CA 3.25Å; F263-M286 WeakPolarHBondContact O-CA 3.46Å; F263-E287 PolarHBondContact O-N 3.03Å; F263-L288 HydrophobicContact CD1-CD2 3.65Å; F263-L288 HydrophobicContact CE1-CD2 3.49Å; F263-L288 VanDerWaalsContact CE1-CD2 3.49Å
264	T	98.4	Very high	98	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.1	162.5	-59.5	0	0	0	0	109.2	I182 P184 M191 K195 E287	I182-T264 PolarHBondContact O-N 3.27Å; P184-T264 VanDerWaalsContact CD-O 3.26Å; P184-T264 WeakPolarHBondContact CD-O 3.34Å; P184-T264 HydrophobicContact CG-CG2 3.91Å; M191-T264 HydrophobicContact SD-CG2 3.86Å; K195-T264 WeakPolarHBondContact CE-OG1 3Å; K195-T264 PolarHBondContact NZ-OG1 3.16Å; T264-E287 VanDerWaalsContact CA-O 3.22Å; T264-E287 WeakPolarHBondContact CA-O 3.38Å; T264-E287 HydrophobicContact CG2-CB 3.92Å; T264-E287 HydrophobicContact CG2-CG 4.26Å; T264-E287 WeakPolarHBondContact CG2-OE1 3.39Å
265	G	95.6	Very high	98	Very high	21 Å²	21	42.4 Å²	42.4	22%	0.216	24%	0.242	C	C	.	.	S	Bend	trans	158.3	-152.1	178.7	0	0	0	0	0	113.4	E287 L288 G289	G265-E287 PolarHBondContact N-O 2.72Å; G265-L288 VanDerWaalsContact O-CA 3.29Å; G265-L288 WeakPolarHBondContact O-CA 3.4Å; G265-G289 PolarHBondContact O-N 3.27Å
266	S	94.7	Very high	98	Very high	53 Å²	53	43 Å²	43	37%	0.371	24%	0.244	S	C	.	.			trans	-70.6	148.3	-176.2	69	0	0	0	0	112.7	T268 T269 G270	S266-T268 PolarHBondContact O-N 3.24Å; S266-T269 PolarHBondContact O-N 3.25Å; S266-T269 PolarHBondContact OG-N 3.3Å; S266-T269 PolarHBondContact OG-OG1 3.09Å; S266-G270 PolarHBondContact O-N 2.93Å
267	T	95	Very high	98	Very high	29 Å²	29	37.8 Å²	37.8	18%	0.178	21%	0.21	C	C	.	.	H	α-helix	trans	-56.6	-38	176.7	-51.6	0	0	0	0	112.3	G270 K271 L288	T267-G270 PolarHBondContact O-N 3.05Å; T267-K271 HydrophobicContact CG2-CD 4.41Å; T267-K271 WeakPolarHBondContact O-CG 3.36Å; T267-K271 PolarHBondContact O-N 3.47Å; T267-L288 HydrophobicContact CG2-CD1 4.35Å
268	T	95.4	Very high	98	Very high	102 Å²	102	38.6 Å²	38.6	63%	0.626	22%	0.223	S	C	*	.	H	α-helix	trans	-59.8	-49.8	177	-52.9	0	0	0	0	112.1	S266 K271 I272	S266-T268 PolarHBondContact O-N 3.24Å; T268-K271 PolarHBondContact O-N 3.4Å; T268-I272 WeakPolarHBondContact O-CG1 3.16Å; T268-I272 PolarHBondContact O-N 3Å
269	T	97.8	Very high	98	Very high	58 Å²	58	45 Å²	45	36%	0.356	26%	0.258	S	S	.	.	H	α-helix	trans	-66.7	-40.7	178	-60.3	0	0	0	0	110.6	F263 S266 K271 I272 L273	F263-T269 HydrophobicContact CE1-CG2 4.26Å; F263-T269 HydrophobicContact CE2-CG2 3.8Å; F263-T269 HydrophobicContact CZ-CG2 3.51Å; S266-T269 PolarHBondContact O-N 3.25Å; S266-T269 PolarHBondContact OG-N 3.3Å; S266-T269 PolarHBondContact OG-OG1 3.09Å; T269-K271 VanDerWaalsContact C-N 3.34Å; T269-K271 PolarHBondContact O-N 3.03Å; T269-I272 WeakPolarHBondContact O-CB 3.37Å; T269-I272 PolarHBondContact O-N 2.94Å; T269-I272 VanDerWaalsContact O-N 3.16Å; T269-L273 HydrophobicContact CG2-CD1 4.22Å; T269-L273 HydrophobicContact CG2-CG 4.28Å; T269-L273 WeakPolarHBondContact O-CG 3.47Å; T269-L273 PolarHBondContact O-N 3.35Å
270	G	98.3	Very high	98	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-54.5	-47.4	176.1	0	0	0	0	0	112.8	S266 T267 I272 L273 L274 M286	S266-G270 PolarHBondContact O-N 2.93Å; T267-G270 PolarHBondContact O-N 3.05Å; G270-I272 PolarHBondContact O-N 3.4Å; G270-L273 PolarHBondContact O-N 2.98Å; G270-L274 WeakPolarHBondContact O-CG 3.25Å; G270-L274 PolarHBondContact O-N 3.26Å; G270-M286 WeakPolarHBondContact O-CE 3.36Å
271	K	98.4	Very high	98	Very high	99 Å²	99	51.8 Å²	51.8	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-41	177.1	-72	179	178.8	179.4	0	112.7	T267 T268 T269 L273 L274 H275 Q490	T267-K271 HydrophobicContact CG2-CD 4.41Å; T267-K271 WeakPolarHBondContact O-CG 3.36Å; T267-K271 PolarHBondContact O-N 3.47Å; T268-K271 PolarHBondContact O-N 3.4Å; T269-K271 VanDerWaalsContact C-N 3.34Å; T269-K271 PolarHBondContact O-N 3.03Å; K271-L273 VanDerWaalsContact C-N 3.35Å; K271-L273 PolarHBondContact O-N 3.17Å; K271-L274 PolarHBondContact O-N 3.21Å; K271-H275 PolarHBondContact O-CD2 2.74Å; K271-H275 PolarHBondContact O-N 3.17Å; K271-H275 VanDerWaalsContact O-N 3.09Å; K271-Q490 VanDerWaalsContact CE-OE1 3.32Å
272	I	98.8	Very high	98	Very high	83 Å²	83	52.8 Å²	52.8	43%	0.426	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-46.2	174.7	-66.4	166.1	0	0	0	110.6	T268 T269 G270 L274 H275 H276	T268-I272 WeakPolarHBondContact O-CG1 3.16Å; T268-I272 PolarHBondContact O-N 3Å; T269-I272 WeakPolarHBondContact O-CB 3.37Å; T269-I272 PolarHBondContact O-N 2.94Å; T269-I272 VanDerWaalsContact O-N 3.16Å; G270-I272 PolarHBondContact O-N 3.4Å; I272-L274 VanDerWaalsContact C-N 3.33Å; I272-L274 PolarHBondContact O-N 3.03Å; I272-H275 WeakPolarHBondContact O-CB 3.49Å; I272-H275 PolarHBondContact O-N 3.4Å; I272-H275 VanDerWaalsContact O-N 3.17Å; I272-H276 PolarHBondContact O-CD2 3.43Å; I272-H276 PolarHBondContact O-N 3.15Å; I272-H276 VanDerWaalsContact O-N 3.13Å
273	L	98.8	Very high	98	Very high	8 Å²	8	56.5 Å²	56.5	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-67.4	-33.2	179.6	-61.8	-176.3	0	0	0	112.5	I182 F263 T269 G270 K271 H275 H276 A277 M286	I182-L273 HydrophobicContact CD1-CD1 3.81Å; I182-L273 HydrophobicContact CD1-CD2 4.4Å; F263-L273 HydrophobicContact CB-CD1 3.93Å; F263-L273 HydrophobicContact CD1-CD1 4.13Å; F263-L273 HydrophobicContact CD2-CD1 3.59Å; F263-L273 HydrophobicContact CE2-CD1 4.09Å; F263-L273 HydrophobicContact CG-CD1 3.6Å; T269-L273 HydrophobicContact CG2-CD1 4.22Å; T269-L273 HydrophobicContact CG2-CG 4.28Å; T269-L273 WeakPolarHBondContact O-CG 3.47Å; T269-L273 PolarHBondContact O-N 3.35Å; G270-L273 PolarHBondContact O-N 2.98Å; K271-L273 VanDerWaalsContact C-N 3.35Å; K271-L273 PolarHBondContact O-N 3.17Å; L273-H275 VanDerWaalsContact C-N 3.34Å; L273-H276 PolarHBondContact O-N 2.74Å; L273-A277 WeakPolarHBondContact O-CB 3.42Å; L273-A277 PolarHBondContact O-N 2.99Å; L273-M286 HydrophobicContact CB-CE 3.66Å
274	L	98.8	Very high	98	Very high	59 Å²	59	57.2 Å²	57.2	31%	0.309	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-40.7	171.1	-76	168.6	0	0	0	111.7	G270 K271 I272 H276 A277 A278 V284 M286 L493	G270-L274 WeakPolarHBondContact O-CG 3.25Å; G270-L274 PolarHBondContact O-N 3.26Å; K271-L274 PolarHBondContact O-N 3.21Å; I272-L274 VanDerWaalsContact C-N 3.33Å; I272-L274 PolarHBondContact O-N 3.03Å; L274-H276 VanDerWaalsContact C-N 3.34Å; L274-H276 PolarHBondContact O-N 3.2Å; L274-A277 PolarHBondContact O-N 3.24Å; L274-A278 WeakPolarHBondContact O-CB 3.25Å; L274-A278 PolarHBondContact O-N 3.03Å; L274-V284 HydrophobicContact CD2-CB 4.21Å; L274-V284 HydrophobicContact CD2-CG1 3.77Å; L274-V284 HydrophobicContact CD2-CG2 4.2Å; L274-M286 HydrophobicContact CD1-SD 4.03Å; L274-M286 HydrophobicContact CD2-CE 4.09Å; L274-M286 HydrophobicContact CD2-SD 4.14Å; L274-M286 HydrophobicContact CG-CE 3.78Å; L274-M286 HydrophobicContact CG-SD 3.74Å; L274-L493 HydrophobicContact CD2-CD1 3.94Å
275	H	98.8	Very high	98	Very high	137 Å²	137	57.2 Å²	57.2	63%	0.634	32%	0.323	S	S	*	.	H	α-helix	trans	-61.4	-41.3	173.7	-76	-67.5	0	0	0	112.2	K271 I272 L273 A278	K271-H275 PolarHBondContact O-CD2 2.74Å; K271-H275 PolarHBondContact O-N 3.17Å; K271-H275 VanDerWaalsContact O-N 3.09Å; I272-H275 WeakPolarHBondContact O-CB 3.49Å; I272-H275 PolarHBondContact O-N 3.4Å; I272-H275 VanDerWaalsContact O-N 3.17Å; L273-H275 VanDerWaalsContact C-N 3.34Å; H275-A278 PolarHBondContact O-N 2.94Å
276	H	98.7	Very high	98.1	Very high	32 Å²	32	56.5 Å²	56.5	15%	0.148	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-43.7	174.4	-64.2	-43.2	0	0	0	112.3	C253 T254 I272 L273 L274 A278	C253-H276 HydrophobicContact CB-CB 4.01Å; T254-H276 HydrophobicContact CG2-CB 3.82Å; I272-H276 PolarHBondContact O-CD2 3.43Å; I272-H276 PolarHBondContact O-N 3.15Å; I272-H276 VanDerWaalsContact O-N 3.13Å; L273-H276 PolarHBondContact O-N 2.74Å; L274-H276 VanDerWaalsContact C-N 3.34Å; L274-H276 PolarHBondContact O-N 3.2Å; H276-A278 VanDerWaalsContact C-N 3.32Å; H276-A278 PolarHBondContact O-N 3.2Å
277	A	98.7	Very high	98.3	Very high	3 Å²	3	54.1 Å²	54.1	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-39.7	179.7	0	0	0	0	0	112.6	I261 L273 L274 N279 S280 V281 K282 V284	I261-A277 HydrophobicContact CD1-CB 3.6Å; L273-A277 WeakPolarHBondContact O-CB 3.42Å; L273-A277 PolarHBondContact O-N 2.99Å; L274-A277 PolarHBondContact O-N 3.24Å; A277-N279 VanDerWaalsContact C-N 3.26Å; A277-N279 PolarHBondContact O-N 2.9Å; A277-S280 PolarHBondContact O-N 3.39Å; A277-V281 PolarHBondContact O-N 2.86Å; A277-K282 HydrophobicContact CB-CB 4.29Å; A277-K282 PolarHBondContact O-N 2.88Å; A277-V284 HydrophobicContact CB-CG2 3.57Å
278	A	98.8	Very high	98.3	Very high	65 Å²	65	53.2 Å²	53.2	54%	0.537	29%	0.291	S	S	.	.	H	α-helix	trans	-58.3	-35.9	-175.1	0	0	0	0	0	113	L274 H275 H276 S280 V281	L274-A278 WeakPolarHBondContact O-CB 3.25Å; L274-A278 PolarHBondContact O-N 3.03Å; H275-A278 PolarHBondContact O-N 2.94Å; H276-A278 VanDerWaalsContact C-N 3.32Å; H276-A278 PolarHBondContact O-N 3.2Å; A278-S280 PolarHBondContact O-N 3.21Å; A278-S280 VanDerWaalsContact O-N 3.1Å; A278-V281 PolarHBondContact O-N 3.31Å
279	N	98.6	Very high	97.7	Very high	137 Å²	137	48.5 Å²	48.5	73%	0.733	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.9	-178.7	-67.2	-36.8	0	0	0	114.1	A277	A277-N279 VanDerWaalsContact C-N 3.26Å; A277-N279 PolarHBondContact O-N 2.9Å
280	S	98.6	Very high	96.9	Very high	54 Å²	54	45.8 Å²	45.8	38%	0.378	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.9	17.5	178.9	55.3	0	0	0	0	113	A277 A278 K282	A277-S280 PolarHBondContact O-N 3.39Å; A278-S280 PolarHBondContact O-N 3.21Å; A278-S280 VanDerWaalsContact O-N 3.1Å; S280-K282 PolarHBondContact O-N 3.24Å; S280-K282 VanDerWaalsContact O-N 3.16Å; S280-K282 WeakPolarHBondContact OG-CE 3.29Å; S280-K282 VanDerWaalsContact OG-CG 3.26Å; S280-K282 WeakPolarHBondContact OG-CG 3.49Å; S280-K282 PolarHBondContact OG-NZ 2.93Å
281	V	98.8	Very high	96.4	Very high	134 Å²	134	46.6 Å²	46.6	81%	0.812	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	40.1	176.2	-158.1	0	0	0	0	112.1	A277 A278	A277-V281 PolarHBondContact O-N 2.86Å; A278-V281 PolarHBondContact O-N 3.31Å
282	K	98.8	Very high	96.3	Very high	20 Å²	20	41.9 Å²	41.9	9%	0.087	23%	0.231	C	C	.	.			trans	-67.1	146.1	-179.1	-55.8	-166	-172.3	-53.7	0	110.1	C253 D255 V258 I261 A277 S280 V284	C253-K282 WeakPolarHBondContact O-CD 3.37Å; C253-K282 WeakPolarHBondContact O-CE 3.42Å; D255-K282 WeakPolarHBondContact O-CE 3.33Å; D255-K282 PolarHBondContact O-NZ 2.91Å; V258-K282 HydrophobicContact CG1-CD 4.35Å; V258-K282 WeakPolarHBondContact O-CD 3.49Å; V258-K282 WeakPolarHBondContact O-CE 3.25Å; V258-K282 PolarHBondContact O-NZ 3.43Å; I261-K282 HydrophobicContact CD1-CB 4.37Å; I261-K282 HydrophobicContact CD1-CD 3.91Å; I261-K282 HydrophobicContact CG1-CD 4.25Å; A277-K282 HydrophobicContact CB-CB 4.29Å; A277-K282 PolarHBondContact O-N 2.88Å; S280-K282 PolarHBondContact O-N 3.24Å; S280-K282 VanDerWaalsContact O-N 3.16Å; S280-K282 WeakPolarHBondContact OG-CE 3.29Å; S280-K282 VanDerWaalsContact OG-CG 3.26Å; S280-K282 WeakPolarHBondContact OG-CG 3.49Å; S280-K282 PolarHBondContact OG-NZ 2.93Å; K282-V284 WeakPolarHBondContact O-CG2 3.33Å
283	R	98.8	Very high	96.2	Very high	79 Å²	79	38.1 Å²	38.1	30%	0.298	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	142.6	166.8	-69.6	-76.3	-60	-77.5	-2	108.4	I176 S259 K260 I261 L506 E507	I176-R283 HydrophobicContact CD1-CB 4.14Å; I176-R283 HydrophobicContact CD1-CG 4.05Å; S259-R283 PolarHBondContact O-N 2.81Å; S259-R283 VanDerWaalsContact O-N 3.08Å; K260-R283 CarbonylContact C-O 3.53Å; K260-R283 WeakPolarHBondContact CA-O 3.48Å; K260-R283 HydrophobicContact CD-CB 3.72Å; I261-R283 PolarHBondContact N-O 2.79Å; R283-L506 PolarHBondContact NH1-O 2.88Å; R283-E507 IonicContact CZ-OE1 3.66Å; R283-E507 VanDerWaalsContact NH1-CD 3.35Å; R283-E507 IonicContact NH1-OE1 3.98Å; R283-E507 PolarHBondContact NH1-OE1 2.85Å; R283-E507 IonicContact NH1-OE2 2.63Å
284	V	98.8	Very high	96.2	Very high	25 Å²	25	37.7 Å²	37.7	15%	0.152	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	138.6	-178.5	-176.6	0	0	0	0	110	K260 I261 L274 A277 K282 M286 L493	K260-V284 PolarHBondContact NZ-O 2.94Å; I261-V284 HydrophobicContact CB-CG2 4.47Å; I261-V284 CarbonylContact O-C 3.5Å; I261-V284 WeakPolarHBondContact O-CA 3.47Å; L274-V284 HydrophobicContact CD2-CB 4.21Å; L274-V284 HydrophobicContact CD2-CG1 3.77Å; L274-V284 HydrophobicContact CD2-CG2 4.2Å; A277-V284 HydrophobicContact CB-CG2 3.57Å; K282-V284 WeakPolarHBondContact O-CG2 3.33Å; V284-M286 HydrophobicContact CG1-CE 3.63Å; V284-M286 HydrophobicContact CG1-CG 3.66Å; V284-M286 HydrophobicContact CG1-SD 4.12Å; V284-L493 HydrophobicContact CG1-CD1 4.49Å
285	S	98.8	Very high	96.2	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.028	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.6	157.8	50.4	0	0	0	0	109.2	K260 I261 S262 F263 L493	K260-S285 WeakPolarHBondContact CE-OG 3.46Å; K260-S285 PolarHBondContact NZ-OG 2.9Å; I261-S285 PolarHBondContact O-N 2.85Å; S262-S285 WeakPolarHBondContact CA-O 3.14Å; F263-S285 PolarHBondContact N-O 3.01Å; S285-L493 CarbonylContact C-O 3.55Å; S285-L493 VanDerWaalsContact CA-O 3.25Å; S285-L493 WeakPolarHBondContact CA-O 3.29Å; S285-L493 WeakPolarHBondContact CB-O 3.47Å
286	M	98.3	Very high	96.2	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.03	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.2	-177.7	-65.8	-169.7	168.9	0	0	111	F263 G270 L273 L274 V284 L288 G492 L493	F263-M286 HydrophobicContact CB-CE 4.22Å; F263-M286 HydrophobicContact CB-CG 4.19Å; F263-M286 HydrophobicContact CD1-CE 4.4Å; F263-M286 HydrophobicContact CD1-CG 4.37Å; F263-M286 HydrophobicContact CD1-SD 4.22Å; F263-M286 VanDerWaalsContact O-CA 3.25Å; F263-M286 WeakPolarHBondContact O-CA 3.46Å; G270-M286 WeakPolarHBondContact O-CE 3.36Å; L273-M286 HydrophobicContact CB-CE 3.66Å; L274-M286 HydrophobicContact CD1-SD 4.03Å; L274-M286 HydrophobicContact CD2-CE 4.09Å; L274-M286 HydrophobicContact CD2-SD 4.14Å; L274-M286 HydrophobicContact CG-CE 3.78Å; L274-M286 HydrophobicContact CG-SD 3.74Å; V284-M286 HydrophobicContact CG1-CE 3.63Å; V284-M286 HydrophobicContact CG1-CG 3.66Å; V284-M286 HydrophobicContact CG1-SD 4.12Å; M286-L288 HydrophobicContact CB-CD1 4.46Å; M286-L288 HydrophobicContact CB-CD2 4.1Å; M286-L288 HydrophobicContact CB-CG 4.07Å; M286-L288 HydrophobicContact SD-CD1 4.48Å; M286-L288 HydrophobicContact SD-CD2 4.33Å; M286-G492 CarbonylContact O-C 3.45Å; M286-G492 WeakPolarHBondContact O-CA 3.22Å; M286-L493 PolarHBondContact N-O 2.81Å; M286-L493 PolarHBondContact O-N 2.84Å
287	E	97.8	Very high	96.2	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.009	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.3	161.7	-173.1	-150.4	115.5	0	0	107.3	R194 F263 T264 G265 C321 L447 F485	R194-E287 IonicContact NH1-OE2 3.73Å; R194-E287 PolarHBondContact NH1-OE2 2.88Å; F263-E287 PolarHBondContact O-N 3.03Å; T264-E287 VanDerWaalsContact CA-O 3.22Å; T264-E287 WeakPolarHBondContact CA-O 3.38Å; T264-E287 HydrophobicContact CG2-CB 3.92Å; T264-E287 HydrophobicContact CG2-CG 4.26Å; T264-E287 WeakPolarHBondContact CG2-OE1 3.39Å; G265-E287 PolarHBondContact N-O 2.72Å; E287-C321 PolarHBondContact OE1-SG 2.81Å; E287-L447 HydrophobicContact CG-CD1 3.99Å; E287-L447 HydrophobicContact CG-CD2 4.45Å; E287-F485 WeakPolarHBondContact OE2-CD1 3.41Å; E287-F485 WeakPolarHBondContact OE2-CE1 3.38Å
288	L	95.3	Very high	96.2	Very high	10 Å²	10	30.2 Å²	30.2	5%	0.052	18%	0.175	C	C	.	.			trans	-112.5	179.6	-174.4	-55.3	179.2	0	0	0	110.5	F263 G265 T267 M286 Q490 S491	F263-L288 HydrophobicContact CD1-CD2 3.65Å; F263-L288 HydrophobicContact CE1-CD2 3.49Å; F263-L288 VanDerWaalsContact CE1-CD2 3.49Å; G265-L288 VanDerWaalsContact O-CA 3.29Å; G265-L288 WeakPolarHBondContact O-CA 3.4Å; T267-L288 HydrophobicContact CG2-CD1 4.35Å; M286-L288 HydrophobicContact CB-CD1 4.46Å; M286-L288 HydrophobicContact CB-CD2 4.1Å; M286-L288 HydrophobicContact CB-CG 4.07Å; M286-L288 HydrophobicContact SD-CD1 4.48Å; M286-L288 HydrophobicContact SD-CD2 4.33Å; L288-Q490 WeakPolarHBondContact CD1-O 3.36Å; L288-S491 PolarHBondContact N-O 3.01Å
289	G	82.8	Confident	96.2	Very high	4 Å²	4	29.4 Å²	29.4	4%	0.041	17%	0.165	C	C	.	.			trans	-56.8	154	-175.8	0	0	0	0	0	113.8	G265 E419 V445 S491	G265-G289 PolarHBondContact O-N 3.27Å; G289-E419 VanDerWaalsContact CA-CD 3.47Å; G289-E419 WeakPolarHBondContact CA-OE1 3.36Å; G289-E419 WeakPolarHBondContact CA-OE2 3.44Å; G289-V445 WeakPolarHBondContact O-CG1 3.4Å; G289-S491 PolarHBondContact O-OG 3.5Å
290	G	81.6	Confident	96.2	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.01	14%	0.135	C	C	.	.			trans	-134.5	152.4	-178.5	0	0	0	0	0	113.2	N325 E419	G290-N325 PolarHBondContact O-ND2 3.19Å; G290-E419 PolarHBondContact N-OE1 3.41Å; G290-E419 WeakPolarHBondContact O-CG 3.4Å
291	L	88.8	Confident	96.2	Very high	16 Å²	16	24.3 Å²	24.3	8%	0.084	14%	0.135	C	C	.	.			trans	-119	92.7	162.9	-74.4	170.7	0	0	0	106.3	P293 N325 A443 V445	L291-P293 WeakPolarHBondContact O-CD 3Å; L291-N325 HydrophobicContact CD2-CB 4.04Å; L291-A443 HydrophobicContact CD1-CB 4.37Å; L291-V445 HydrophobicContact CB-CG2 3.84Å; L291-V445 HydrophobicContact CD1-CG2 4.11Å; L291-V445 HydrophobicContact CG-CG2 4.01Å
292	A	94.6	Very high	96.2	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.008	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	114.4	-175.3	0	0	0	0	0	110.5	S324 N325 Q326 A448 Y450	A292-S324 CarbonylContact O-C 3.59Å; A292-S324 WeakPolarHBondContact O-CA 3.19Å; A292-N325 PolarHBondContact O-N 3.11Å; A292-Q326 PolarHBondContact O-N 3.05Å; A292-A448 WeakPolarHBondContact CA-O 3.5Å; A292-A448 HydrophobicContact CB-CB 4.31Å; A292-A448 VanDerWaalsContact CB-O 3.23Å; A292-A448 WeakPolarHBondContact CB-O 3.5Å; A292-Y450 HydrophobicContact CB-CD2 4.4Å; A292-Y450 HydrophobicContact CB-CE2 4.07Å
293	P	96.9	Very high	96.2	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.019	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	143.2	171.9	30.8	-35.5	0	0	0	110	L291 I295 L328 A440 A448 Y450 L466	L291-P293 WeakPolarHBondContact O-CD 3Å; P293-I295 HydrophobicContact CB-CG1 4.49Å; P293-L328 HydrophobicContact CB-CD1 4.3Å; P293-A440 HydrophobicContact CB-CB 3.74Å; P293-A440 HydrophobicContact CG-CB 3.86Å; P293-A448 WeakPolarHBondContact CD-O 3.29Å; P293-Y450 PolarHBondContact O-N 2.93Å; P293-L466 HydrophobicContact CG-CD2 4.23Å
294	F	98.5	Very high	96.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	102	171.7	-170.9	-74.2	0	0	0	108.5	V296 A305 A309 Q326 F327 L328 Y450 Y452	F294-V296 HydrophobicContact CD1-CG2 3.75Å; F294-V296 HydrophobicContact CE1-CG2 3.54Å; F294-A305 WeakPolarHBondContact CZ-O 3.5Å; F294-A309 HydrophobicContact CE1-CB 4.09Å; F294-A309 HydrophobicContact CE2-CB 4.42Å; F294-A309 HydrophobicContact CZ-CB 3.91Å; F294-Q326 PolarHBondContact N-O 2.83Å; F294-F327 HydrophobicContact CB-CD1 3.77Å; F294-F327 HydrophobicContact CB-CE1 3.86Å; F294-F327 HydrophobicContact CB-CG 4.45Å; F294-F327 AromaticContact CD1-CD1 3.46Å; F294-F327 HydrophobicContact CD1-CD1 3.46Å; F294-F327 VanDerWaalsContact CD1-CD1 3.46Å; F294-F327 AromaticContact CD1-CE1 3.57Å; F294-F327 HydrophobicContact CD1-CE1 3.57Å; F294-F327 HydrophobicContact CD2-CE1 4.09Å; F294-F327 HydrophobicContact CE1-CD1 4.2Å; F294-F327 HydrophobicContact CE1-CE1 4.07Å; F294-F327 AromaticContact CG-CD1 3.73Å; F294-F327 HydrophobicContact CG-CD1 3.73Å; F294-F327 AromaticContact CG-CE1 3.57Å; F294-F327 HydrophobicContact CG-CE1 3.57Å; F294-F327 CarbonylContact O-C 3.58Å; F294-F327 WeakPolarHBondContact O-CA 3.47Å; F294-L328 PolarHBondContact O-N 3.04Å; F294-Y450 CarbonylContact C-O 3.47Å; F294-Y450 WeakPolarHBondContact CA-O 3.26Å; F294-Y450 VanDerWaalsContact CD2-CB 3.45Å; F294-Y450 HydrophobicContact CD2-CD2 4.25Å; F294-Y450 AromaticContact CD2-CG 3.95Å; F294-Y450 HydrophobicContact CD2-CG 3.95Å; F294-Y450 HydrophobicContact CE2-CG 4.47Å; F294-Y452 AromaticContact CE1-CD2 3.84Å; F294-Y452 HydrophobicContact CE1-CD2 3.84Å; F294-Y452 HydrophobicContact CE1-CE2 4.07Å; F294-Y452 HydrophobicContact CE2-CD2 4.26Å; F294-Y452 AromaticContact CE2-CE2 3.77Å; F294-Y452 HydrophobicContact CE2-CE2 3.77Å; F294-Y452 AromaticContact CZ-CD2 3.5Å; F294-Y452 HydrophobicContact CZ-CD2 3.5Å; F294-Y452 AromaticContact CZ-CE2 3.25Å; F294-Y452 HydrophobicContact CZ-CE2 3.25Å
295	I	98.9	Very high	96.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	127.9	-171.6	-45.1	179.1	0	0	0	110.2	P293 F297 L328 F430 A436 A440 Y450 F451 Y452 V462 L466	P293-I295 HydrophobicContact CB-CG1 4.49Å; I295-F297 HydrophobicContact CB-CE2 4.24Å; I295-F297 HydrophobicContact CB-CZ 4.44Å; I295-F297 HydrophobicContact CG2-CD1 4.42Å; I295-F297 HydrophobicContact CG2-CD2 4.18Å; I295-F297 HydrophobicContact CG2-CE1 3.94Å; I295-F297 HydrophobicContact CG2-CE2 3.68Å; I295-F297 HydrophobicContact CG2-CZ 3.55Å; I295-L328 CarbonylContact C-O 3.59Å; I295-L328 VanDerWaalsContact CA-O 3.27Å; I295-L328 WeakPolarHBondContact CA-O 3.31Å; I295-L328 HydrophobicContact CB-CB 4.48Å; I295-L328 HydrophobicContact CD1-CD1 4.4Å; I295-L328 HydrophobicContact CG1-CB 4.23Å; I295-L328 HydrophobicContact CG1-CD1 4.04Å; I295-L328 HydrophobicContact CG2-CB 4.29Å; I295-F430 HydrophobicContact CG2-CE1 3.75Å; I295-F430 HydrophobicContact CG2-CZ 3.78Å; I295-A436 HydrophobicContact CD1-CB 4.44Å; I295-A436 HydrophobicContact CG2-CB 3.96Å; I295-A440 HydrophobicContact CD1-CB 4.17Å; I295-Y450 PolarHBondContact N-O 3.02Å; I295-F451 HydrophobicContact CB-CB 3.79Å; I295-F451 HydrophobicContact CG1-CB 4.48Å; I295-F451 CarbonylContact O-C 3.58Å; I295-F451 WeakPolarHBondContact O-CA 3.5Å; I295-F451 WeakPolarHBondContact O-CB 3.21Å; I295-Y452 PolarHBondContact O-N 3.32Å; I295-V462 HydrophobicContact CD1-CG1 4.48Å; I295-L466 HydrophobicContact CD1-CD1 4.5Å; I295-L466 HydrophobicContact CD1-CD2 4.12Å
296	V	98.9	Very high	96.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	106.8	176.5	-175.6	0	0	0	0	108.1	F294 A300 A305 L328 V329 Q330 I333 F337	F294-V296 HydrophobicContact CD1-CG2 3.75Å; F294-V296 HydrophobicContact CE1-CG2 3.54Å; V296-A300 HydrophobicContact CG1-CB 3.8Å; V296-A305 HydrophobicContact CG1-CB 3.96Å; V296-A305 HydrophobicContact CG2-CB 4.18Å; V296-L328 PolarHBondContact N-O 3.26Å; V296-V329 HydrophobicContact CB-CB 4.49Å; V296-V329 HydrophobicContact CB-CG1 4.1Å; V296-V329 HydrophobicContact CB-CG2 4.24Å; V296-V329 HydrophobicContact CG1-CG1 4.42Å; V296-V329 HydrophobicContact CG2-CG2 4.31Å; V296-Q330 PolarHBondContact O-N 3.05Å; V296-I333 HydrophobicContact CG1-CD1 4.31Å; V296-I333 HydrophobicContact CG1-CG2 4.14Å; V296-F337 HydrophobicContact CG1-CD2 4.17Å; V296-F337 HydrophobicContact CG2-CD2 4.24Å; V296-F337 HydrophobicContact CG2-CE2 3.88Å; V296-F337 HydrophobicContact CG2-CZ 4.12Å
297	F	98.9	Very high	96.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.157	C	C	.	.			trans	-82.1	161.5	176.9	-65.1	-75.5	0	0	0	111.4	I295 S299 A300 F430 E433 F451 Y452 Q458 V462	I295-F297 HydrophobicContact CB-CE2 4.24Å; I295-F297 HydrophobicContact CB-CZ 4.44Å; I295-F297 HydrophobicContact CG2-CD1 4.42Å; I295-F297 HydrophobicContact CG2-CD2 4.18Å; I295-F297 HydrophobicContact CG2-CE1 3.94Å; I295-F297 HydrophobicContact CG2-CE2 3.68Å; I295-F297 HydrophobicContact CG2-CZ 3.55Å; F297-S299 PolarHBondContact O-N 3.46Å; F297-S299 VanDerWaalsContact O-N 3.17Å; F297-A300 WeakPolarHBondContact O-CB 3.45Å; F297-A300 PolarHBondContact O-N 3.48Å; F297-F430 HydrophobicContact CD1-CE2 4.12Å; F297-F430 AromaticContact CD1-CZ 3.81Å; F297-F430 HydrophobicContact CD1-CZ 3.81Å; F297-F430 HydrophobicContact CE1-CE2 4.11Å; F297-F430 AromaticContact CE1-CZ 3.9Å; F297-F430 HydrophobicContact CE1-CZ 3.9Å; F297-E433 HydrophobicContact CE1-CB 4.06Å; F297-E433 HydrophobicContact CE1-CG 3.94Å; F297-E433 HydrophobicContact CZ-CG 4.18Å; F297-F451 HydrophobicContact CD2-CD2 4.27Å; F297-F451 HydrophobicContact CE2-CB 4.11Å; F297-F451 AromaticContact CE2-CD2 3.97Å; F297-F451 HydrophobicContact CE2-CD2 3.97Å; F297-F451 HydrophobicContact CE2-CG 4.29Å; F297-Y452 WeakPolarHBondContact CD2-O 3.46Å; F297-Y452 PolarHBondContact N-O 3.16Å; F297-Q458 HydrophobicContact CD2-CG 4.37Å; F297-Q458 HydrophobicContact CE2-CG 4.3Å; F297-Q458 HydrophobicContact CZ-CG 4.48Å; F297-V462 HydrophobicContact CE2-CG1 4.2Å; F297-V462 HydrophobicContact CE2-CG2 3.83Å; F297-V462 HydrophobicContact CZ-CG1 4.3Å; F297-V462 HydrophobicContact CZ-CG2 3.6Å
298	D	98.9	Very high	96.2	Very high	73 Å²	73	27.1 Å²	27.1	39%	0.39	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.1	-179.7	-73.2	-27.3	0	0	0	113.2	A300 Q330 G332 I333	D298-A300 VanDerWaalsContact C-N 3.25Å; D298-A300 PolarHBondContact O-N 3.33Å; D298-Q330 WeakPolarHBondContact OD1-CB 3.38Å; D298-Q330 VanDerWaalsContact OD2-CD 3.29Å; D298-Q330 WeakPolarHBondContact OD2-CG 3.09Å; D298-G332 VanDerWaalsContact OD1-C 3.32Å; D298-G332 WeakPolarHBondContact OD1-CA 3.28Å; D298-G332 PolarHBondContact OD1-N 2.93Å; D298-I333 PolarHBondContact OD1-N 2.78Å
299	S	98.8	Very high	96.3	Very high	49 Å²	49	26.7 Å²	26.7	34%	0.343	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-8.2	176	69.3	0	0	0	0	113.5	F297 S453 Q454	F297-S299 PolarHBondContact O-N 3.46Å; F297-S299 VanDerWaalsContact O-N 3.17Å; S299-S453 PolarHBondContact OG-OG 3.03Å; S299-S453 VanDerWaalsContact OG-OG 3.07Å; S299-Q454 WeakPolarHBondContact O-CB 3.39Å; S299-Q454 WeakPolarHBondContact O-CG 3.26Å; S299-Q454 PolarHBondContact OG-N 3.49Å; S299-Q454 VanDerWaalsContact OG-N 3.07Å
300	A	98.8	Very high	97.1	Very high	11 Å²	11	27.7 Å²	27.7	9%	0.091	16%	0.159	C	C	.	.	S	Bend	trans	-63.8	147.1	-177.2	0	0	0	0	0	112.3	V296 F297 D298 V302 I333	V296-A300 HydrophobicContact CG1-CB 3.8Å; F297-A300 WeakPolarHBondContact O-CB 3.45Å; F297-A300 PolarHBondContact O-N 3.48Å; D298-A300 VanDerWaalsContact C-N 3.25Å; D298-A300 PolarHBondContact O-N 3.33Å; A300-V302 PolarHBondContact O-N 3.5Å; A300-I333 HydrophobicContact CB-CD1 4.08Å; A300-I333 WeakPolarHBondContact O-CD1 3.37Å
301	N	98.7	Very high	97.7	Very high	73 Å²	73	29.2 Å²	29.2	39%	0.39	17%	0.172	S	C	.	.			trans	-74	113.9	162.1	-179.1	-52.5	0	0	0	108.8	D303 Q304 A305	N301-D303 PolarHBondContact O-N 2.74Å; N301-D303 PolarHBondContact OD1-N 2.73Å; N301-D303 VanDerWaalsContact OD1-N 3.1Å; N301-Q304 HydrophobicContact CB-CB 4.05Å; N301-Q304 HydrophobicContact CB-CG 4.04Å; N301-Q304 PolarHBondContact O-N 2.91Å; N301-Q304 PolarHBondContact OD1-N 2.86Å; N301-A305 WeakPolarHBondContact O-CB 3.43Å; N301-A305 PolarHBondContact O-N 3.24Å
302	V	98.5	Very high	98	Very high	37 Å²	37	28.6 Å²	28.6	22%	0.224	17%	0.169	C	C	.	.	H	α-helix	trans	-55.4	-48.7	-176.4	179.6	0	0	0	0	111.8	A300 Q304 A305 V306 I333 A340	A300-V302 PolarHBondContact O-N 3.5Å; V302-Q304 VanDerWaalsContact C-N 3.32Å; V302-Q304 PolarHBondContact O-N 2.86Å; V302-A305 PolarHBondContact O-N 2.63Å; V302-V306 HydrophobicContact CG1-CG2 4.27Å; V302-V306 WeakPolarHBondContact O-CB 3.42Å; V302-V306 WeakPolarHBondContact O-CG2 3.21Å; V302-V306 PolarHBondContact O-N 2.92Å; V302-I333 HydrophobicContact CG2-CD1 3.56Å; V302-I333 HydrophobicContact CG2-CG1 3.64Å; V302-A340 HydrophobicContact CG1-CB 4.14Å
303	D	98.4	Very high	98.1	Very high	118 Å²	118	28.5 Å²	28.5	63%	0.631	17%	0.168	S	C	*	.	H	α-helix	trans	-64.5	-39.6	-175.7	-66.8	-34.8	0	0	0	111.4	N301 A307	N301-D303 PolarHBondContact O-N 2.74Å; N301-D303 PolarHBondContact OD1-N 2.73Å; N301-D303 VanDerWaalsContact OD1-N 3.1Å; D303-A307 WeakPolarHBondContact O-CB 3.16Å; D303-A307 PolarHBondContact O-N 2.77Å
304	Q	98.7	Very high	98.1	Very high	109 Å²	109	28.6 Å²	28.6	51%	0.509	17%	0.169	S	C	.	.	H	α-helix	trans	-68.3	-42.2	175.6	-65.1	-61.1	-49.7	0	0	111.7	N301 V302 V306 A307 G308 Y452	N301-Q304 HydrophobicContact CB-CB 4.05Å; N301-Q304 HydrophobicContact CB-CG 4.04Å; N301-Q304 PolarHBondContact O-N 2.91Å; N301-Q304 PolarHBondContact OD1-N 2.86Å; V302-Q304 VanDerWaalsContact C-N 3.32Å; V302-Q304 PolarHBondContact O-N 2.86Å; Q304-V306 VanDerWaalsContact C-N 3.33Å; Q304-V306 PolarHBondContact O-N 3.22Å; Q304-A307 PolarHBondContact O-N 3.02Å; Q304-G308 PolarHBondContact O-N 2.84Å; Q304-Y452 HydrophobicContact CB-CD1 4.27Å; Q304-Y452 HydrophobicContact CB-CE1 3.93Å; Q304-Y452 VanDerWaalsContact O-CE1 3.23Å; Q304-Y452 WeakPolarHBondContact O-CE1 3.45Å; Q304-Y452 PolarHBondContact O-OH 2.97Å
305	A	98.7	Very high	97.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-41.9	176.2	0	0	0	0	0	111.3	F294 V296 N301 V302 G308 A309 F337 Y452	F294-A305 WeakPolarHBondContact CZ-O 3.5Å; V296-A305 HydrophobicContact CG1-CB 3.96Å; V296-A305 HydrophobicContact CG2-CB 4.18Å; N301-A305 WeakPolarHBondContact O-CB 3.43Å; N301-A305 PolarHBondContact O-N 3.24Å; V302-A305 PolarHBondContact O-N 2.63Å; A305-G308 PolarHBondContact O-N 2.84Å; A305-A309 VanDerWaalsContact O-CB 3.23Å; A305-A309 WeakPolarHBondContact O-CB 3.17Å; A305-A309 PolarHBondContact O-N 2.91Å; A305-F337 HydrophobicContact CB-CD2 4.18Å; A305-F337 HydrophobicContact CB-CE2 3.96Å; A305-Y452 VanDerWaalsContact CA-CD1 3.48Å; A305-Y452 HydrophobicContact CB-CD1 3.84Å; A305-Y452 HydrophobicContact CB-CD2 4.22Å; A305-Y452 HydrophobicContact CB-CE1 4.45Å; A305-Y452 HydrophobicContact CB-CG 3.72Å
306	V	98.8	Very high	97.4	Very high	10 Å²	10	35.3 Å²	35.3	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-42.8	175.3	169.7	0	0	0	0	111.2	V302 Q304 G308 A309 M310 F337 A340 F341 A344	V302-V306 HydrophobicContact CG1-CG2 4.27Å; V302-V306 WeakPolarHBondContact O-CB 3.42Å; V302-V306 WeakPolarHBondContact O-CG2 3.21Å; V302-V306 PolarHBondContact O-N 2.92Å; Q304-V306 VanDerWaalsContact C-N 3.33Å; Q304-V306 PolarHBondContact O-N 3.22Å; V306-G308 VanDerWaalsContact C-N 3.35Å; V306-G308 PolarHBondContact O-N 3.47Å; V306-A309 PolarHBondContact O-N 3.3Å; V306-M310 HydrophobicContact CG1-CG 4.32Å; V306-M310 WeakPolarHBondContact O-CB 3.44Å; V306-M310 WeakPolarHBondContact O-CG 3.26Å; V306-M310 PolarHBondContact O-N 3.04Å; V306-F337 HydrophobicContact CG2-CD2 3.75Å; V306-F337 HydrophobicContact CG2-CE2 3.8Å; V306-A340 HydrophobicContact CG2-CB 3.89Å; V306-F341 HydrophobicContact CG1-CD2 4.34Å; V306-F341 HydrophobicContact CG2-CB 4.24Å; V306-A344 HydrophobicContact CG1-CB 3.61Å
307	A	98.5	Very high	97.1	Very high	52 Å²	52	35.6 Å²	35.6	43%	0.43	20%	0.2	S	C	.	.	H	α-helix	trans	-60.7	-44.7	176	0	0	0	0	0	111.7	D303 Q304 M310 A311	D303-A307 WeakPolarHBondContact O-CB 3.16Å; D303-A307 PolarHBondContact O-N 2.77Å; Q304-A307 PolarHBondContact O-N 3.02Å; A307-M310 PolarHBondContact O-N 3.25Å; A307-A311 WeakPolarHBondContact O-CB 3.39Å; A307-A311 PolarHBondContact O-N 2.94Å
308	G	98.3	Very high	96.8	Very high	3 Å²	3	35.6 Å²	35.6	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-44.9	173.3	0	0	0	0	0	113.3	Q304 A305 V306 M310 A311 S312 Y452	Q304-G308 PolarHBondContact O-N 2.84Å; A305-G308 PolarHBondContact O-N 2.84Å; V306-G308 VanDerWaalsContact C-N 3.35Å; V306-G308 PolarHBondContact O-N 3.47Å; G308-M310 PolarHBondContact O-N 3.32Å; G308-A311 PolarHBondContact O-N 3.02Å; G308-S312 VanDerWaalsContact O-CB 3.26Å; G308-S312 WeakPolarHBondContact O-CB 3.47Å; G308-S312 PolarHBondContact O-N 3.47Å; G308-Y452 WeakPolarHBondContact CA-OH 3.27Å
309	A	98.4	Very high	96.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-43.5	177.4	0	0	0	0	0	111.6	F294 A305 V306 K313 F327 F337 F341	F294-A309 HydrophobicContact CE1-CB 4.09Å; F294-A309 HydrophobicContact CE2-CB 4.42Å; F294-A309 HydrophobicContact CZ-CB 3.91Å; A305-A309 VanDerWaalsContact O-CB 3.23Å; A305-A309 WeakPolarHBondContact O-CB 3.17Å; A305-A309 PolarHBondContact O-N 2.91Å; V306-A309 PolarHBondContact O-N 3.3Å; A309-K313 VanDerWaalsContact O-CB 3.27Å; A309-K313 WeakPolarHBondContact O-CB 3.3Å; A309-K313 PolarHBondContact O-N 3.49Å; A309-F327 HydrophobicContact CB-CD1 4.36Å; A309-F327 HydrophobicContact CB-CE1 3.43Å; A309-F327 VanDerWaalsContact CB-CE1 3.43Å; A309-F327 HydrophobicContact CB-CZ 4Å; A309-F337 HydrophobicContact CB-CE2 4.43Å; A309-F337 HydrophobicContact CB-CZ 4.02Å; A309-F341 HydrophobicContact CB-CD1 4.45Å; A309-F341 HydrophobicContact CB-CD2 4.37Å; A309-F341 HydrophobicContact CB-CE1 3.93Å; A309-F341 HydrophobicContact CB-CE2 3.81Å; A309-F341 HydrophobicContact CB-CZ 3.58Å
310	M	98.4	Very high	95.9	Very high	25 Å²	25	30.2 Å²	30.2	12%	0.123	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-48.3	176	-75.5	-70.4	-61.2	0	0	111.6	V306 A307 G308 F314 F341 A344 M345 N348 L349	V306-M310 HydrophobicContact CG1-CG 4.32Å; V306-M310 WeakPolarHBondContact O-CB 3.44Å; V306-M310 WeakPolarHBondContact O-CG 3.26Å; V306-M310 PolarHBondContact O-N 3.04Å; A307-M310 PolarHBondContact O-N 3.25Å; G308-M310 PolarHBondContact O-N 3.32Å; M310-F314 HydrophobicContact CE-CD2 4.47Å; M310-F314 PolarHBondContact O-N 2.65Å; M310-F314 HydrophobicContact SD-CD2 3.94Å; M310-F314 HydrophobicContact SD-CE2 4.05Å; M310-F341 HydrophobicContact CG-CD2 4.14Å; M310-F341 HydrophobicContact CG-CE2 3.91Å; M310-F341 HydrophobicContact SD-CD2 3.94Å; M310-F341 HydrophobicContact SD-CE2 3.68Å; M310-A344 HydrophobicContact CG-CB 3.95Å; M310-A344 HydrophobicContact SD-CB 3.94Å; M310-M345 HydrophobicContact SD-CB 4.43Å; M310-M345 HydrophobicContact SD-CG 3.71Å; M310-N348 HydrophobicContact CE-CB 3.91Å; M310-L349 HydrophobicContact CE-CD1 4.32Å; M310-L349 HydrophobicContact CE-CD2 3.71Å; M310-L349 HydrophobicContact CE-CG 3.83Å
311	A	94.5	Very high	95.3	Very high	34 Å²	34	30 Å²	30	28%	0.281	17%	0.165	S	C	.	.	H	α-helix	trans	-68.8	-39.3	-178.6	0	0	0	0	0	112.5	A307 G308 R315 L477	A307-A311 WeakPolarHBondContact O-CB 3.39Å; A307-A311 PolarHBondContact O-N 2.94Å; G308-A311 PolarHBondContact O-N 3.02Å; A311-R315 WeakPolarHBondContact O-CB 3.34Å; A311-L477 HydrophobicContact CB-CD1 3.97Å; A311-L477 HydrophobicContact CB-CD2 4.15Å; A311-L477 HydrophobicContact CB-CG 3.82Å
312	S	95.3	Very high	94.9	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.014	15%	0.147	C	C	.	.	H	α-helix	trans	-73.7	-47.8	-179.7	-177.7	0	0	0	0	112.3	G308 C323 S324	G308-S312 VanDerWaalsContact O-CB 3.26Å; G308-S312 WeakPolarHBondContact O-CB 3.47Å; G308-S312 PolarHBondContact O-N 3.47Å; S312-C323 PolarHBondContact O-SG 3.37Å; S312-S324 PolarHBondContact OG-N 3.04Å; S312-S324 PolarHBondContact OG-OG 3.34Å
313	K	96.9	Very high	94.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-79.2	-42.1	-171.7	-176.9	67.8	-142	-172.6	0	114.1	A309 G318 S324 N325 F327 G422 L424 A425	A309-K313 VanDerWaalsContact O-CB 3.27Å; A309-K313 WeakPolarHBondContact O-CB 3.3Å; A309-K313 PolarHBondContact O-N 3.49Å; K313-G318 WeakPolarHBondContact O-CA 3.24Å; K313-G318 PolarHBondContact O-N 3.07Å; K313-S324 WeakPolarHBondContact CD-O 3.16Å; K313-S324 PolarHBondContact NZ-O 3.49Å; K313-N325 PolarHBondContact NZ-OD1 3.17Å; K313-F327 HydrophobicContact CB-CE2 4.31Å; K313-F327 HydrophobicContact CB-CZ 3.98Å; K313-F327 HydrophobicContact CD-CE2 4.2Å; K313-F327 HydrophobicContact CG-CE2 4.29Å; K313-F327 HydrophobicContact CG-CZ 4.46Å; K313-G422 WeakPolarHBondContact CE-O 3.48Å; K313-G422 PolarHBondContact NZ-O 3.14Å; K313-L424 WeakPolarHBondContact CE-O 3.41Å; K313-L424 PolarHBondContact NZ-O 3.36Å; K313-A425 HydrophobicContact CG-CB 4.22Å
314	F	96.2	Very high	94	Very high	5 Å²	5	19.2 Å²	19.2	2%	0.022	11%	0.107	C	C	.	.	H	α-helix	trans	-98.3	-6.3	-167.9	-62.2	-67.5	0	0	0	113.1	M310 N316 T317 F341 M345 L349 Q361 P403 P423 A425	M310-F314 HydrophobicContact CE-CD2 4.47Å; M310-F314 PolarHBondContact O-N 2.65Å; M310-F314 HydrophobicContact SD-CD2 3.94Å; M310-F314 HydrophobicContact SD-CE2 4.05Å; F314-N316 PolarHBondContact O-N 3.42Å; F314-T317 WeakPolarHBondContact O-CA 3.26Å; F314-T317 PolarHBondContact O-N 3.44Å; F314-F341 HydrophobicContact CD2-CE2 4.38Å; F314-F341 AromaticContact CE2-CE2 3.61Å; F314-F341 HydrophobicContact CE2-CE2 3.61Å; F314-F341 AromaticContact CE2-CZ 3.72Å; F314-F341 HydrophobicContact CE2-CZ 3.72Å; F314-F341 HydrophobicContact CZ-CZ 4.4Å; F314-M345 HydrophobicContact CD2-CG 4.48Å; F314-M345 HydrophobicContact CE1-CE 4.12Å; F314-M345 HydrophobicContact CE2-CE 4.22Å; F314-M345 HydrophobicContact CE2-CG 3.61Å; F314-M345 HydrophobicContact CE2-SD 3.88Å; F314-M345 HydrophobicContact CZ-CE 3.49Å; F314-M345 VanDerWaalsContact CZ-CE 3.49Å; F314-M345 HydrophobicContact CZ-CG 3.89Å; F314-M345 HydrophobicContact CZ-SD 3.66Å; F314-L349 HydrophobicContact CB-CD1 4.26Å; F314-L349 HydrophobicContact CB-CD2 3.86Å; F314-L349 HydrophobicContact CD1-CD1 3.73Å; F314-L349 HydrophobicContact CD2-CD1 3.72Å; F314-L349 HydrophobicContact CD2-CD2 4.4Å; F314-L349 HydrophobicContact CE1-CD1 3.98Å; F314-L349 HydrophobicContact CE2-CD1 3.95Å; F314-L349 HydrophobicContact CG-CD1 3.62Å; F314-L349 HydrophobicContact CG-CD2 4.12Å; F314-L349 HydrophobicContact CZ-CD1 4.09Å; F314-Q361 PolarHBondContact O-NE2 3.25Å; F314-P403 HydrophobicContact CD1-CB 4.26Å; F314-P403 HydrophobicContact CE1-CB 3.87Å; F314-P423 HydrophobicContact CD1-CB 4.06Å; F314-P423 HydrophobicContact CE1-CB 4.17Å; F314-A425 HydrophobicContact CZ-CB 4.45Å
315	R	91.4	Very high	93.5	Very high	79 Å²	79	14 Å²	14	30%	0.298	8%	0.082	S	C	.	.	G	3₁₀ helix	trans	-59.1	132.8	169.7	-176.8	175.8	69	155.5	0.6	110.2	A311 T317 G318 S479	A311-R315 WeakPolarHBondContact O-CB 3.34Å; R315-T317 PolarHBondContact O-N 3.25Å; R315-G318 PolarHBondContact O-N 2.94Å; R315-G318 VanDerWaalsContact O-N 3.09Å; R315-S479 PolarHBondContact NH1-OG 3.27Å
316	N	91.3	Very high	93.1	Very high	61 Å²	61	14.7 Å²	14.7	33%	0.326	9%	0.085	S	C	.	.	G	3₁₀ helix	trans	55	32	-173.8	-159.9	16.8	0	0	0	113.2	N186 F314 G318 Q319	N186-N316 PolarHBondContact O-ND2 3.49Å; N186-N316 VanDerWaalsContact O-ND2 3.07Å; F314-N316 PolarHBondContact O-N 3.42Å; N316-G318 PolarHBondContact O-N 2.99Å; N316-G318 VanDerWaalsContact O-N 3.17Å; N316-Q319 PolarHBondContact ND2-O 3.42Å; N316-Q319 VanDerWaalsContact O-CB 3.25Å; N316-Q319 WeakPolarHBondContact O-CB 3.25Å; N316-Q319 WeakPolarHBondContact O-CG 3.06Å; N316-Q319 PolarHBondContact O-N 3.17Å; N316-Q319 PolarHBondContact O-NE2 2.93Å; N316-Q319 VanDerWaalsContact O-NE2 3.16Å
317	T	93.5	Very high	93	Very high	7 Å²	7	14.2 Å²	14.2	4%	0.043	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	55.1	33.9	-176.2	-45.3	0	0	0	0	112.2	F314 R315 Q319 G362 L364 G422 P423	F314-T317 WeakPolarHBondContact O-CA 3.26Å; F314-T317 PolarHBondContact O-N 3.44Å; R315-T317 PolarHBondContact O-N 3.25Å; T317-Q319 VanDerWaalsContact C-N 3.3Å; T317-Q319 PolarHBondContact O-N 3.16Å; T317-G362 WeakPolarHBondContact CG2-O 3.41Å; T317-G362 PolarHBondContact OG1-N 2.87Å; T317-G362 VanDerWaalsContact OG1-N 3.11Å; T317-G362 PolarHBondContact OG1-O 3.36Å; T317-L364 HydrophobicContact CG2-CD2 4.23Å; T317-G422 CarbonylContact O-C 3.58Å; T317-G422 WeakPolarHBondContact O-CA 3.18Å; T317-P423 HydrophobicContact CG2-CB 3.87Å; T317-P423 HydrophobicContact CG2-CG 3.78Å
318	G	91.8	Very high	93.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	75.7	12.3	-179.7	0	0	0	0	0	115.4	K313 R315 N316 T320 F421 G422	K313-G318 WeakPolarHBondContact O-CA 3.24Å; K313-G318 PolarHBondContact O-N 3.07Å; R315-G318 PolarHBondContact O-N 2.94Å; R315-G318 VanDerWaalsContact O-N 3.09Å; N316-G318 PolarHBondContact O-N 2.99Å; N316-G318 VanDerWaalsContact O-N 3.17Å; G318-T320 VanDerWaalsContact C-N 3.31Å; G318-T320 PolarHBondContact O-N 2.95Å; G318-F421 WeakPolarHBondContact O-CA 3.44Å; G318-G422 PolarHBondContact O-N 2.7Å
319	Q	91.5	Very high	93.1	Very high	6 Å²	6	11.6 Å²	11.6	3%	0.028	6%	0.06	C	C	.	.			trans	-94.9	46.1	-175.1	-61.4	172.3	112.1	0	0	112.5	W185 N186 N316 T317 P363 L364 F421	W185-Q319 HydrophobicContact CH2-CB 3.5Å; W185-Q319 VanDerWaalsContact CH2-CB 3.5Å; W185-Q319 VanDerWaalsContact CH2-CD 3.49Å; W185-Q319 HydrophobicContact CH2-CG 3.77Å; W185-Q319 HydrophobicContact CZ3-CB 3.87Å; W185-Q319 HydrophobicContact CZ3-CG 4.33Å; N186-Q319 WeakPolarHBondContact CB-O 3Å; N316-Q319 PolarHBondContact ND2-O 3.42Å; N316-Q319 VanDerWaalsContact O-CB 3.25Å; N316-Q319 WeakPolarHBondContact O-CB 3.25Å; N316-Q319 WeakPolarHBondContact O-CG 3.06Å; N316-Q319 PolarHBondContact O-N 3.17Å; N316-Q319 PolarHBondContact O-NE2 2.93Å; N316-Q319 VanDerWaalsContact O-NE2 3.16Å; T317-Q319 VanDerWaalsContact C-N 3.3Å; T317-Q319 PolarHBondContact O-N 3.16Å; Q319-P363 PolarHBondContact NE2-O 3.11Å; Q319-L364 HydrophobicContact CG-CD2 3.82Å; Q319-L364 VanDerWaalsContact OE1-CA 3.28Å; Q319-F421 HydrophobicContact CB-CB 4.48Å; Q319-F421 HydrophobicContact CG-CB 4.42Å
320	T	87.2	Confident	93.1	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.012	7%	0.066	C	C	.	.	S	Bend	trans	-128.6	142	179.6	-52.1	0	0	0	0	110	F187 G318 V322 C323 F421	F187-T320 HydrophobicContact CE2-CG2 3.41Å; F187-T320 VanDerWaalsContact CE2-CG2 3.41Å; F187-T320 WeakPolarHBondContact CE2-OG1 3.47Å; F187-T320 HydrophobicContact CZ-CG2 3.87Å; F187-T320 WeakPolarHBondContact CZ-OG1 2.92Å; G318-T320 VanDerWaalsContact C-N 3.31Å; G318-T320 PolarHBondContact O-N 2.95Å; T320-V322 HydrophobicContact CG2-CG2 3.63Å; T320-V322 PolarHBondContact O-N 2.83Å; T320-C323 WeakPolarHBondContact CB-SG 2.93Å; T320-C323 WeakPolarHBondContact O-CB 3.48Å; T320-C323 PolarHBondContact O-N 2.98Å; T320-F421 WeakPolarHBondContact O-CE1 3.38Å
321	C	86.1	Confident	93.1	Very high	6 Å²	6	19 Å²	19	4%	0.041	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.2	176.2	53.4	0	0	0	0	113.6	E287 F421 L447	E287-C321 PolarHBondContact OE1-SG 2.81Å; C321-F421 HydrophobicContact CB-CZ 4.31Å; C321-L447 HydrophobicContact CB-CD2 3.55Å
322	V	90.1	Very high	93.3	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.018	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	8.3	176.6	-59	0	0	0	0	114.2	T320 S324 L447 A448 Y450 M470 F485	T320-V322 HydrophobicContact CG2-CG2 3.63Å; T320-V322 PolarHBondContact O-N 2.83Å; V322-S324 PolarHBondContact O-N 2.79Å; V322-L447 HydrophobicContact CG1-CD2 3.98Å; V322-L447 HydrophobicContact CG1-CG 4.18Å; V322-A448 HydrophobicContact CB-CB 3.82Å; V322-A448 HydrophobicContact CG1-CB 3.65Å; V322-Y450 WeakPolarHBondContact O-CE2 3.28Å; V322-Y450 PolarHBondContact O-OH 2.78Å; V322-Y450 VanDerWaalsContact O-OH 3.05Å; V322-M470 HydrophobicContact CG1-CE 4.06Å; V322-F485 HydrophobicContact CG1-CE1 4.17Å; V322-F485 HydrophobicContact CG1-CE2 4.17Å; V322-F485 HydrophobicContact CG1-CZ 3.42Å; V322-F485 VanDerWaalsContact CG1-CZ 3.42Å; V322-F485 HydrophobicContact CG2-CZ 4.37Å
323	C	88.7	Confident	93.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	-64	132.4	171.4	-80.9	0	0	0	0	109.8	S312 T320 N325	S312-C323 PolarHBondContact O-SG 3.37Å; T320-C323 WeakPolarHBondContact CB-SG 2.93Å; T320-C323 WeakPolarHBondContact O-CB 3.48Å; T320-C323 PolarHBondContact O-N 2.98Å; C323-N325 PolarHBondContact O-N 2.88Å; C323-N325 VanDerWaalsContact O-N 3.08Å; C323-N325 PolarHBondContact O-OD1 2.88Å
324	S	90.2	Very high	93.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	110.6	174.1	51.6	0	0	0	0	110.7	A292 S312 K313 V322 F327	A292-S324 CarbonylContact O-C 3.59Å; A292-S324 WeakPolarHBondContact O-CA 3.19Å; S312-S324 PolarHBondContact OG-N 3.04Å; S312-S324 PolarHBondContact OG-OG 3.34Å; K313-S324 WeakPolarHBondContact CD-O 3.16Å; K313-S324 PolarHBondContact NZ-O 3.49Å; V322-S324 PolarHBondContact O-N 2.79Å; S324-F327 WeakPolarHBondContact OG-CZ 3.37Å
325	N	86.9	Confident	93.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-20	-173.8	-75	-28.3	0	0	0	113.2	G290 L291 A292 K313 C323 T420 P426	G290-N325 PolarHBondContact O-ND2 3.19Å; L291-N325 HydrophobicContact CD2-CB 4.04Å; A292-N325 PolarHBondContact O-N 3.11Å; K313-N325 PolarHBondContact NZ-OD1 3.17Å; C323-N325 PolarHBondContact O-N 2.88Å; C323-N325 VanDerWaalsContact O-N 3.08Å; C323-N325 PolarHBondContact O-OD1 2.88Å; N325-T420 PolarHBondContact OD1-O 3.28Å; N325-P426 WeakPolarHBondContact O-CD 3.4Å; N325-P426 WeakPolarHBondContact O-CG 3.36Å
326	Q	90.7	Very high	94	Very high	13 Å²	13	25.3 Å²	25.3	6%	0.061	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.9	-179.9	-62.6	172.6	29.9	0	0	108.9	A292 F294 T416	A292-Q326 PolarHBondContact O-N 3.05Å; F294-Q326 PolarHBondContact N-O 2.83Å; Q326-T416 HydrophobicContact CG-CG2 4.47Å; Q326-T416 PolarHBondContact NE2-O 3.46Å
327	F	98.3	Very high	94.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	113.5	175.2	-69.5	-89.1	0	0	0	108.5	F294 A309 K313 S324 V329 F337 F341 A425 P426 V427 I428	F294-F327 HydrophobicContact CB-CD1 3.77Å; F294-F327 HydrophobicContact CB-CE1 3.86Å; F294-F327 HydrophobicContact CB-CG 4.45Å; F294-F327 AromaticContact CD1-CD1 3.46Å; F294-F327 HydrophobicContact CD1-CD1 3.46Å; F294-F327 VanDerWaalsContact CD1-CD1 3.46Å; F294-F327 AromaticContact CD1-CE1 3.57Å; F294-F327 HydrophobicContact CD1-CE1 3.57Å; F294-F327 HydrophobicContact CD2-CE1 4.09Å; F294-F327 HydrophobicContact CE1-CD1 4.2Å; F294-F327 HydrophobicContact CE1-CE1 4.07Å; F294-F327 AromaticContact CG-CD1 3.73Å; F294-F327 HydrophobicContact CG-CD1 3.73Å; F294-F327 AromaticContact CG-CE1 3.57Å; F294-F327 HydrophobicContact CG-CE1 3.57Å; F294-F327 CarbonylContact O-C 3.58Å; F294-F327 WeakPolarHBondContact O-CA 3.47Å; A309-F327 HydrophobicContact CB-CD1 4.36Å; A309-F327 HydrophobicContact CB-CE1 3.43Å; A309-F327 VanDerWaalsContact CB-CE1 3.43Å; A309-F327 HydrophobicContact CB-CZ 4Å; K313-F327 HydrophobicContact CB-CE2 4.31Å; K313-F327 HydrophobicContact CB-CZ 3.98Å; K313-F327 HydrophobicContact CD-CE2 4.2Å; K313-F327 HydrophobicContact CG-CE2 4.29Å; K313-F327 HydrophobicContact CG-CZ 4.46Å; S324-F327 WeakPolarHBondContact OG-CZ 3.37Å; F327-V329 HydrophobicContact CB-CG2 4.28Å; F327-F337 HydrophobicContact CD1-CE1 4.36Å; F327-F337 HydrophobicContact CD1-CZ 4.12Å; F327-F341 HydrophobicContact CD1-CE1 4.26Å; F327-F341 HydrophobicContact CD2-CE1 4.33Å; F327-F341 AromaticContact CE1-CE1 3.9Å; F327-F341 HydrophobicContact CE1-CE1 3.9Å; F327-F341 HydrophobicContact CE1-CZ 4.24Å; F327-F341 AromaticContact CE2-CE1 3.95Å; F327-F341 HydrophobicContact CE2-CE1 3.95Å; F327-F341 HydrophobicContact CE2-CZ 4.29Å; F327-F341 HydrophobicContact CG-CE1 4.47Å; F327-F341 AromaticContact CZ-CE1 3.7Å; F327-F341 HydrophobicContact CZ-CE1 3.7Å; F327-F341 AromaticContact CZ-CZ 3.81Å; F327-F341 HydrophobicContact CZ-CZ 3.81Å; F327-A425 HydrophobicContact CD2-CB 3.93Å; F327-A425 HydrophobicContact CE2-CB 3.59Å; F327-P426 PolarHBondContact N-O 3.17Å; F327-V427 HydrophobicContact CB-CB 4.44Å; F327-V427 HydrophobicContact CB-CG1 4.48Å; F327-V427 HydrophobicContact CB-CG2 4.01Å; F327-V427 CarbonylContact O-C 3.55Å; F327-V427 WeakPolarHBondContact O-CA 3.47Å; F327-I428 PolarHBondContact O-N 3.44Å
328	L	98.6	Very high	94.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	114.1	172.7	-65.1	167.7	0	0	0	106.4	P293 F294 I295 V296 I428 F430 I439 A440	P293-L328 HydrophobicContact CB-CD1 4.3Å; F294-L328 PolarHBondContact O-N 3.04Å; I295-L328 CarbonylContact C-O 3.59Å; I295-L328 VanDerWaalsContact CA-O 3.27Å; I295-L328 WeakPolarHBondContact CA-O 3.31Å; I295-L328 HydrophobicContact CB-CB 4.48Å; I295-L328 HydrophobicContact CD1-CD1 4.4Å; I295-L328 HydrophobicContact CG1-CB 4.23Å; I295-L328 HydrophobicContact CG1-CD1 4.04Å; I295-L328 HydrophobicContact CG2-CB 4.29Å; V296-L328 PolarHBondContact N-O 3.26Å; L328-I428 WeakPolarHBondContact CA-O 3.47Å; L328-I428 HydrophobicContact CD2-CB 3.84Å; L328-I428 HydrophobicContact CD2-CD1 4.11Å; L328-I428 HydrophobicContact CD2-CG2 3.91Å; L328-F430 VanDerWaalsContact C-CE1 3.45Å; L328-F430 HydrophobicContact CB-CD1 3.86Å; L328-F430 HydrophobicContact CB-CE1 4Å; L328-F430 WeakPolarHBondContact O-CE1 3.17Å; L328-I439 HydrophobicContact CD1-CB 4.31Å; L328-I439 HydrophobicContact CD1-CG2 4.2Å; L328-I439 HydrophobicContact CD2-CB 4.12Å; L328-I439 HydrophobicContact CD2-CD1 4.17Å; L328-I439 HydrophobicContact CD2-CG2 3.61Å; L328-A440 HydrophobicContact CD1-CB 4.02Å
329	V	98.9	Very high	95	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.8	-174.5	-172.5	0	0	0	0	110	V296 F327 I333 H334 F337 V427 I428 K429 F430	V296-V329 HydrophobicContact CB-CB 4.49Å; V296-V329 HydrophobicContact CB-CG1 4.1Å; V296-V329 HydrophobicContact CB-CG2 4.24Å; V296-V329 HydrophobicContact CG1-CG1 4.42Å; V296-V329 HydrophobicContact CG2-CG2 4.31Å; F327-V329 HydrophobicContact CB-CG2 4.28Å; V329-I333 HydrophobicContact CG1-CG2 3.89Å; V329-H334 HydrophobicContact CG1-CB 4.18Å; V329-F337 HydrophobicContact CB-CD1 4.46Å; V329-F337 HydrophobicContact CG1-CB 3.99Å; V329-F337 HydrophobicContact CG1-CD1 4.04Å; V329-F337 HydrophobicContact CG1-CG 4.12Å; V329-F337 HydrophobicContact CG2-CD1 3.64Å; V329-F337 HydrophobicContact CG2-CE1 3.75Å; V329-F337 HydrophobicContact CG2-CG 4.38Å; V329-V427 HydrophobicContact CB-CG1 4.18Å; V329-V427 HydrophobicContact CG2-CG1 3.74Å; V329-I428 PolarHBondContact N-O 3.07Å; V329-K429 WeakPolarHBondContact O-CA 3.26Å; V329-F430 VanDerWaalsContact C-CE1 3.43Å; V329-F430 PolarHBondContact O-N 2.69Å
330	Q	98.9	Very high	95.3	Very high	26 Å²	26	29.4 Å²	29.4	12%	0.121	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	146.5	-174.4	-161.5	166.8	15.4	0	0	111.5	V296 D298 G332 I333 H334 F430 D431	V296-Q330 PolarHBondContact O-N 3.05Å; D298-Q330 WeakPolarHBondContact OD1-CB 3.38Å; D298-Q330 VanDerWaalsContact OD2-CD 3.29Å; D298-Q330 WeakPolarHBondContact OD2-CG 3.09Å; Q330-G332 VanDerWaalsContact C-N 3.29Å; Q330-G332 PolarHBondContact O-N 3.42Å; Q330-I333 HydrophobicContact CB-CG2 4.42Å; Q330-I333 PolarHBondContact O-N 3.11Å; Q330-H334 WeakPolarHBondContact O-CB 3.34Å; Q330-H334 PolarHBondContact O-N 3.29Å; Q330-F430 CarbonylContact C-O 3.58Å; Q330-F430 WeakPolarHBondContact CA-O 3.49Å; Q330-F430 HydrophobicContact CB-CD2 4.28Å; Q330-F430 HydrophobicContact CB-CE1 3.98Å; Q330-F430 HydrophobicContact CB-CE2 3.61Å; Q330-F430 HydrophobicContact CB-CZ 3.45Å; Q330-F430 VanDerWaalsContact CB-CZ 3.45Å; Q330-F430 HydrophobicContact CG-CD2 4.05Å; Q330-F430 HydrophobicContact CG-CE2 3.53Å; Q330-F430 HydrophobicContact CG-CZ 3.94Å; Q330-D431 PolarHBondContact NE2-O 3Å
331	R	98.8	Very high	95.9	Very high	155 Å²	155	29.3 Å²	29.3	59%	0.585	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-42.4	-173.4	-178.6	-177.5	-64	-148.7	4.9	114.1	I333 K429 F430 D431	R331-I333 PolarHBondContact O-N 3.3Å; R331-K429 HydrophobicContact CB-CD 4.47Å; R331-K429 HydrophobicContact CB-CG 4.49Å; R331-K429 HydrophobicContact CG-CD 4.43Å; R331-F430 PolarHBondContact N-O 3.1Å; R331-D431 IonicContact CZ-OD1 2.77Å; R331-D431 IonicContact CZ-OD2 3.26Å; R331-D431 IonicContact NE-OD1 3.15Å; R331-D431 PolarHBondContact NE-OD1 3.4Å; R331-D431 IonicContact NE-OD2 3.79Å; R331-D431 IonicContact NH2-OD1 3.32Å; R331-D431 PolarHBondContact NH2-OD1 2.98Å; R331-D431 IonicContact NH2-OD2 2.73Å; R331-D431 PolarHBondContact NH2-OD2 2.79Å
332	G	98.7	Very high	96.5	Very high	65 Å²	65	29.9 Å²	29.9	67%	0.67	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-34.9	-174.3	0	0	0	0	0	113.6	D298 Q330	D298-G332 VanDerWaalsContact OD1-C 3.32Å; D298-G332 WeakPolarHBondContact OD1-CA 3.28Å; D298-G332 PolarHBondContact OD1-N 2.93Å; Q330-G332 VanDerWaalsContact C-N 3.29Å; Q330-G332 PolarHBondContact O-N 3.42Å
333	I	98.6	Very high	96.9	Very high	13 Å²	13	34.7 Å²	34.7	7%	0.067	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-10.4	-177.7	-158.8	170.3	0	0	0	113.9	V296 D298 A300 V302 V329 Q330 R331 D335 A336 F337	V296-I333 HydrophobicContact CG1-CD1 4.31Å; V296-I333 HydrophobicContact CG1-CG2 4.14Å; D298-I333 PolarHBondContact OD1-N 2.78Å; A300-I333 HydrophobicContact CB-CD1 4.08Å; A300-I333 WeakPolarHBondContact O-CD1 3.37Å; V302-I333 HydrophobicContact CG2-CD1 3.56Å; V302-I333 HydrophobicContact CG2-CG1 3.64Å; V329-I333 HydrophobicContact CG1-CG2 3.89Å; Q330-I333 HydrophobicContact CB-CG2 4.42Å; Q330-I333 PolarHBondContact O-N 3.11Å; R331-I333 PolarHBondContact O-N 3.3Å; I333-D335 PolarHBondContact O-N 3.4Å; I333-A336 PolarHBondContact O-N 3.17Å; I333-F337 WeakPolarHBondContact O-CB 3.32Å; I333-F337 PolarHBondContact O-N 3.04Å
334	H	98.8	Very high	97.4	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.023	20%	0.198	C	C	.	.	H	α-helix	trans	-49.2	-57	-171.7	176.8	-83.5	0	0	0	114.5	V329 Q330 A336 F337 V338 K429	V329-H334 HydrophobicContact CG1-CB 4.18Å; Q330-H334 WeakPolarHBondContact O-CB 3.34Å; Q330-H334 PolarHBondContact O-N 3.29Å; H334-A336 VanDerWaalsContact C-N 3.32Å; H334-A336 PolarHBondContact O-N 3.26Å; H334-F337 PolarHBondContact O-N 3.02Å; H334-V338 WeakPolarHBondContact O-CG2 3.22Å; H334-V338 PolarHBondContact O-N 3.01Å; H334-K429 WeakPolarHBondContact CD2-CE 3.11Å; H334-K429 VanDerWaalsContact CE1-CE 3.48Å; H334-K429 WeakPolarHBondContact CE1-CE 3.3Å; H334-K429 VanDerWaalsContact ND1-CE 3.29Å; H334-K429 WeakPolarHBondContact ND1-CE 3.47Å
335	D	98.5	Very high	97.8	Very high	113 Å²	113	35.7 Å²	35.7	60%	0.604	20%	0.199	S	C	*	.	H	α-helix	trans	-68.6	-36.1	-171.7	-65.8	-4.3	0	0	0	111.4	I333 K339 K429	I333-D335 PolarHBondContact O-N 3.4Å; D335-K339 VanDerWaalsContact O-CB 3.32Å; D335-K339 WeakPolarHBondContact O-CB 3.37Å; D335-K339 PolarHBondContact O-N 3.25Å; D335-K339 VanDerWaalsContact O-N 3.15Å; D335-K429 IonicContact OD1-NZ 2.81Å
336	A	98.7	Very high	98.3	Very high	56 Å²	56	44.4 Å²	44.4	46%	0.463	24%	0.237	S	C	.	.	H	α-helix	trans	-64.3	-45.9	174.5	0	0	0	0	0	111.3	I333 H334 A340	I333-A336 PolarHBondContact O-N 3.17Å; H334-A336 VanDerWaalsContact C-N 3.32Å; H334-A336 PolarHBondContact O-N 3.26Å; A336-A340 VanDerWaalsContact O-CB 3.3Å; A336-A340 WeakPolarHBondContact O-CB 3.39Å; A336-A340 PolarHBondContact O-N 2.83Å
337	F	98.9	Very high	98.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-51	177.9	176.7	-92.9	0	0	0	112.1	V296 A305 V306 A309 F327 V329 I333 H334 K339 A340 F341	V296-F337 HydrophobicContact CG1-CD2 4.17Å; V296-F337 HydrophobicContact CG2-CD2 4.24Å; V296-F337 HydrophobicContact CG2-CE2 3.88Å; V296-F337 HydrophobicContact CG2-CZ 4.12Å; A305-F337 HydrophobicContact CB-CD2 4.18Å; A305-F337 HydrophobicContact CB-CE2 3.96Å; V306-F337 HydrophobicContact CG2-CD2 3.75Å; V306-F337 HydrophobicContact CG2-CE2 3.8Å; A309-F337 HydrophobicContact CB-CE2 4.43Å; A309-F337 HydrophobicContact CB-CZ 4.02Å; F327-F337 HydrophobicContact CD1-CE1 4.36Å; F327-F337 HydrophobicContact CD1-CZ 4.12Å; V329-F337 HydrophobicContact CB-CD1 4.46Å; V329-F337 HydrophobicContact CG1-CB 3.99Å; V329-F337 HydrophobicContact CG1-CD1 4.04Å; V329-F337 HydrophobicContact CG1-CG 4.12Å; V329-F337 HydrophobicContact CG2-CD1 3.64Å; V329-F337 HydrophobicContact CG2-CE1 3.75Å; V329-F337 HydrophobicContact CG2-CG 4.38Å; I333-F337 WeakPolarHBondContact O-CB 3.32Å; I333-F337 PolarHBondContact O-N 3.04Å; H334-F337 PolarHBondContact O-N 3.02Å; F337-K339 VanDerWaalsContact C-N 3.31Å; F337-K339 PolarHBondContact O-N 3.36Å; F337-A340 PolarHBondContact O-N 3.4Å; F337-F341 HydrophobicContact CE1-CB 4.39Å; F337-F341 AromaticContact CE1-CD1 3.72Å; F337-F341 HydrophobicContact CE1-CD1 3.72Å; F337-F341 HydrophobicContact CE1-CE1 4.42Å; F337-F341 HydrophobicContact CE1-CG 4.41Å; F337-F341 AromaticContact CZ-CD1 3.85Å; F337-F341 HydrophobicContact CZ-CD1 3.85Å; F337-F341 HydrophobicContact CZ-CE1 4.34Å; F337-F341 HydrophobicContact CZ-CG 4.36Å; F337-F341 VanDerWaalsContact O-CB 3.25Å; F337-F341 WeakPolarHBondContact O-CB 3.3Å; F337-F341 PolarHBondContact O-N 3.37Å
338	V	98.8	Very high	98.7	Very high	12 Å²	12	55.2 Å²	55.2	7%	0.073	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-43.3	-177.7	171.7	0	0	0	0	111.1	H334 A342 V388 L405 C407 V427	H334-V338 WeakPolarHBondContact O-CG2 3.22Å; H334-V338 PolarHBondContact O-N 3.01Å; V338-A342 WeakPolarHBondContact O-CB 3.26Å; V338-A342 PolarHBondContact O-N 3.01Å; V338-V388 HydrophobicContact CG1-CG1 4.35Å; V338-V388 HydrophobicContact CG1-CG2 3.99Å; V338-L405 HydrophobicContact CG1-CD2 4.26Å; V338-C407 HydrophobicContact CG1-CB 4.25Å; V338-V427 HydrophobicContact CG2-CB 4.43Å; V338-V427 HydrophobicContact CG2-CG1 3.93Å; V338-V427 HydrophobicContact CG2-CG2 4.34Å
339	K	98.8	Very high	98.6	Very high	127 Å²	127	56.5 Å²	56.5	55%	0.552	29%	0.294	S	S	*	.	H	α-helix	trans	-62.2	-52.2	176.5	-179.3	178.5	177.1	-66.4	0	111.5	D335 F337 F341 A342 E343	D335-K339 VanDerWaalsContact O-CB 3.32Å; D335-K339 WeakPolarHBondContact O-CB 3.37Å; D335-K339 PolarHBondContact O-N 3.25Å; D335-K339 VanDerWaalsContact O-N 3.15Å; F337-K339 VanDerWaalsContact C-N 3.31Å; F337-K339 PolarHBondContact O-N 3.36Å; K339-F341 VanDerWaalsContact C-N 3.29Å; K339-F341 PolarHBondContact O-N 3.37Å; K339-A342 PolarHBondContact O-N 3.48Å; K339-E343 WeakPolarHBondContact CE-OE1 3.37Å; K339-E343 IonicContact NZ-OE1 2.74Å; K339-E343 PolarHBondContact NZ-OE1 2.84Å; K339-E343 IonicContact NZ-OE2 2.83Å; K339-E343 WeakPolarHBondContact O-CG 3.38Å; K339-E343 PolarHBondContact O-N 3.49Å
340	A	98.8	Very high	98.6	Very high	21 Å²	21	64 Å²	64	17%	0.174	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-36.3	-179.2	0	0	0	0	0	112	V302 V306 A336 F337 E343 A344	V302-A340 HydrophobicContact CG1-CB 4.14Å; V306-A340 HydrophobicContact CG2-CB 3.89Å; A336-A340 VanDerWaalsContact O-CB 3.3Å; A336-A340 WeakPolarHBondContact O-CB 3.39Å; A336-A340 PolarHBondContact O-N 2.83Å; F337-A340 PolarHBondContact O-N 3.4Å; A340-E343 PolarHBondContact O-N 3.4Å; A340-A344 WeakPolarHBondContact O-CB 3.19Å; A340-A344 PolarHBondContact O-N 3.47Å
341	F	98.8	Very high	98.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66	-45.9	177.4	-165.8	-170.5	0	0	0	111.6	V306 A309 M310 F314 F327 F337 K339 E343 A344 M345 L405 A425	V306-F341 HydrophobicContact CG1-CD2 4.34Å; V306-F341 HydrophobicContact CG2-CB 4.24Å; A309-F341 HydrophobicContact CB-CD1 4.45Å; A309-F341 HydrophobicContact CB-CD2 4.37Å; A309-F341 HydrophobicContact CB-CE1 3.93Å; A309-F341 HydrophobicContact CB-CE2 3.81Å; A309-F341 HydrophobicContact CB-CZ 3.58Å; M310-F341 HydrophobicContact CG-CD2 4.14Å; M310-F341 HydrophobicContact CG-CE2 3.91Å; M310-F341 HydrophobicContact SD-CD2 3.94Å; M310-F341 HydrophobicContact SD-CE2 3.68Å; F314-F341 HydrophobicContact CD2-CE2 4.38Å; F314-F341 AromaticContact CE2-CE2 3.61Å; F314-F341 HydrophobicContact CE2-CE2 3.61Å; F314-F341 AromaticContact CE2-CZ 3.72Å; F314-F341 HydrophobicContact CE2-CZ 3.72Å; F314-F341 HydrophobicContact CZ-CZ 4.4Å; F327-F341 HydrophobicContact CD1-CE1 4.26Å; F327-F341 HydrophobicContact CD2-CE1 4.33Å; F327-F341 AromaticContact CE1-CE1 3.9Å; F327-F341 HydrophobicContact CE1-CE1 3.9Å; F327-F341 HydrophobicContact CE1-CZ 4.24Å; F327-F341 AromaticContact CE2-CE1 3.95Å; F327-F341 HydrophobicContact CE2-CE1 3.95Å; F327-F341 HydrophobicContact CE2-CZ 4.29Å; F327-F341 HydrophobicContact CG-CE1 4.47Å; F327-F341 AromaticContact CZ-CE1 3.7Å; F327-F341 HydrophobicContact CZ-CE1 3.7Å; F327-F341 AromaticContact CZ-CZ 3.81Å; F327-F341 HydrophobicContact CZ-CZ 3.81Å; F337-F341 HydrophobicContact CE1-CB 4.39Å; F337-F341 AromaticContact CE1-CD1 3.72Å; F337-F341 HydrophobicContact CE1-CD1 3.72Å; F337-F341 HydrophobicContact CE1-CE1 4.42Å; F337-F341 HydrophobicContact CE1-CG 4.41Å; F337-F341 AromaticContact CZ-CD1 3.85Å; F337-F341 HydrophobicContact CZ-CD1 3.85Å; F337-F341 HydrophobicContact CZ-CE1 4.34Å; F337-F341 HydrophobicContact CZ-CG 4.36Å; F337-F341 VanDerWaalsContact O-CB 3.25Å; F337-F341 WeakPolarHBondContact O-CB 3.3Å; F337-F341 PolarHBondContact O-N 3.37Å; K339-F341 VanDerWaalsContact C-N 3.29Å; K339-F341 PolarHBondContact O-N 3.37Å; F341-E343 VanDerWaalsContact C-N 3.33Å; F341-E343 PolarHBondContact O-N 3.29Å; F341-A344 PolarHBondContact O-N 2.93Å; F341-M345 HydrophobicContact CD2-CG 4.1Å; F341-M345 HydrophobicContact CD2-SD 4.26Å; F341-M345 HydrophobicContact CE2-CG 4.16Å; F341-M345 HydrophobicContact CE2-SD 4.32Å; F341-M345 VanDerWaalsContact O-CG 3.27Å; F341-M345 WeakPolarHBondContact O-CG 3.34Å; F341-M345 PolarHBondContact O-N 3.34Å; F341-L405 HydrophobicContact CB-CD2 4.35Å; F341-L405 HydrophobicContact CD1-CD1 3.66Å; F341-L405 HydrophobicContact CD1-CD2 4.37Å; F341-L405 HydrophobicContact CE1-CD1 3.86Å; F341-L405 HydrophobicContact CG-CD1 4.46Å; F341-L405 HydrophobicContact CG-CD2 4.48Å; F341-A425 HydrophobicContact CE1-CB 4.12Å; F341-A425 HydrophobicContact CZ-CB 4.43Å
342	A	98.8	Very high	98.3	Very high	18 Å²	18	57 Å²	57	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-41	175.1	0	0	0	0	0	112.5	V338 K339 M345 K346 V388 L405	V338-A342 WeakPolarHBondContact O-CB 3.26Å; V338-A342 PolarHBondContact O-N 3.01Å; K339-A342 PolarHBondContact O-N 3.48Å; A342-M345 PolarHBondContact O-N 3.09Å; A342-K346 PolarHBondContact O-N 2.86Å; A342-V388 HydrophobicContact CB-CG1 3.73Å; A342-L405 HydrophobicContact CB-CD2 3.89Å
343	E	98.8	Very high	97.6	Very high	104 Å²	104	55.3 Å²	55.3	49%	0.486	28%	0.275	S	S	.	.	H	α-helix	trans	-64.1	-43.8	176.5	-73.5	174.1	177.5	0	0	111.8	K339 A340 F341 K346 K347	K339-E343 WeakPolarHBondContact CE-OE1 3.37Å; K339-E343 IonicContact NZ-OE1 2.74Å; K339-E343 PolarHBondContact NZ-OE1 2.84Å; K339-E343 IonicContact NZ-OE2 2.83Å; K339-E343 WeakPolarHBondContact O-CG 3.38Å; K339-E343 PolarHBondContact O-N 3.49Å; A340-E343 PolarHBondContact O-N 3.4Å; F341-E343 VanDerWaalsContact C-N 3.33Å; F341-E343 PolarHBondContact O-N 3.29Å; E343-K346 PolarHBondContact O-N 2.87Å; E343-K347 WeakPolarHBondContact O-CB 3.49Å; E343-K347 PolarHBondContact O-N 3.5Å
344	A	98.7	Very high	96.9	Very high	15 Å²	15	57.5 Å²	57.5	12%	0.124	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-40	175.7	0	0	0	0	0	112	V306 M310 A340 F341 K347 N348	V306-A344 HydrophobicContact CG1-CB 3.61Å; M310-A344 HydrophobicContact CG-CB 3.95Å; M310-A344 HydrophobicContact SD-CB 3.94Å; A340-A344 WeakPolarHBondContact O-CB 3.19Å; A340-A344 PolarHBondContact O-N 3.47Å; F341-A344 PolarHBondContact O-N 2.93Å; A344-K347 PolarHBondContact O-N 3.18Å; A344-N348 WeakPolarHBondContact O-CB 3.38Å; A344-N348 PolarHBondContact O-N 2.93Å; A344-N348 PolarHBondContact O-ND2 3.33Å
345	M	98.7	Very high	96	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.03	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-51.5	174.2	-72.7	170.1	63.4	0	0	110.9	M310 F314 F341 A342 K347 N348 L349 T389 P403 L405	M310-M345 HydrophobicContact SD-CB 4.43Å; M310-M345 HydrophobicContact SD-CG 3.71Å; F314-M345 HydrophobicContact CD2-CG 4.48Å; F314-M345 HydrophobicContact CE1-CE 4.12Å; F314-M345 HydrophobicContact CE2-CE 4.22Å; F314-M345 HydrophobicContact CE2-CG 3.61Å; F314-M345 HydrophobicContact CE2-SD 3.88Å; F314-M345 HydrophobicContact CZ-CE 3.49Å; F314-M345 VanDerWaalsContact CZ-CE 3.49Å; F314-M345 HydrophobicContact CZ-CG 3.89Å; F314-M345 HydrophobicContact CZ-SD 3.66Å; F341-M345 HydrophobicContact CD2-CG 4.1Å; F341-M345 HydrophobicContact CD2-SD 4.26Å; F341-M345 HydrophobicContact CE2-CG 4.16Å; F341-M345 HydrophobicContact CE2-SD 4.32Å; F341-M345 VanDerWaalsContact O-CG 3.27Å; F341-M345 WeakPolarHBondContact O-CG 3.34Å; F341-M345 PolarHBondContact O-N 3.34Å; A342-M345 PolarHBondContact O-N 3.09Å; M345-K347 VanDerWaalsContact C-N 3.3Å; M345-K347 PolarHBondContact O-N 2.98Å; M345-N348 PolarHBondContact O-N 3.15Å; M345-L349 HydrophobicContact CB-CD1 3.94Å; M345-L349 HydrophobicContact CG-CD1 3.91Å; M345-L349 VanDerWaalsContact O-CB 3.25Å; M345-L349 WeakPolarHBondContact O-CB 3.45Å; M345-L349 WeakPolarHBondContact O-CG 3.03Å; M345-L349 PolarHBondContact O-N 3.25Å; M345-T389 HydrophobicContact CE-CG2 3.52Å; M345-T389 HydrophobicContact SD-CG2 4.15Å; M345-P403 HydrophobicContact CE-CB 3.89Å; M345-P403 WeakPolarHBondContact CE-O 3.36Å; M345-L405 HydrophobicContact CE-CB 3.97Å; M345-L405 HydrophobicContact SD-CB 3.77Å; M345-L405 HydrophobicContact SD-CD1 4.49Å; M345-L405 HydrophobicContact SD-CD2 4.2Å; M345-L405 HydrophobicContact SD-CG 4.39Å
346	K	98.3	Very high	95.3	Very high	183 Å²	183	62.8 Å²	62.8	80%	0.796	32%	0.32	S	S	*	.	H	α-helix	trans	-60.3	-39.3	179.4	-178	178.6	178.6	179.7	0	112.6	A342 E343	A342-K346 PolarHBondContact O-N 2.86Å; E343-K346 PolarHBondContact O-N 2.87Å
347	K	98.3	Very high	94.8	Very high	164 Å²	164	69.9 Å²	69.9	71%	0.713	34%	0.344	S	S	*	.	H	α-helix	trans	-71.6	-39.8	-177.1	-175.4	-179.3	175.7	-178.7	0	112.7	E343 A344 M345	E343-K347 WeakPolarHBondContact O-CB 3.49Å; E343-K347 PolarHBondContact O-N 3.5Å; A344-K347 PolarHBondContact O-N 3.18Å; M345-K347 VanDerWaalsContact C-N 3.3Å; M345-K347 PolarHBondContact O-N 2.98Å
348	N	98	Very high	94.5	Very high	76 Å²	76	71.5 Å²	71.5	41%	0.406	36%	0.36	S	S	.	.	H	α-helix	trans	-112.2	-22.6	-163.1	-56.3	-49.8	0	0	0	114.1	M310 A344 M345 T360	M310-N348 HydrophobicContact CE-CB 3.91Å; A344-N348 WeakPolarHBondContact O-CB 3.38Å; A344-N348 PolarHBondContact O-N 2.93Å; A344-N348 PolarHBondContact O-ND2 3.33Å; M345-N348 PolarHBondContact O-N 3.15Å; N348-T360 PolarHBondContact O-OG1 3.08Å
349	L	98.3	Very high	94.1	Very high	28 Å²	28	72.5 Å²	72.5	15%	0.147	37%	0.367	C	S	.	.			trans	-88.9	116.9	-177.1	-56.4	-178.1	0	0	0	111.1	M310 F314 M345 T360 Q361 P403	M310-L349 HydrophobicContact CE-CD1 4.32Å; M310-L349 HydrophobicContact CE-CD2 3.71Å; M310-L349 HydrophobicContact CE-CG 3.83Å; F314-L349 HydrophobicContact CB-CD1 4.26Å; F314-L349 HydrophobicContact CB-CD2 3.86Å; F314-L349 HydrophobicContact CD1-CD1 3.73Å; F314-L349 HydrophobicContact CD2-CD1 3.72Å; F314-L349 HydrophobicContact CD2-CD2 4.4Å; F314-L349 HydrophobicContact CE1-CD1 3.98Å; F314-L349 HydrophobicContact CE2-CD1 3.95Å; F314-L349 HydrophobicContact CG-CD1 3.62Å; F314-L349 HydrophobicContact CG-CD2 4.12Å; F314-L349 HydrophobicContact CZ-CD1 4.09Å; M345-L349 HydrophobicContact CB-CD1 3.94Å; M345-L349 HydrophobicContact CG-CD1 3.91Å; M345-L349 VanDerWaalsContact O-CB 3.25Å; M345-L349 WeakPolarHBondContact O-CB 3.45Å; M345-L349 WeakPolarHBondContact O-CG 3.03Å; M345-L349 PolarHBondContact O-N 3.25Å; L349-T360 VanDerWaalsContact CA-OG1 3.29Å; L349-T360 WeakPolarHBondContact CA-OG1 3.5Å; L349-Q361 HydrophobicContact CB-CG 4.02Å; L349-Q361 HydrophobicContact CD2-CG 4.06Å; L349-Q361 HydrophobicContact CG-CG 4.42Å; L349-P403 HydrophobicContact CB-CG 4.07Å; L349-P403 HydrophobicContact CD1-CB 3.45Å; L349-P403 VanDerWaalsContact CD1-CB 3.45Å; L349-P403 HydrophobicContact CD1-CG 3.78Å
350	R	97.9	Very high	93.8	Very high	158 Å²	158	69.9 Å²	69.9	60%	0.596	36%	0.361	S	S	*	.			trans	-122.5	107	-179.6	-65.2	178.7	-177.7	-178.6	5.1	108	G358 T360 Q361	R350-G358 WeakPolarHBondContact CB-O 3.31Å; R350-G358 WeakPolarHBondContact CD-O 3.28Å; R350-T360 PolarHBondContact N-OG1 3.19Å; R350-T360 PolarHBondContact O-N 2.82Å; R350-Q361 PolarHBondContact O-N 3.41Å
351	V	98.1	Very high	93.7	Very high	30 Å²	30	69 Å²	69	18%	0.182	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-77.3	124.5	178.3	-175	0	0	0	0	108.8	Q361 H394 L396 F400 P403	V351-Q361 WeakPolarHBondContact CA-O 3.22Å; V351-Q361 HydrophobicContact CB-CB 4.49Å; V351-Q361 HydrophobicContact CG2-CB 4.01Å; V351-H394 HydrophobicContact CG1-CB 4.34Å; V351-L396 HydrophobicContact CG1-CD1 4.31Å; V351-F400 HydrophobicContact CG1-CB 4.09Å; V351-F400 HydrophobicContact CG1-CD1 3.55Å; V351-F400 HydrophobicContact CG1-CE1 4.35Å; V351-F400 HydrophobicContact CG1-CG 4.17Å; V351-P403 HydrophobicContact CG2-CG 4.2Å
352	G	92.2	Very high	93.4	Very high	3 Å²	3	70 Å²	70	3%	0.031	36%	0.364	C	S	.	.	S	Bend	trans	-173.2	-178.8	-175.5	0	0	0	0	0	113.1	T359 Q361 F400	G352-T359 WeakPolarHBondContact O-CG2 3.27Å; G352-Q361 PolarHBondContact N-O 3.42Å; G352-F400 VanDerWaalsContact O-CE1 3.3Å; G352-F400 WeakPolarHBondContact O-CE1 3.37Å
353	N	85.5	Confident	93	Very high	29 Å²	29	70 Å²	70	16%	0.155	36%	0.362	C	S	.	.			trans	-69.5	138	173.8	-172.9	-63.7	0	0	0	109.5	A82 F355 E356 T359	A82-N353 WeakPolarHBondContact CB-ND2 3.41Å; N353-F355 PolarHBondContact O-N 3.48Å; N353-F355 WeakPolarHBondContact OD1-CD2 3.49Å; N353-F355 PolarHBondContact OD1-N 3.27Å; N353-E356 HydrophobicContact CB-CG 3.98Å; N353-E356 PolarHBondContact N-OE2 2.99Å; N353-E356 WeakPolarHBondContact O-CB 3.5Å; N353-E356 PolarHBondContact O-N 3.03Å; N353-T359 VanDerWaalsContact O-CB 3.32Å; N353-T359 WeakPolarHBondContact O-CB 3.43Å; N353-T359 WeakPolarHBondContact O-CG2 3.43Å; N353-T359 PolarHBondContact O-OG1 2.86Å
354	G	84.2	Confident	92.8	Very high	60 Å²	60	65 Å²	65	62%	0.619	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.3	-177.5	0	0	0	0	0	115.3
355	F	78.5	Confident	92.5	Very high	123 Å²	123	65.5 Å²	65.5	54%	0.539	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.9	174.2	-66.2	-75.9	0	0	0	113.9	R140 N353	R140-F355 HydrophobicContact CB-CE1 4.37Å; R140-F355 HydrophobicContact CG-CE1 4.22Å; N353-F355 PolarHBondContact O-N 3.48Å; N353-F355 WeakPolarHBondContact OD1-CD2 3.49Å; N353-F355 PolarHBondContact OD1-N 3.27Å
356	E	84.4	Confident	92.1	Very high	105 Å²	105	67.7 Å²	67.7	49%	0.491	35%	0.351	S	S	.	.	S	Bend	trans	-81.3	132.5	177	-70.4	165.2	-176.8	0	0	110.1	N353 G358 T359	N353-E356 HydrophobicContact CB-CG 3.98Å; N353-E356 PolarHBondContact N-OE2 2.99Å; N353-E356 WeakPolarHBondContact O-CB 3.5Å; N353-E356 PolarHBondContact O-N 3.03Å; E356-G358 PolarHBondContact O-N 3.43Å; E356-T359 WeakPolarHBondContact O-CB 3.09Å; E356-T359 PolarHBondContact O-N 3.46Å; E356-T359 PolarHBondContact O-OG1 3.02Å
357	E	89.1	Confident	91.9	Very high	205 Å²	205	62.3 Å²	62.3	96%	0.958	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	134.1	179.5	-172.1	179	-178.7	0	0	111	T359	E357-T359 VanDerWaalsContact C-N 3.27Å; E357-T359 PolarHBondContact O-N 3.44Å
358	G	91.3	Very high	91.7	Very high	34 Å²	34	60.4 Å²	60.4	35%	0.351	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-1	-179.6	0	0	0	0	0	114.7	R350 E356 T360	R350-G358 WeakPolarHBondContact CB-O 3.31Å; R350-G358 WeakPolarHBondContact CD-O 3.28Å; E356-G358 PolarHBondContact O-N 3.43Å; G358-T360 PolarHBondContact O-N 3.08Å
359	T	90.9	Very high	91.5	Very high	34 Å²	34	57.5 Å²	57.5	21%	0.209	31%	0.307	C	S	.	.			trans	-61.7	128.5	166.2	-69	0	0	0	0	109.6	G352 N353 E356 E357	G352-T359 WeakPolarHBondContact O-CG2 3.27Å; N353-T359 VanDerWaalsContact O-CB 3.32Å; N353-T359 WeakPolarHBondContact O-CB 3.43Å; N353-T359 WeakPolarHBondContact O-CG2 3.43Å; N353-T359 PolarHBondContact O-OG1 2.86Å; E356-T359 WeakPolarHBondContact O-CB 3.09Å; E356-T359 PolarHBondContact O-N 3.46Å; E356-T359 PolarHBondContact O-OG1 3.02Å; E357-T359 VanDerWaalsContact C-N 3.27Å; E357-T359 PolarHBondContact O-N 3.44Å
360	T	93.4	Very high	91.5	Very high	71 Å²	71	56.2 Å²	56.2	44%	0.436	30%	0.3	S	S	.	.			trans	-120.1	-11.2	174.9	58.9	0	0	0	0	112.6	N348 L349 R350 G358	N348-T360 PolarHBondContact O-OG1 3.08Å; L349-T360 VanDerWaalsContact CA-OG1 3.29Å; L349-T360 WeakPolarHBondContact CA-OG1 3.5Å; R350-T360 PolarHBondContact N-OG1 3.19Å; R350-T360 PolarHBondContact O-N 2.82Å; G358-T360 PolarHBondContact O-N 3.08Å
361	Q	96.3	Very high	91.5	Very high	3 Å²	3	53.3 Å²	53.3	1%	0.014	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-128	112.7	172.7	-67.1	-64.3	-82.9	0	0	110.3	F314 L349 R350 V351 G352 P403	F314-Q361 PolarHBondContact O-NE2 3.25Å; L349-Q361 HydrophobicContact CB-CG 4.02Å; L349-Q361 HydrophobicContact CD2-CG 4.06Å; L349-Q361 HydrophobicContact CG-CG 4.42Å; R350-Q361 PolarHBondContact O-N 3.41Å; V351-Q361 WeakPolarHBondContact CA-O 3.22Å; V351-Q361 HydrophobicContact CB-CB 4.49Å; V351-Q361 HydrophobicContact CG2-CB 4.01Å; G352-Q361 PolarHBondContact N-O 3.42Å; Q361-P403 HydrophobicContact CG-CG 3.92Å
362	G	91.6	Very high	91.4	Very high	20 Å²	20	55.7 Å²	55.7	21%	0.206	30%	0.302	C	S	.	.			trans	-83.1	178.5	171.6	0	0	0	0	0	112.3	T317	T317-G362 WeakPolarHBondContact CG2-O 3.41Å; T317-G362 PolarHBondContact OG1-N 2.87Å; T317-G362 VanDerWaalsContact OG1-N 3.11Å; T317-G362 PolarHBondContact OG1-O 3.36Å
363	P	91.3	Very high	91.7	Very high	18 Å²	18	55.7 Å²	55.7	12%	0.117	30%	0.301	C	S	.	.			trans	-67.1	161.9	175.2	35	-40.6	0	0	0	111.6	P81 A82 Q319 N399 F400	P81-P363 HydrophobicContact CB-CG 4.04Å; P81-P363 HydrophobicContact CG-CG 4.11Å; A82-P363 HydrophobicContact CB-CG 3.81Å; Q319-P363 PolarHBondContact NE2-O 3.11Å; P363-N399 HydrophobicContact CB-CB 4.05Å; P363-F400 HydrophobicContact CB-CD1 3.95Å; P363-F400 HydrophobicContact CB-CE1 3.75Å; P363-F400 HydrophobicContact CB-CE2 4.4Å; P363-F400 HydrophobicContact CB-CG 4.39Å; P363-F400 HydrophobicContact CB-CZ 4Å; P363-F400 HydrophobicContact CG-CE1 4.23Å; P363-F400 HydrophobicContact CG-CZ 4.37Å
364	L	94.6	Very high	92.2	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.304	C	S	.	.			trans	-69.2	157.3	159.8	-66.2	179	0	0	0	110.6	T317 Q319 N366 A369 V370 V373 N399 F401	T317-L364 HydrophobicContact CG2-CD2 4.23Å; Q319-L364 HydrophobicContact CG-CD2 3.82Å; Q319-L364 VanDerWaalsContact OE1-CA 3.28Å; L364-N366 VanDerWaalsContact C-N 3.32Å; L364-N366 PolarHBondContact O-N 3.3Å; L364-A369 HydrophobicContact CB-CB 4.01Å; L364-A369 HydrophobicContact CD1-CB 4.26Å; L364-V370 HydrophobicContact CB-CG2 4.3Å; L364-V370 HydrophobicContact CD1-CB 4.45Å; L364-V370 HydrophobicContact CD1-CG2 4.04Å; L364-V373 HydrophobicContact CD1-CG2 3.98Å; L364-N399 HydrophobicContact CB-CB 4.47Å; L364-N399 WeakPolarHBondContact CB-O 3.39Å; L364-N399 PolarHBondContact N-O 3.26Å; L364-N399 WeakPolarHBondContact O-CB 3.43Å; L364-F401 HydrophobicContact CD1-CB 4.16Å
365	I	91.7	Very high	92.9	Very high	26 Å²	26	59.3 Å²	59.3	13%	0.133	30%	0.299	C	S	.	.	S	Bend	trans	-61.3	-36.6	-172.5	-169	61.5	0	0	0	113.8	W185 D213 A369	W185-I365 HydrophobicContact CD2-CB 4.14Å; W185-I365 HydrophobicContact CD2-CD1 4.08Å; W185-I365 HydrophobicContact CD2-CG1 3.72Å; W185-I365 HydrophobicContact CD2-CG2 4.38Å; W185-I365 HydrophobicContact CE3-CB 3.93Å; W185-I365 HydrophobicContact CE3-CD1 3.72Å; W185-I365 HydrophobicContact CE3-CG1 3.74Å; W185-I365 HydrophobicContact CG-CD1 4.48Å; W185-I365 HydrophobicContact CG-CG1 4.19Å; W185-I365 HydrophobicContact CH2-CB 3.62Å; W185-I365 HydrophobicContact CH2-CG1 4.3Å; W185-I365 HydrophobicContact CH2-CG2 3.61Å; W185-I365 HydrophobicContact CZ2-CB 3.87Å; W185-I365 HydrophobicContact CZ2-CG1 4.33Å; W185-I365 HydrophobicContact CZ2-CG2 3.44Å; W185-I365 VanDerWaalsContact CZ2-CG2 3.44Å; W185-I365 HydrophobicContact CZ3-CB 3.67Å; W185-I365 HydrophobicContact CZ3-CD1 4.19Å; W185-I365 HydrophobicContact CZ3-CG1 4.05Å; W185-I365 HydrophobicContact CZ3-CG2 4.19Å; D213-I365 HydrophobicContact CB-CD1 4Å; D213-I365 HydrophobicContact CB-CG1 4.15Å; I365-A369 HydrophobicContact CG2-CB 4.06Å
366	N	89.3	Confident	93.8	Very high	52 Å²	52	53.4 Å²	53.4	28%	0.278	27%	0.273	S	S	.	.	S	Bend	trans	-162.2	172.6	179.8	58.6	50.4	0	0	0	111.8	L364 K368 A369 V370	L364-N366 VanDerWaalsContact C-N 3.32Å; L364-N366 PolarHBondContact O-N 3.3Å; N366-K368 VanDerWaalsContact C-N 3.27Å; N366-K368 PolarHBondContact O-N 3.07Å; N366-K368 WeakPolarHBondContact OD1-CB 3.47Å; N366-K368 PolarHBondContact OD1-N 3.24Å; N366-A369 WeakPolarHBondContact O-CB 3.31Å; N366-A369 PolarHBondContact O-N 3.47Å; N366-A369 PolarHBondContact OD1-N 2.84Å; N366-V370 PolarHBondContact O-N 3.5Å
367	E	95	Very high	94.5	Very high	69 Å²	69	48.6 Å²	48.6	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-55.6	-38.2	-178.5	-178.9	59.9	-159.1	0	0	113.1	A369 V370 E371 R393 N399	E367-A369 PolarHBondContact O-N 2.66Å; E367-V370 WeakPolarHBondContact O-CA 3.37Å; E367-V370 WeakPolarHBondContact O-CB 3.42Å; E367-V370 PolarHBondContact O-N 2.95Å; E367-E371 HydrophobicContact CG-CG 4.37Å; E367-E371 WeakPolarHBondContact O-CG 3.39Å; E367-E371 PolarHBondContact O-N 3.37Å; E367-R393 VanDerWaalsContact CD-NH1 3.34Å; E367-R393 IonicContact OE1-CZ 2.88Å; E367-R393 IonicContact OE1-NH1 2.76Å; E367-R393 PolarHBondContact OE1-NH1 3.36Å; E367-R393 IonicContact OE1-NH2 2.66Å; E367-R393 PolarHBondContact OE1-NH2 2.79Å; E367-R393 IonicContact OE2-NH1 3.17Å; E367-R393 PolarHBondContact OE2-NH1 2.78Å; E367-R393 VanDerWaalsContact OE2-NH1 3.15Å; E367-N399 PolarHBondContact N-OD1 2.85Å
368	K	94.8	Very high	94.9	Very high	124 Å²	124	43.8 Å²	43.8	54%	0.539	23%	0.232	S	C	.	.	H	α-helix	trans	-65.2	-29.3	179.7	-60	-169.1	174.4	-170.8	0	112.6	N366 K372	N366-K368 VanDerWaalsContact C-N 3.27Å; N366-K368 PolarHBondContact O-N 3.07Å; N366-K368 WeakPolarHBondContact OD1-CB 3.47Å; N366-K368 PolarHBondContact OD1-N 3.24Å; K368-K372 WeakPolarHBondContact O-CB 3.28Å; K368-K372 PolarHBondContact O-N 2.79Å; K368-K372 VanDerWaalsContact O-N 3.09Å
369	A	94.1	Very high	95.3	Very high	16 Å²	16	43.6 Å²	43.6	13%	0.132	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-40.7	173.4	0	0	0	0	0	110.7	L364 I365 N366 E367 K372 V373	L364-A369 HydrophobicContact CB-CB 4.01Å; L364-A369 HydrophobicContact CD1-CB 4.26Å; I365-A369 HydrophobicContact CG2-CB 4.06Å; N366-A369 WeakPolarHBondContact O-CB 3.31Å; N366-A369 PolarHBondContact O-N 3.47Å; N366-A369 PolarHBondContact OD1-N 2.84Å; E367-A369 PolarHBondContact O-N 2.66Å; A369-K372 PolarHBondContact O-N 3.23Å; A369-V373 WeakPolarHBondContact O-CG2 3.33Å; A369-V373 PolarHBondContact O-N 3.22Å; A369-V373 VanDerWaalsContact O-N 3.11Å
370	V	97.4	Very high	95.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-52.3	173.8	-174.7	0	0	0	0	110.6	L364 N366 E367 K372 V373 E374 R393 N399 F401	L364-V370 HydrophobicContact CB-CG2 4.3Å; L364-V370 HydrophobicContact CD1-CB 4.45Å; L364-V370 HydrophobicContact CD1-CG2 4.04Å; N366-V370 PolarHBondContact O-N 3.5Å; E367-V370 WeakPolarHBondContact O-CA 3.37Å; E367-V370 WeakPolarHBondContact O-CB 3.42Å; E367-V370 PolarHBondContact O-N 2.95Å; V370-K372 PolarHBondContact O-N 2.79Å; V370-V373 PolarHBondContact O-N 2.79Å; V370-V373 VanDerWaalsContact O-N 3.1Å; V370-E374 HydrophobicContact CG1-CG 4.4Å; V370-E374 WeakPolarHBondContact O-CG 3.32Å; V370-E374 PolarHBondContact O-N 3.44Å; V370-R393 HydrophobicContact CG1-CG 3.92Å; V370-N399 HydrophobicContact CG2-CB 4.17Å; V370-F401 HydrophobicContact CG1-CD2 4.1Å
371	E	97.3	Very high	95.9	Very high	98 Å²	98	41.7 Å²	41.7	46%	0.458	21%	0.211	S	C	.	.	H	α-helix	trans	-55.1	-39.2	178.6	-69.4	170.1	174.2	0	0	111.8	E367 K375	E367-E371 HydrophobicContact CG-CG 4.37Å; E367-E371 WeakPolarHBondContact O-CG 3.39Å; E367-E371 PolarHBondContact O-N 3.37Å; E371-K375 VanDerWaalsContact O-CB 3.31Å; E371-K375 WeakPolarHBondContact O-CB 3.38Å; E371-K375 PolarHBondContact O-N 2.94Å
372	K	96.4	Very high	96	Very high	80 Å²	80	46 Å²	46	35%	0.348	24%	0.242	S	C	.	.	H	α-helix	trans	-67	-44.3	178.1	-175.7	173.2	177	179.8	0	112.1	K368 A369 V370 K375 Q376 E419	K368-K372 WeakPolarHBondContact O-CB 3.28Å; K368-K372 PolarHBondContact O-N 2.79Å; K368-K372 VanDerWaalsContact O-N 3.09Å; A369-K372 PolarHBondContact O-N 3.23Å; V370-K372 PolarHBondContact O-N 2.79Å; K372-K375 PolarHBondContact O-N 3.04Å; K372-Q376 WeakPolarHBondContact O-CG 3.26Å; K372-Q376 PolarHBondContact O-N 3.02Å; K372-Q376 VanDerWaalsContact O-N 3.09Å; K372-E419 VanDerWaalsContact CE-O 3.22Å; K372-E419 WeakPolarHBondContact CE-O 3.48Å; K372-E419 PolarHBondContact NZ-O 2.95Å
373	V	97.8	Very high	96.3	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-64.3	-44.9	176.8	177.3	0	0	0	0	110.2	L364 A369 V370 K375 Q376 V377 F401 L424	L364-V373 HydrophobicContact CD1-CG2 3.98Å; A369-V373 WeakPolarHBondContact O-CG2 3.33Å; A369-V373 PolarHBondContact O-N 3.22Å; A369-V373 VanDerWaalsContact O-N 3.11Å; V370-V373 PolarHBondContact O-N 2.79Å; V370-V373 VanDerWaalsContact O-N 3.1Å; V373-K375 VanDerWaalsContact C-N 3.33Å; V373-K375 PolarHBondContact O-N 3.08Å; V373-Q376 PolarHBondContact O-N 3.46Å; V373-V377 HydrophobicContact CG1-CG2 4.41Å; V373-V377 WeakPolarHBondContact O-CG2 3.48Å; V373-V377 PolarHBondContact O-N 3.33Å; V373-F401 HydrophobicContact CG1-CD1 3.61Å; V373-F401 HydrophobicContact CG1-CD2 4.44Å; V373-F401 HydrophobicContact CG1-CE1 3.39Å; V373-F401 HydrophobicContact CG1-CE2 4.27Å; V373-F401 HydrophobicContact CG1-CG 4.15Å; V373-F401 HydrophobicContact CG1-CZ 3.76Å; V373-L424 HydrophobicContact CG1-CB 4.31Å
374	E	97.9	Very high	96.6	Very high	49 Å²	49	50.7 Å²	50.7	23%	0.229	27%	0.268	C	S	.	.	H	α-helix	trans	-56.1	-46.7	174.6	-74.7	-178.8	135.6	0	0	112	V370 Q376 V377 N378 R393 F401	V370-E374 HydrophobicContact CG1-CG 4.4Å; V370-E374 WeakPolarHBondContact O-CG 3.32Å; V370-E374 PolarHBondContact O-N 3.44Å; E374-Q376 VanDerWaalsContact C-N 3.31Å; E374-Q376 PolarHBondContact O-N 3.32Å; E374-V377 PolarHBondContact O-N 3.31Å; E374-N378 WeakPolarHBondContact O-CB 3.12Å; E374-N378 PolarHBondContact O-N 3.37Å; E374-N378 PolarHBondContact O-ND2 2.81Å; E374-N378 VanDerWaalsContact O-ND2 3.15Å; E374-R393 VanDerWaalsContact CD-NE 3.26Å; E374-R393 WeakPolarHBondContact OE1-CD 3.5Å; E374-R393 WeakPolarHBondContact OE1-CG 3.46Å; E374-R393 IonicContact OE1-CZ 3.94Å; E374-R393 IonicContact OE1-NE 3.41Å; E374-R393 PolarHBondContact OE1-NE 3Å; E374-R393 IonicContact OE1-NH2 2.64Å; E374-R393 IonicContact OE2-CZ 3.31Å; E374-R393 IonicContact OE2-NE 3.63Å; E374-R393 PolarHBondContact OE2-NE 2.9Å; E374-R393 IonicContact OE2-NH2 2.92Å; E374-R393 PolarHBondContact OE2-NH2 3.19Å; E374-F401 HydrophobicContact CG-CD2 4.4Å; E374-F401 HydrophobicContact CG-CE2 3.55Å; E374-F401 HydrophobicContact CG-CZ 4.31Å
375	K	97.9	Very high	96.8	Very high	116 Å²	116	51 Å²	51	50%	0.504	27%	0.271	S	S	.	.	H	α-helix	trans	-58.2	-43.8	178.1	-173.6	-172.9	176.7	-158.7	0	111.7	E371 K372 V373 D379	E371-K375 VanDerWaalsContact O-CB 3.31Å; E371-K375 WeakPolarHBondContact O-CB 3.38Å; E371-K375 PolarHBondContact O-N 2.94Å; K372-K375 PolarHBondContact O-N 3.04Å; V373-K375 VanDerWaalsContact C-N 3.33Å; V373-K375 PolarHBondContact O-N 3.08Å; K375-D379 VanDerWaalsContact O-CB 3.31Å; K375-D379 WeakPolarHBondContact O-CB 3.28Å; K375-D379 PolarHBondContact O-N 2.84Å
376	Q	98.1	Very high	97.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69.4	-40	-179.9	-72.6	173.9	-22.5	0	0	112.6	K372 V373 E374 A380 C415 T420 L424	K372-Q376 WeakPolarHBondContact O-CG 3.26Å; K372-Q376 PolarHBondContact O-N 3.02Å; K372-Q376 VanDerWaalsContact O-N 3.09Å; V373-Q376 PolarHBondContact O-N 3.46Å; E374-Q376 VanDerWaalsContact C-N 3.31Å; E374-Q376 PolarHBondContact O-N 3.32Å; Q376-A380 WeakPolarHBondContact O-CB 3.44Å; Q376-A380 PolarHBondContact O-N 3.36Å; Q376-C415 HydrophobicContact CB-CB 4.27Å; Q376-T420 VanDerWaalsContact CD-OG1 3.22Å; Q376-T420 PolarHBondContact NE2-OG1 2.82Å; Q376-T420 PolarHBondContact OE1-OG1 2.87Å; Q376-L424 HydrophobicContact CB-CD2 3.81Å
377	V	98.4	Very high	97.6	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-49.6	174.4	173.6	0	0	0	0	110.3	V373 E374 D379 A380 V381 F401 T404 L424	V373-V377 HydrophobicContact CG1-CG2 4.41Å; V373-V377 WeakPolarHBondContact O-CG2 3.48Å; V373-V377 PolarHBondContact O-N 3.33Å; E374-V377 PolarHBondContact O-N 3.31Å; V377-D379 PolarHBondContact O-N 3.3Å; V377-A380 PolarHBondContact O-N 3.48Å; V377-V381 HydrophobicContact CG1-CG2 4.32Å; V377-V381 WeakPolarHBondContact O-CG2 3.47Å; V377-V381 PolarHBondContact O-N 3.04Å; V377-F401 HydrophobicContact CG2-CE1 4.43Å; V377-F401 HydrophobicContact CG2-CZ 4.34Å; V377-T404 HydrophobicContact CG2-CG2 4.13Å; V377-L424 HydrophobicContact CG2-CD1 3.86Å; V377-L424 HydrophobicContact CG2-CD2 3.97Å; V377-L424 HydrophobicContact CG2-CG 4.5Å
378	N	98.3	Very high	97.8	Very high	105 Å²	105	52.7 Å²	52.7	56%	0.561	29%	0.289	S	S	*	.	H	α-helix	trans	-62.6	-44.7	-178.5	-69.7	-27.9	0	0	0	112	E374 V381 S382	E374-N378 WeakPolarHBondContact O-CB 3.12Å; E374-N378 PolarHBondContact O-N 3.37Å; E374-N378 PolarHBondContact O-ND2 2.81Å; E374-N378 VanDerWaalsContact O-ND2 3.15Å; N378-V381 PolarHBondContact O-N 3.22Å; N378-S382 VanDerWaalsContact O-CB 3.24Å; N378-S382 WeakPolarHBondContact O-CB 3.46Å; N378-S382 PolarHBondContact O-N 3.27Å; N378-S382 PolarHBondContact O-OG 2.86Å
379	D	98.6	Very high	97.9	Very high	30 Å²	30	49.1 Å²	49.1	16%	0.16	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-50.6	175.3	178.6	83.4	0	0	0	111.5	K375 V377 V381 S382 K383 L414	K375-D379 VanDerWaalsContact O-CB 3.31Å; K375-D379 WeakPolarHBondContact O-CB 3.28Å; K375-D379 PolarHBondContact O-N 2.84Å; V377-D379 PolarHBondContact O-N 3.3Å; D379-V381 PolarHBondContact O-N 3.13Å; D379-S382 PolarHBondContact O-N 3.14Å; D379-S382 PolarHBondContact O-OG 2.91Å; D379-K383 VanDerWaalsContact CG-NZ 3.29Å; D379-K383 WeakPolarHBondContact O-CG 3.49Å; D379-K383 PolarHBondContact O-N 3.36Å; D379-K383 WeakPolarHBondContact OD1-CE 3.47Å; D379-K383 IonicContact OD1-NZ 3.84Å; D379-K383 PolarHBondContact OD1-NZ 2.88Å; D379-K383 IonicContact OD2-NZ 3.76Å; D379-K383 PolarHBondContact OD2-NZ 3.43Å; D379-L414 HydrophobicContact CB-CB 4.26Å; D379-L414 HydrophobicContact CB-CD1 3.77Å; D379-L414 HydrophobicContact CB-CG 4.12Å; D379-L414 VanDerWaalsContact CG-CG 3.45Å; D379-L414 WeakPolarHBondContact OD2-CB 3.26Å; D379-L414 VanDerWaalsContact OD2-CG 3.3Å; D379-L414 WeakPolarHBondContact OD2-CG 3.33Å; D379-L414 PolarHBondContact OD2-N 3.35Å
380	A	98.3	Very high	98.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-47.7	-179.5	0	0	0	0	0	112	Q376 V377 S382 K383 G384 A385 L406 M413	Q376-A380 WeakPolarHBondContact O-CB 3.44Å; Q376-A380 PolarHBondContact O-N 3.36Å; V377-A380 PolarHBondContact O-N 3.48Å; A380-S382 VanDerWaalsContact C-N 3.35Å; A380-S382 PolarHBondContact O-N 2.97Å; A380-K383 CarbonylContact O-C 3.52Å; A380-K383 PolarHBondContact O-N 3.43Å; A380-K383 VanDerWaalsContact O-N 3.12Å; A380-G384 PolarHBondContact O-N 2.73Å; A380-A385 VanDerWaalsContact C-CB 3.45Å; A380-A385 HydrophobicContact CB-CB 3.8Å; A380-A385 WeakPolarHBondContact O-CB 3.39Å; A380-A385 PolarHBondContact O-N 3.36Å; A380-L406 HydrophobicContact CB-CD1 3.76Å; A380-M413 HydrophobicContact CB-CB 4.43Å; A380-M413 HydrophobicContact CB-SD 3.72Å
381	V	98.5	Very high	98.1	Very high	64 Å²	64	50.3 Å²	50.3	39%	0.388	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-41.1	179.2	173.3	0	0	0	0	111.1	V377 N378 D379 K383 G384 V387	V377-V381 HydrophobicContact CG1-CG2 4.32Å; V377-V381 WeakPolarHBondContact O-CG2 3.47Å; V377-V381 PolarHBondContact O-N 3.04Å; N378-V381 PolarHBondContact O-N 3.22Å; D379-V381 PolarHBondContact O-N 3.13Å; V381-K383 PolarHBondContact O-N 3.2Å; V381-K383 VanDerWaalsContact O-N 3.13Å; V381-G384 PolarHBondContact O-N 2.95Å; V381-G384 VanDerWaalsContact O-N 3.1Å; V381-V387 HydrophobicContact CG2-CG2 3.56Å
382	S	98.3	Very high	98.2	Very high	95 Å²	95	51.8 Å²	51.8	66%	0.664	30%	0.296	S	S	*	.	H	α-helix	trans	-62.5	-19.1	176.6	75.3	0	0	0	0	113.9	N378 D379 A380	N378-S382 VanDerWaalsContact O-CB 3.24Å; N378-S382 WeakPolarHBondContact O-CB 3.46Å; N378-S382 PolarHBondContact O-N 3.27Å; N378-S382 PolarHBondContact O-OG 2.86Å; D379-S382 PolarHBondContact O-N 3.14Å; D379-S382 PolarHBondContact O-OG 2.91Å; A380-S382 VanDerWaalsContact C-N 3.35Å; A380-S382 PolarHBondContact O-N 2.97Å
383	K	98.5	Very high	98.3	Very high	87 Å²	87	51.9 Å²	51.9	38%	0.378	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	8.6	178.7	-68.8	172.8	179.9	167.4	0	113.7	D379 A380 V381 D412 M413	D379-K383 VanDerWaalsContact CG-NZ 3.29Å; D379-K383 WeakPolarHBondContact O-CG 3.49Å; D379-K383 PolarHBondContact O-N 3.36Å; D379-K383 WeakPolarHBondContact OD1-CE 3.47Å; D379-K383 IonicContact OD1-NZ 3.84Å; D379-K383 PolarHBondContact OD1-NZ 2.88Å; D379-K383 IonicContact OD2-NZ 3.76Å; D379-K383 PolarHBondContact OD2-NZ 3.43Å; A380-K383 CarbonylContact O-C 3.52Å; A380-K383 PolarHBondContact O-N 3.43Å; A380-K383 VanDerWaalsContact O-N 3.12Å; V381-K383 PolarHBondContact O-N 3.2Å; V381-K383 VanDerWaalsContact O-N 3.13Å; K383-D412 PolarHBondContact NZ-O 3.31Å; K383-M413 HydrophobicContact CB-CE 3.91Å; K383-M413 HydrophobicContact CB-CG 4.28Å; K383-M413 HydrophobicContact CD-CG 4.17Å
384	G	98.1	Very high	98.3	Very high	49 Å²	49	53.4 Å²	53.4	51%	0.505	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.9	1.5	173.9	0	0	0	0	0	115.9	A380 V381	A380-G384 PolarHBondContact O-N 2.73Å; V381-G384 PolarHBondContact O-N 2.95Å; V381-G384 VanDerWaalsContact O-N 3.1Å
385	A	98.4	Very high	98.3	Very high	7 Å²	7	59.7 Å²	59.7	6%	0.058	33%	0.33	C	S	.	.			trans	-64	148	170.6	0	0	0	0	0	110.8	A380 V409 M413	A380-A385 VanDerWaalsContact C-CB 3.45Å; A380-A385 HydrophobicContact CB-CB 3.8Å; A380-A385 WeakPolarHBondContact O-CB 3.39Å; A380-A385 PolarHBondContact O-N 3.36Å; A385-V409 HydrophobicContact CB-CG2 3.99Å; A385-M413 HydrophobicContact CB-CE 3.94Å; A385-M413 HydrophobicContact CB-SD 3.82Å
386	T	98.7	Very high	98.2	Very high	66 Å²	66	58.3 Å²	58.3	41%	0.405	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.6	178.8	-54.6	0	0	0	0	109.9	V388 L406 C407 N408	T386-V388 PolarHBondContact O-N 3.1Å; T386-L406 WeakPolarHBondContact O-CA 3.24Å; T386-C407 PolarHBondContact N-O 3.04Å; T386-C407 PolarHBondContact O-N 3.49Å; T386-N408 PolarHBondContact OG1-ND2 2.88Å; T386-N408 VanDerWaalsContact OG1-ND2 3.14Å
387	V	98.8	Very high	98.1	Very high	60 Å²	60	59.7 Å²	59.7	36%	0.364	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	117	173.3	-173	0	0	0	0	109.2	V381 G390 L406	V381-V387 HydrophobicContact CG2-CG2 3.56Å; V387-G390 WeakPolarHBondContact CG1-O 3.37Å; V387-L406 HydrophobicContact CB-CD2 4.08Å; V387-L406 HydrophobicContact CG1-CD2 4.23Å; V387-L406 HydrophobicContact CG2-CD2 3.7Å
388	V	98.7	Very high	97.9	Very high	56 Å²	56	65.1 Å²	65.1	34%	0.339	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-41.4	176.5	-176.5	0	0	0	0	110.7	V338 A342 T386 L405 C407	V338-V388 HydrophobicContact CG1-CG1 4.35Å; V338-V388 HydrophobicContact CG1-CG2 3.99Å; A342-V388 HydrophobicContact CB-CG1 3.73Å; T386-V388 PolarHBondContact O-N 3.1Å; V388-L405 HydrophobicContact CB-CB 4.25Å; V388-L405 HydrophobicContact CB-CD2 4.12Å; V388-L405 HydrophobicContact CB-CG 4.21Å; V388-L405 HydrophobicContact CG1-CD2 4.09Å; V388-L405 HydrophobicContact CG2-CD2 4.47Å; V388-L405 HydrophobicContact CG2-CG 4.41Å; V388-L405 PolarHBondContact N-O 3.04Å; V388-C407 HydrophobicContact CG2-CB 3.94Å; V388-C407 VanDerWaalsContact CG2-SG 3.53Å
389	T	98.5	Very high	97.7	Very high	49 Å²	49	61.4 Å²	61.4	30%	0.301	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	156.5	173.4	-171.5	0	0	0	0	110.3	M345 T404 L405	M345-T389 HydrophobicContact CE-CG2 3.52Å; M345-T389 HydrophobicContact SD-CG2 4.15Å; T389-T404 WeakPolarHBondContact O-CA 3.43Å; T389-L405 HydrophobicContact CG2-CB 3.96Å; T389-L405 PolarHBondContact O-N 3.46Å; T389-L405 VanDerWaalsContact O-N 3.13Å
390	G	98.3	Very high	97.6	Very high	24 Å²	24	60.4 Å²	60.4	25%	0.247	34%	0.34	C	S	.	.			trans	71.5	-136.9	-179.3	0	0	0	0	0	113.3	V387 E402	V387-G390 WeakPolarHBondContact CG1-O 3.37Å; G390-E402 WeakPolarHBondContact CA-OE2 3.47Å
391	G	97.1	Very high	97.6	Very high	16 Å²	16	60.7 Å²	60.7	17%	0.165	34%	0.341	C	S	.	.			trans	103.2	1.7	171.1	0	0	0	0	0	115.7	T404	G391-T404 WeakPolarHBondContact CA-OG1 3.32Å; G391-T404 PolarHBondContact N-OG1 3.07Å
392	K	98.3	Very high	97.6	Very high	129 Å²	129	59.6 Å²	59.6	56%	0.561	33%	0.332	S	S	*	.	S	Bend	trans	-145.7	171.5	-177.1	57.8	-178.3	178.9	-172.2	0	111.7	H394 F401 E402	K392-H394 PolarHBondContact O-N 3.25Å; K392-F401 WeakPolarHBondContact O-CE2 3.29Å; K392-E402 WeakPolarHBondContact CE-OE1 3.3Å; K392-E402 VanDerWaalsContact CE-OE2 3.3Å; K392-E402 WeakPolarHBondContact CE-OE2 3.47Å; K392-E402 HydrophobicContact CG-CG 4.44Å; K392-E402 WeakPolarHBondContact CG-OE2 3.4Å; K392-E402 WeakPolarHBondContact O-CB 3.29Å; K392-E402 WeakPolarHBondContact O-CG 3.47Å; K392-E402 PolarHBondContact O-N 3.5Å
393	R	98.5	Very high	97.6	Very high	82 Å²	82	55.9 Å²	55.9	31%	0.309	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-55.8	138.9	168.4	-59.2	-171.9	-175.6	-141.1	-1	109.7	E367 V370 E374 F401	E367-R393 VanDerWaalsContact CD-NH1 3.34Å; E367-R393 IonicContact OE1-CZ 2.88Å; E367-R393 IonicContact OE1-NH1 2.76Å; E367-R393 PolarHBondContact OE1-NH1 3.36Å; E367-R393 IonicContact OE1-NH2 2.66Å; E367-R393 PolarHBondContact OE1-NH2 2.79Å; E367-R393 IonicContact OE2-NH1 3.17Å; E367-R393 PolarHBondContact OE2-NH1 2.78Å; E367-R393 VanDerWaalsContact OE2-NH1 3.15Å; V370-R393 HydrophobicContact CG1-CG 3.92Å; E374-R393 VanDerWaalsContact CD-NE 3.26Å; E374-R393 WeakPolarHBondContact OE1-CD 3.5Å; E374-R393 WeakPolarHBondContact OE1-CG 3.46Å; E374-R393 IonicContact OE1-CZ 3.94Å; E374-R393 IonicContact OE1-NE 3.41Å; E374-R393 PolarHBondContact OE1-NE 3Å; E374-R393 IonicContact OE1-NH2 2.64Å; E374-R393 IonicContact OE2-CZ 3.31Å; E374-R393 IonicContact OE2-NE 3.63Å; E374-R393 PolarHBondContact OE2-NE 2.9Å; E374-R393 IonicContact OE2-NH2 2.92Å; E374-R393 PolarHBondContact OE2-NH2 3.19Å; R393-F401 HydrophobicContact CG-CD2 4.25Å; R393-F401 HydrophobicContact CG-CE2 4.39Å
394	H	98.6	Very high	97.6	Very high	35 Å²	35	51.7 Å²	51.7	16%	0.162	29%	0.287	C	S	.	.			trans	-71.1	150.8	177.6	-173.8	-98.7	0	0	0	110.2	V351 K392 L396 G397 F400 E402	V351-H394 HydrophobicContact CG1-CB 4.34Å; K392-H394 PolarHBondContact O-N 3.25Å; H394-L396 WeakPolarHBondContact ND1-CB 3.18Å; H394-L396 WeakPolarHBondContact ND1-CG 3.13Å; H394-L396 PolarHBondContact ND1-N 3.04Å; H394-L396 PolarHBondContact O-N 2.91Å; H394-G397 PolarHBondContact O-N 2.97Å; H394-F400 HydrophobicContact CB-CB 3.85Å; H394-F400 PolarHBondContact N-O 2.89Å; H394-E402 HydrophobicContact CB-CG 4.04Å
395	Q	97.7	Very high	97.7	Very high	180 Å²	180	49.4 Å²	49.4	84%	0.841	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-18	-178.5	64.8	175.4	19.6	0	0	115	G397	Q395-G397 PolarHBondContact O-N 3.48Å
396	L	95.1	Very high	97.7	Very high	88 Å²	88	49 Å²	49	46%	0.461	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.2	172.5	-71.9	171.8	0	0	0	113	V351 H394 F400	V351-L396 HydrophobicContact CG1-CD1 4.31Å; H394-L396 WeakPolarHBondContact ND1-CB 3.18Å; H394-L396 WeakPolarHBondContact ND1-CG 3.13Å; H394-L396 PolarHBondContact ND1-N 3.04Å; H394-L396 PolarHBondContact O-N 2.91Å; L396-F400 HydrophobicContact CB-CB 4.24Å; L396-F400 HydrophobicContact CB-CD2 3.8Å; L396-F400 HydrophobicContact CB-CE2 4.42Å; L396-F400 HydrophobicContact CB-CG 4.12Å; L396-F400 HydrophobicContact CD1-CD1 4.48Å; L396-F400 HydrophobicContact CD1-CD2 4.43Å; L396-F400 HydrophobicContact CD1-CG 4.37Å
397	G	95.6	Very high	97.7	Very high	29 Å²	29	46.6 Å²	46.6	30%	0.299	25%	0.246	S	C	.	.			trans	66.4	-157	-178.1	0	0	0	0	0	112.8	H394 Q395 N399 F400	H394-G397 PolarHBondContact O-N 2.97Å; Q395-G397 PolarHBondContact O-N 3.48Å; G397-N399 PolarHBondContact O-N 3.44Å; G397-F400 WeakPolarHBondContact O-CB 3.27Å; G397-F400 WeakPolarHBondContact O-CD2 3.34Å; G397-F400 PolarHBondContact O-N 3.21Å
398	K	94.8	Very high	97.6	Very high	117 Å²	117	47.7 Å²	47.7	51%	0.509	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-131.9	-179.5	-51.3	179.2	-174.5	179.6	0	111.1	A82 S83 F400	A82-K398 WeakPolarHBondContact O-CD 3.1Å; A82-K398 PolarHBondContact O-NZ 2.91Å; S83-K398 PolarHBondContact O-NZ 3.23Å; K398-F400 VanDerWaalsContact C-N 3.34Å
399	N	93.6	Very high	97.6	Very high	26 Å²	26	45.3 Å²	45.3	14%	0.139	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	14	-178.7	-57.4	-32.6	0	0	0	113.9	P81 P363 L364 E367 V370 G397	P81-N399 PolarHBondContact O-ND2 3.24Å; P363-N399 HydrophobicContact CB-CB 4.05Å; L364-N399 HydrophobicContact CB-CB 4.47Å; L364-N399 WeakPolarHBondContact CB-O 3.39Å; L364-N399 PolarHBondContact N-O 3.26Å; L364-N399 WeakPolarHBondContact O-CB 3.43Å; E367-N399 PolarHBondContact N-OD1 2.85Å; V370-N399 HydrophobicContact CG2-CB 4.17Å; G397-N399 PolarHBondContact O-N 3.44Å
400	F	97.4	Very high	97.5	Very high	10 Å²	10	45.7 Å²	45.7	4%	0.044	24%	0.238	C	C	.	.			trans	-86.2	128.7	178.9	-66.1	-79.2	0	0	0	111.2	A82 V351 G352 P363 H394 L396 G397 K398	A82-F400 HydrophobicContact CB-CE2 4.45Å; A82-F400 HydrophobicContact CB-CZ 3.82Å; V351-F400 HydrophobicContact CG1-CB 4.09Å; V351-F400 HydrophobicContact CG1-CD1 3.55Å; V351-F400 HydrophobicContact CG1-CE1 4.35Å; V351-F400 HydrophobicContact CG1-CG 4.17Å; G352-F400 VanDerWaalsContact O-CE1 3.3Å; G352-F400 WeakPolarHBondContact O-CE1 3.37Å; P363-F400 HydrophobicContact CB-CD1 3.95Å; P363-F400 HydrophobicContact CB-CE1 3.75Å; P363-F400 HydrophobicContact CB-CE2 4.4Å; P363-F400 HydrophobicContact CB-CG 4.39Å; P363-F400 HydrophobicContact CB-CZ 4Å; P363-F400 HydrophobicContact CG-CE1 4.23Å; P363-F400 HydrophobicContact CG-CZ 4.37Å; H394-F400 HydrophobicContact CB-CB 3.85Å; H394-F400 PolarHBondContact N-O 2.89Å; L396-F400 HydrophobicContact CB-CB 4.24Å; L396-F400 HydrophobicContact CB-CD2 3.8Å; L396-F400 HydrophobicContact CB-CE2 4.42Å; L396-F400 HydrophobicContact CB-CG 4.12Å; L396-F400 HydrophobicContact CD1-CD1 4.48Å; L396-F400 HydrophobicContact CD1-CD2 4.43Å; L396-F400 HydrophobicContact CD1-CG 4.37Å; G397-F400 WeakPolarHBondContact O-CB 3.27Å; G397-F400 WeakPolarHBondContact O-CD2 3.34Å; G397-F400 PolarHBondContact O-N 3.21Å; K398-F400 VanDerWaalsContact C-N 3.34Å
401	F	98.6	Very high	97.2	Very high	5 Å²	5	48.7 Å²	48.7	2%	0.022	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-122.8	144.3	177.4	-158.9	-94.5	0	0	0	110.5	L364 V370 V373 E374 V377 K392 R393 T404 P423	L364-F401 HydrophobicContact CD1-CB 4.16Å; V370-F401 HydrophobicContact CG1-CD2 4.1Å; V373-F401 HydrophobicContact CG1-CD1 3.61Å; V373-F401 HydrophobicContact CG1-CD2 4.44Å; V373-F401 HydrophobicContact CG1-CE1 3.39Å; V373-F401 HydrophobicContact CG1-CE2 4.27Å; V373-F401 HydrophobicContact CG1-CG 4.15Å; V373-F401 HydrophobicContact CG1-CZ 3.76Å; E374-F401 HydrophobicContact CG-CD2 4.4Å; E374-F401 HydrophobicContact CG-CE2 3.55Å; E374-F401 HydrophobicContact CG-CZ 4.31Å; V377-F401 HydrophobicContact CG2-CE1 4.43Å; V377-F401 HydrophobicContact CG2-CZ 4.34Å; K392-F401 WeakPolarHBondContact O-CE2 3.29Å; R393-F401 HydrophobicContact CG-CD2 4.25Å; R393-F401 HydrophobicContact CG-CE2 4.39Å; F401-T404 WeakPolarHBondContact CE1-OG1 3.42Å; F401-P423 HydrophobicContact CB-CG 4.32Å; F401-P423 HydrophobicContact CD1-CG 4.28Å
402	E	98.6	Very high	97.1	Very high	41 Å²	41	52.5 Å²	52.5	19%	0.192	26%	0.262	C	S	.	.			trans	-69.9	133	178.8	-65.8	179.7	170	0	0	110.6	G390 K392 H394 T404	G390-E402 WeakPolarHBondContact CA-OE2 3.47Å; K392-E402 WeakPolarHBondContact CE-OE1 3.3Å; K392-E402 VanDerWaalsContact CE-OE2 3.3Å; K392-E402 WeakPolarHBondContact CE-OE2 3.47Å; K392-E402 HydrophobicContact CG-CG 4.44Å; K392-E402 WeakPolarHBondContact CG-OE2 3.4Å; K392-E402 WeakPolarHBondContact O-CB 3.29Å; K392-E402 WeakPolarHBondContact O-CG 3.47Å; K392-E402 PolarHBondContact O-N 3.5Å; H394-E402 HydrophobicContact CB-CG 4.04Å; E402-T404 PolarHBondContact O-N 3.38Å; E402-T404 VanDerWaalsContact O-N 3.07Å; E402-T404 PolarHBondContact O-OG1 3.19Å
403	P	98.6	Very high	97	Very high	17 Å²	17	46.3 Å²	46.3	11%	0.11	24%	0.235	C	C	.	.			trans	-55.1	118.5	168.8	-26.6	36	0	0	0	110.9	F314 M345 L349 V351 Q361	F314-P403 HydrophobicContact CD1-CB 4.26Å; F314-P403 HydrophobicContact CE1-CB 3.87Å; M345-P403 HydrophobicContact CE-CB 3.89Å; M345-P403 WeakPolarHBondContact CE-O 3.36Å; L349-P403 HydrophobicContact CB-CG 4.07Å; L349-P403 HydrophobicContact CD1-CB 3.45Å; L349-P403 VanDerWaalsContact CD1-CB 3.45Å; L349-P403 HydrophobicContact CD1-CG 3.78Å; V351-P403 HydrophobicContact CG2-CG 4.2Å; Q361-P403 HydrophobicContact CG-CG 3.92Å
404	T	98.8	Very high	96.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.3	-165.8	-59.9	0	0	0	0	110.5	V377 T389 G391 F401 E402 L406 P423 L424 A425	V377-T404 HydrophobicContact CG2-CG2 4.13Å; T389-T404 WeakPolarHBondContact O-CA 3.43Å; G391-T404 WeakPolarHBondContact CA-OG1 3.32Å; G391-T404 PolarHBondContact N-OG1 3.07Å; F401-T404 WeakPolarHBondContact CE1-OG1 3.42Å; E402-T404 PolarHBondContact O-N 3.38Å; E402-T404 VanDerWaalsContact O-N 3.07Å; E402-T404 PolarHBondContact O-OG1 3.19Å; T404-L406 HydrophobicContact CG2-CD2 3.76Å; T404-L406 HydrophobicContact CG2-CG 4.13Å; T404-P423 PolarHBondContact N-O 2.97Å; T404-L424 HydrophobicContact CG2-CD1 3.62Å; T404-L424 WeakPolarHBondContact O-CA 3.41Å; T404-A425 PolarHBondContact O-N 3Å
405	L	98.8	Very high	96.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.2	171.6	-176.2	68.1	0	0	0	108.2	V338 F341 A342 M345 V388 T389 A425 V427	V338-L405 HydrophobicContact CG1-CD2 4.26Å; F341-L405 HydrophobicContact CB-CD2 4.35Å; F341-L405 HydrophobicContact CD1-CD1 3.66Å; F341-L405 HydrophobicContact CD1-CD2 4.37Å; F341-L405 HydrophobicContact CE1-CD1 3.86Å; F341-L405 HydrophobicContact CG-CD1 4.46Å; F341-L405 HydrophobicContact CG-CD2 4.48Å; A342-L405 HydrophobicContact CB-CD2 3.89Å; M345-L405 HydrophobicContact CE-CB 3.97Å; M345-L405 HydrophobicContact SD-CB 3.77Å; M345-L405 HydrophobicContact SD-CD1 4.49Å; M345-L405 HydrophobicContact SD-CD2 4.2Å; M345-L405 HydrophobicContact SD-CG 4.39Å; V388-L405 HydrophobicContact CB-CB 4.25Å; V388-L405 HydrophobicContact CB-CD2 4.12Å; V388-L405 HydrophobicContact CB-CG 4.21Å; V388-L405 HydrophobicContact CG1-CD2 4.09Å; V388-L405 HydrophobicContact CG2-CD2 4.47Å; V388-L405 HydrophobicContact CG2-CG 4.41Å; V388-L405 PolarHBondContact N-O 3.04Å; T389-L405 HydrophobicContact CG2-CB 3.96Å; T389-L405 PolarHBondContact O-N 3.46Å; T389-L405 VanDerWaalsContact O-N 3.13Å; L405-A425 WeakPolarHBondContact CA-O 3.31Å; L405-A425 HydrophobicContact CD1-CB 3.68Å; L405-A425 WeakPolarHBondContact CD1-O 3.49Å; L405-V427 HydrophobicContact CD1-CG2 3.73Å
406	L	98.7	Very high	95.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	136.5	173.9	-53.6	-176.6	0	0	0	109	A380 T386 V387 T404 V409 L424 A425 V427	A380-L406 HydrophobicContact CB-CD1 3.76Å; T386-L406 WeakPolarHBondContact O-CA 3.24Å; V387-L406 HydrophobicContact CB-CD2 4.08Å; V387-L406 HydrophobicContact CG1-CD2 4.23Å; V387-L406 HydrophobicContact CG2-CD2 3.7Å; T404-L406 HydrophobicContact CG2-CD2 3.76Å; T404-L406 HydrophobicContact CG2-CG 4.13Å; L406-V409 HydrophobicContact CB-CG2 3.82Å; L406-L424 HydrophobicContact CD1-CD1 3.79Å; L406-L424 HydrophobicContact CG-CD1 3.81Å; L406-A425 PolarHBondContact N-O 2.65Å; L406-V427 WeakPolarHBondContact O-CB 3.44Å; L406-V427 WeakPolarHBondContact O-CG2 3.31Å; L406-V427 PolarHBondContact O-N 3.21Å
407	C	97.8	Very high	95.1	Very high	14 Å²	14	35.8 Å²	35.8	10%	0.095	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	174.9	166.9	70.4	0	0	0	0	110.5	V338 T386 V388 V409	V338-C407 HydrophobicContact CG1-CB 4.25Å; T386-C407 PolarHBondContact N-O 3.04Å; T386-C407 PolarHBondContact O-N 3.49Å; V388-C407 HydrophobicContact CG2-CB 3.94Å; V388-C407 VanDerWaalsContact CG2-SG 3.53Å; C407-V409 PolarHBondContact O-N 2.9Å
408	N	97.9	Very high	94.6	Very high	83 Å²	83	37.3 Å²	37.3	44%	0.444	19%	0.188	S	C	.	.	S	Bend	trans	57.2	33.6	-171.8	-54.1	-43.3	0	0	0	112.1	T386	T386-N408 PolarHBondContact OG1-ND2 2.88Å; T386-N408 VanDerWaalsContact OG1-ND2 3.14Å
409	V	98	Very high	94	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.036	17%	0.172	C	C	.	.			trans	-80.1	140.8	174	176.3	0	0	0	0	108.8	A385 L406 C407 M413 T416 P426 V427 I428	A385-V409 HydrophobicContact CB-CG2 3.99Å; L406-V409 HydrophobicContact CB-CG2 3.82Å; C407-V409 PolarHBondContact O-N 2.9Å; V409-M413 HydrophobicContact CB-SD 4.07Å; V409-M413 HydrophobicContact CG1-CB 4.26Å; V409-M413 HydrophobicContact CG1-CG 4.39Å; V409-M413 HydrophobicContact CG1-SD 3.66Å; V409-M413 HydrophobicContact CG2-SD 4.24Å; V409-T416 HydrophobicContact CG1-CG2 3.83Å; V409-P426 HydrophobicContact CB-CB 4.18Å; V409-P426 HydrophobicContact CG1-CB 3.93Å; V409-P426 HydrophobicContact CG2-CB 3.74Å; V409-V427 WeakPolarHBondContact CB-O 3.39Å; V409-V427 PolarHBondContact N-O 3.44Å; V409-V427 VanDerWaalsContact N-O 3.16Å; V409-I428 HydrophobicContact CB-CG1 4.06Å; V409-I428 HydrophobicContact CG1-CG1 3.9Å
410	T	96.3	Very high	93.3	Very high	58 Å²	58	32.4 Å²	32.4	36%	0.356	17%	0.166	S	C	.	.			trans	-111.7	162.8	175.2	57.4	0	0	0	0	110.4	D412 M413 T416	T410-D412 WeakPolarHBondContact CB-OD1 3.31Å; T410-D412 PolarHBondContact O-N 3.31Å; T410-D412 PolarHBondContact OG1-OD1 3.31Å; T410-M413 HydrophobicContact CG2-CE 4.38Å; T410-M413 PolarHBondContact O-N 2.81Å; T410-M413 WeakPolarHBondContact OG1-CE 3.45Å; T410-T416 WeakPolarHBondContact O-CG2 3.49Å
411	Q	93.4	Very high	93	Very high	86 Å²	86	34.4 Å²	34.4	40%	0.402	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.3	-177.1	-167.2	176	-4.7	0	0	113	M413 T416 H417 A442	Q411-M413 VanDerWaalsContact C-N 3.34Å; Q411-M413 PolarHBondContact O-N 3.2Å; Q411-T416 PolarHBondContact O-OG1 3.42Å; Q411-H417 PolarHBondContact O-CE1 3.34Å; Q411-H417 PolarHBondContact O-ND1 2.97Å; Q411-A442 VanDerWaalsContact NE2-CB 3.35Å
412	D	93.9	Very high	92.8	Very high	96 Å²	96	34.1 Å²	34.1	51%	0.513	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.1	-179.4	65.1	-75.3	0	0	0	115.1	K383 T410	K383-D412 PolarHBondContact NZ-O 3.31Å; T410-D412 WeakPolarHBondContact CB-OD1 3.31Å; T410-D412 PolarHBondContact O-N 3.31Å; T410-D412 PolarHBondContact OG1-OD1 3.31Å
413	M	96.2	Very high	92.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-76.4	150.8	-177.7	-62.8	-176	-177.7	0	0	112	A380 K383 A385 V409 T410 Q411 C415 T416 H417	A380-M413 HydrophobicContact CB-CB 4.43Å; A380-M413 HydrophobicContact CB-SD 3.72Å; K383-M413 HydrophobicContact CB-CE 3.91Å; K383-M413 HydrophobicContact CB-CG 4.28Å; K383-M413 HydrophobicContact CD-CG 4.17Å; A385-M413 HydrophobicContact CB-CE 3.94Å; A385-M413 HydrophobicContact CB-SD 3.82Å; V409-M413 HydrophobicContact CB-SD 4.07Å; V409-M413 HydrophobicContact CG1-CB 4.26Å; V409-M413 HydrophobicContact CG1-CG 4.39Å; V409-M413 HydrophobicContact CG1-SD 3.66Å; V409-M413 HydrophobicContact CG2-SD 4.24Å; T410-M413 HydrophobicContact CG2-CE 4.38Å; T410-M413 PolarHBondContact O-N 2.81Å; T410-M413 WeakPolarHBondContact OG1-CE 3.45Å; Q411-M413 VanDerWaalsContact C-N 3.34Å; Q411-M413 PolarHBondContact O-N 3.2Å; M413-C415 VanDerWaalsContact C-N 3.27Å; M413-C415 PolarHBondContact O-N 3.05Å; M413-T416 PolarHBondContact O-N 3.32Å; M413-T416 VanDerWaalsContact O-N 3.12Å; M413-T416 PolarHBondContact O-OG1 3.29Å; M413-H417 PolarHBondContact O-ND1 2.84Å
414	L	90.1	Very high	92.7	Very high	41 Å²	41	31.4 Å²	31.4	22%	0.215	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-63	-32.3	-174.4	-74.4	178.7	0	0	0	113.7	D379 T416 H417 E418	D379-L414 HydrophobicContact CB-CB 4.26Å; D379-L414 HydrophobicContact CB-CD1 3.77Å; D379-L414 HydrophobicContact CB-CG 4.12Å; D379-L414 VanDerWaalsContact CG-CG 3.45Å; D379-L414 WeakPolarHBondContact OD2-CB 3.26Å; D379-L414 VanDerWaalsContact OD2-CG 3.3Å; D379-L414 WeakPolarHBondContact OD2-CG 3.33Å; D379-L414 PolarHBondContact OD2-N 3.35Å; L414-T416 PolarHBondContact O-N 3.2Å; L414-T416 VanDerWaalsContact O-N 3.13Å; L414-H417 PolarHBondContact O-N 2.93Å; L414-H417 VanDerWaalsContact O-N 3.12Å; L414-E418 PolarHBondContact O-N 2.96Å
415	C	88.5	Confident	92.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-64.1	-14.4	178.6	58.3	0	0	0	0	113.7	Q376 M413 L424 P426	Q376-C415 HydrophobicContact CB-CB 4.27Å; M413-C415 VanDerWaalsContact C-N 3.27Å; M413-C415 PolarHBondContact O-N 3.05Å; C415-L424 HydrophobicContact CB-CD2 4.29Å; C415-P426 HydrophobicContact CB-CB 4.46Å; C415-P426 HydrophobicContact CB-CG 4.18Å
416	T	86.6	Confident	92.7	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.055	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-98.3	-4.9	177.5	65.9	0	0	0	0	113.5	Q326 V409 T410 Q411 M413 L414 I428	Q326-T416 HydrophobicContact CG-CG2 4.47Å; Q326-T416 PolarHBondContact NE2-O 3.46Å; V409-T416 HydrophobicContact CG1-CG2 3.83Å; T410-T416 WeakPolarHBondContact O-CG2 3.49Å; Q411-T416 PolarHBondContact O-OG1 3.42Å; M413-T416 PolarHBondContact O-N 3.32Å; M413-T416 VanDerWaalsContact O-N 3.12Å; M413-T416 PolarHBondContact O-OG1 3.29Å; L414-T416 PolarHBondContact O-N 3.2Å; L414-T416 VanDerWaalsContact O-N 3.13Å; T416-I428 HydrophobicContact CG2-CD1 3.75Å; T416-I428 HydrophobicContact CG2-CG1 4.5Å
417	H	85.6	Confident	92.7	Very high	113 Å²	113	31.4 Å²	31.4	52%	0.523	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-26.8	-178.9	-64.2	93.8	0	0	0	113.4	Q411 M413 L414	Q411-H417 PolarHBondContact O-CE1 3.34Å; Q411-H417 PolarHBondContact O-ND1 2.97Å; M413-H417 PolarHBondContact O-ND1 2.84Å; L414-H417 PolarHBondContact O-N 2.93Å; L414-H417 VanDerWaalsContact O-N 3.12Å
418	E	84.2	Confident	92.7	Very high	61 Å²	61	31.1 Å²	31.1	29%	0.285	16%	0.157	S	C	.	.	S	Bend	trans	-106.3	132.9	-179.2	-63	-176.2	-176.8	0	0	110.6	L414 T420	L414-E418 PolarHBondContact O-N 2.96Å; E418-T420 PolarHBondContact O-N 2.86Å; E418-T420 VanDerWaalsContact O-N 3.13Å; E418-T420 PolarHBondContact O-OG1 2.92Å; E418-T420 VanDerWaalsContact O-OG1 3.09Å
419	E	82.2	Confident	92.7	Very high	39 Å²	39	31 Å²	31	18%	0.182	15%	0.152	C	C	.	.			trans	-55.4	120.6	173.6	178.7	172.9	-133.8	0	0	110.6	G289 G290 K372 F421	G289-E419 VanDerWaalsContact CA-CD 3.47Å; G289-E419 WeakPolarHBondContact CA-OE1 3.36Å; G289-E419 WeakPolarHBondContact CA-OE2 3.44Å; G290-E419 PolarHBondContact N-OE1 3.41Å; G290-E419 WeakPolarHBondContact O-CG 3.4Å; K372-E419 VanDerWaalsContact CE-O 3.22Å; K372-E419 WeakPolarHBondContact CE-O 3.48Å; K372-E419 PolarHBondContact NZ-O 2.95Å; E419-F421 HydrophobicContact CG-CD1 3.75Å; E419-F421 HydrophobicContact CG-CE1 3.47Å; E419-F421 VanDerWaalsContact CG-CE1 3.47Å; E419-F421 HydrophobicContact CG-CZ 4.18Å; E419-F421 WeakPolarHBondContact OE1-CE1 3.49Å; E419-F421 VanDerWaalsContact OE1-CZ 3.23Å; E419-F421 WeakPolarHBondContact OE1-CZ 3.42Å
420	T	79.9	Confident	92.8	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	15%	0.151	C	C	.	.			trans	-105.9	97.3	-173.4	-60.8	0	0	0	0	109.9	N325 Q376 E418 G422 L424	N325-T420 PolarHBondContact OD1-O 3.28Å; Q376-T420 VanDerWaalsContact CD-OG1 3.22Å; Q376-T420 PolarHBondContact NE2-OG1 2.82Å; Q376-T420 PolarHBondContact OE1-OG1 2.87Å; E418-T420 PolarHBondContact O-N 2.86Å; E418-T420 VanDerWaalsContact O-N 3.13Å; E418-T420 PolarHBondContact O-OG1 2.92Å; E418-T420 VanDerWaalsContact O-OG1 3.09Å; T420-G422 PolarHBondContact O-N 3.17Å; T420-L424 HydrophobicContact CG2-CB 4.03Å; T420-L424 HydrophobicContact CG2-CD2 4.21Å; T420-L424 HydrophobicContact CG2-CG 4.48Å
421	F	90.7	Very high	92.9	Very high	52 Å²	52	31.3 Å²	31.3	23%	0.228	15%	0.151	C	C	.	.			trans	-90.2	84.5	171.4	-77.6	7.6	0	0	0	109.6	W185 G318 Q319 T320 C321 E419	W185-F421 HydrophobicContact CZ2-CD2 4.32Å; G318-F421 WeakPolarHBondContact O-CA 3.44Å; Q319-F421 HydrophobicContact CB-CB 4.48Å; Q319-F421 HydrophobicContact CG-CB 4.42Å; T320-F421 WeakPolarHBondContact O-CE1 3.38Å; C321-F421 HydrophobicContact CB-CZ 4.31Å; E419-F421 HydrophobicContact CG-CD1 3.75Å; E419-F421 HydrophobicContact CG-CE1 3.47Å; E419-F421 VanDerWaalsContact CG-CE1 3.47Å; E419-F421 HydrophobicContact CG-CZ 4.18Å; E419-F421 WeakPolarHBondContact OE1-CE1 3.49Å; E419-F421 VanDerWaalsContact OE1-CZ 3.23Å; E419-F421 WeakPolarHBondContact OE1-CZ 3.42Å
422	G	94.4	Very high	93.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	177.3	173	179.2	0	0	0	0	0	112.9	K313 T317 G318 T420 L424	K313-G422 WeakPolarHBondContact CE-O 3.48Å; K313-G422 PolarHBondContact NZ-O 3.14Å; T317-G422 CarbonylContact O-C 3.58Å; T317-G422 WeakPolarHBondContact O-CA 3.18Å; G318-G422 PolarHBondContact O-N 2.7Å; T420-G422 PolarHBondContact O-N 3.17Å; G422-L424 PolarHBondContact O-N 2.97Å
423	P	97.1	Very high	93.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-84.5	53.8	-170.1	37.7	-37.4	0	0	0	110.9	F314 T317 F401 T404	F314-P423 HydrophobicContact CD1-CB 4.06Å; F314-P423 HydrophobicContact CE1-CB 4.17Å; T317-P423 HydrophobicContact CG2-CB 3.87Å; T317-P423 HydrophobicContact CG2-CG 3.78Å; F401-P423 HydrophobicContact CB-CG 4.32Å; F401-P423 HydrophobicContact CD1-CG 4.28Å; T404-P423 PolarHBondContact N-O 2.97Å
424	L	98.3	Very high	93.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	118.2	-178.5	173.7	58.2	0	0	0	111	K313 V373 Q376 V377 T404 L406 C415 T420 G422 P426	K313-L424 WeakPolarHBondContact CE-O 3.41Å; K313-L424 PolarHBondContact NZ-O 3.36Å; V373-L424 HydrophobicContact CG1-CB 4.31Å; Q376-L424 HydrophobicContact CB-CD2 3.81Å; V377-L424 HydrophobicContact CG2-CD1 3.86Å; V377-L424 HydrophobicContact CG2-CD2 3.97Å; V377-L424 HydrophobicContact CG2-CG 4.5Å; T404-L424 HydrophobicContact CG2-CD1 3.62Å; T404-L424 WeakPolarHBondContact O-CA 3.41Å; L406-L424 HydrophobicContact CD1-CD1 3.79Å; L406-L424 HydrophobicContact CG-CD1 3.81Å; C415-L424 HydrophobicContact CB-CD2 4.29Å; T420-L424 HydrophobicContact CG2-CB 4.03Å; T420-L424 HydrophobicContact CG2-CD2 4.21Å; T420-L424 HydrophobicContact CG2-CG 4.48Å; G422-L424 PolarHBondContact O-N 2.97Å; L424-P426 WeakPolarHBondContact O-CD 3.5Å
425	A	98.1	Very high	93.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	96.3	178.3	0	0	0	0	0	110.6	K313 F314 F327 F341 T404 L405 L406	K313-A425 HydrophobicContact CG-CB 4.22Å; F314-A425 HydrophobicContact CZ-CB 4.45Å; F327-A425 HydrophobicContact CD2-CB 3.93Å; F327-A425 HydrophobicContact CE2-CB 3.59Å; F341-A425 HydrophobicContact CE1-CB 4.12Å; F341-A425 HydrophobicContact CZ-CB 4.43Å; T404-A425 PolarHBondContact O-N 3Å; L405-A425 WeakPolarHBondContact CA-O 3.31Å; L405-A425 HydrophobicContact CD1-CB 3.68Å; L405-A425 WeakPolarHBondContact CD1-O 3.49Å; L406-A425 PolarHBondContact N-O 2.65Å
426	P	98	Very high	94.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	132.6	169.7	30.1	-30.4	0	0	0	111.4	N325 F327 V409 C415 L424	N325-P426 WeakPolarHBondContact O-CD 3.4Å; N325-P426 WeakPolarHBondContact O-CG 3.36Å; F327-P426 PolarHBondContact N-O 3.17Å; V409-P426 HydrophobicContact CB-CB 4.18Å; V409-P426 HydrophobicContact CG1-CB 3.93Å; V409-P426 HydrophobicContact CG2-CB 3.74Å; C415-P426 HydrophobicContact CB-CB 4.46Å; C415-P426 HydrophobicContact CB-CG 4.18Å; L424-P426 WeakPolarHBondContact O-CD 3.5Å
427	V	98.6	Very high	94.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.7	177.7	-175.2	0	0	0	0	110.6	F327 V329 V338 L405 L406 V409	F327-V427 HydrophobicContact CB-CB 4.44Å; F327-V427 HydrophobicContact CB-CG1 4.48Å; F327-V427 HydrophobicContact CB-CG2 4.01Å; F327-V427 CarbonylContact O-C 3.55Å; F327-V427 WeakPolarHBondContact O-CA 3.47Å; V329-V427 HydrophobicContact CB-CG1 4.18Å; V329-V427 HydrophobicContact CG2-CG1 3.74Å; V338-V427 HydrophobicContact CG2-CB 4.43Å; V338-V427 HydrophobicContact CG2-CG1 3.93Å; V338-V427 HydrophobicContact CG2-CG2 4.34Å; L405-V427 HydrophobicContact CD1-CG2 3.73Å; L406-V427 WeakPolarHBondContact O-CB 3.44Å; L406-V427 WeakPolarHBondContact O-CG2 3.31Å; L406-V427 PolarHBondContact O-N 3.21Å; V409-V427 WeakPolarHBondContact CB-O 3.39Å; V409-V427 PolarHBondContact N-O 3.44Å; V409-V427 VanDerWaalsContact N-O 3.16Å
428	I	98.5	Very high	95.5	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.041	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.2	174.7	-57.9	164.4	0	0	0	107.5	F327 L328 V329 V409 T416	F327-I428 PolarHBondContact O-N 3.44Å; L328-I428 WeakPolarHBondContact CA-O 3.47Å; L328-I428 HydrophobicContact CD2-CB 3.84Å; L328-I428 HydrophobicContact CD2-CD1 4.11Å; L328-I428 HydrophobicContact CD2-CG2 3.91Å; V329-I428 PolarHBondContact N-O 3.07Å; V409-I428 HydrophobicContact CB-CG1 4.06Å; V409-I428 HydrophobicContact CG1-CG1 3.9Å; T416-I428 HydrophobicContact CG2-CD1 3.75Å; T416-I428 HydrophobicContact CG2-CG1 4.5Å
429	K	98.6	Very high	96.1	Very high	81 Å²	81	32.3 Å²	32.3	35%	0.352	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	141.4	175.4	-173.4	178	-67.1	-178.7	0	109.7	V329 R331 H334 D335	V329-K429 WeakPolarHBondContact O-CA 3.26Å; R331-K429 HydrophobicContact CB-CD 4.47Å; R331-K429 HydrophobicContact CB-CG 4.49Å; R331-K429 HydrophobicContact CG-CD 4.43Å; H334-K429 WeakPolarHBondContact CD2-CE 3.11Å; H334-K429 VanDerWaalsContact CE1-CE 3.48Å; H334-K429 WeakPolarHBondContact CE1-CE 3.3Å; H334-K429 VanDerWaalsContact ND1-CE 3.29Å; H334-K429 WeakPolarHBondContact ND1-CE 3.47Å; D335-K429 IonicContact OD1-NZ 2.81Å
430	F	98.7	Very high	96.8	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	163.7	172.6	73.2	-95.1	0	0	0	111	I295 F297 L328 V329 Q330 R331 T432 E435 A436	I295-F430 HydrophobicContact CG2-CE1 3.75Å; I295-F430 HydrophobicContact CG2-CZ 3.78Å; F297-F430 HydrophobicContact CD1-CE2 4.12Å; F297-F430 AromaticContact CD1-CZ 3.81Å; F297-F430 HydrophobicContact CD1-CZ 3.81Å; F297-F430 HydrophobicContact CE1-CE2 4.11Å; F297-F430 AromaticContact CE1-CZ 3.9Å; F297-F430 HydrophobicContact CE1-CZ 3.9Å; L328-F430 VanDerWaalsContact C-CE1 3.45Å; L328-F430 HydrophobicContact CB-CD1 3.86Å; L328-F430 HydrophobicContact CB-CE1 4Å; L328-F430 WeakPolarHBondContact O-CE1 3.17Å; V329-F430 VanDerWaalsContact C-CE1 3.43Å; V329-F430 PolarHBondContact O-N 2.69Å; Q330-F430 CarbonylContact C-O 3.58Å; Q330-F430 WeakPolarHBondContact CA-O 3.49Å; Q330-F430 HydrophobicContact CB-CD2 4.28Å; Q330-F430 HydrophobicContact CB-CE1 3.98Å; Q330-F430 HydrophobicContact CB-CE2 3.61Å; Q330-F430 HydrophobicContact CB-CZ 3.45Å; Q330-F430 VanDerWaalsContact CB-CZ 3.45Å; Q330-F430 HydrophobicContact CG-CD2 4.05Å; Q330-F430 HydrophobicContact CG-CE2 3.53Å; Q330-F430 HydrophobicContact CG-CZ 3.94Å; R331-F430 PolarHBondContact N-O 3.1Å; F430-T432 WeakPolarHBondContact CD2-O 3.49Å; F430-T432 WeakPolarHBondContact CE2-O 3.47Å; F430-E435 HydrophobicContact CB-CG 4.28Å; F430-A436 HydrophobicContact CD1-CB 3.94Å; F430-A436 HydrophobicContact CD2-CB 3.7Å; F430-A436 HydrophobicContact CE1-CB 3.87Å; F430-A436 HydrophobicContact CE2-CB 3.65Å; F430-A436 HydrophobicContact CG-CB 3.84Å; F430-A436 HydrophobicContact CZ-CB 3.72Å
431	D	98.8	Very high	97.5	Very high	69 Å²	69	32.1 Å²	32.1	37%	0.369	17%	0.169	S	C	.	.	S	Bend	trans	-105.8	-43	-178.8	-66.2	-28.8	0	0	0	112.8	Q330 R331 E435	Q330-D431 PolarHBondContact NE2-O 3Å; R331-D431 IonicContact CZ-OD1 2.77Å; R331-D431 IonicContact CZ-OD2 3.26Å; R331-D431 IonicContact NE-OD1 3.15Å; R331-D431 PolarHBondContact NE-OD1 3.4Å; R331-D431 IonicContact NE-OD2 3.79Å; R331-D431 IonicContact NH2-OD1 3.32Å; R331-D431 PolarHBondContact NH2-OD1 2.98Å; R331-D431 IonicContact NH2-OD2 2.73Å; R331-D431 PolarHBondContact NH2-OD2 2.79Å; D431-E435 PolarHBondContact N-OE2 3.37Å
432	T	98.9	Very high	97.6	Very high	72 Å²	72	32.4 Å²	32.4	44%	0.442	18%	0.181	S	C	.	.			trans	-118.4	154.8	-172.9	69.4	0	0	0	0	113.4	F430 E434 E435 A436	F430-T432 WeakPolarHBondContact CD2-O 3.49Å; F430-T432 WeakPolarHBondContact CE2-O 3.47Å; T432-E434 VanDerWaalsContact C-N 3.29Å; T432-E434 PolarHBondContact O-N 3.36Å; T432-E435 PolarHBondContact N-OE2 2.95Å; T432-E435 PolarHBondContact O-N 3.38Å; T432-E435 VanDerWaalsContact OG1-CB 3.24Å; T432-E435 WeakPolarHBondContact OG1-CB 3.47Å; T432-E435 PolarHBondContact OG1-N 3.5Å; T432-A436 PolarHBondContact O-N 3.49Å; T432-A436 VanDerWaalsContact O-N 3.08Å
433	E	98.8	Very high	97.3	Very high	35 Å²	35	33.4 Å²	33.4	16%	0.164	19%	0.189	C	C	.	.	H	α-helix	trans	-58.3	-42.5	174.3	179.4	-177.8	130.5	0	0	112	F297 E435 A436 I437 Q458 R461 V462	F297-E433 HydrophobicContact CE1-CB 4.06Å; F297-E433 HydrophobicContact CE1-CG 3.94Å; F297-E433 HydrophobicContact CZ-CG 4.18Å; E433-E435 PolarHBondContact O-N 3.2Å; E433-A436 PolarHBondContact O-N 3.06Å; E433-I437 HydrophobicContact CG-CD1 3.97Å; E433-I437 WeakPolarHBondContact O-CG1 3.36Å; E433-I437 PolarHBondContact O-N 3.37Å; E433-Q458 VanDerWaalsContact OE2-CG 3.26Å; E433-Q458 WeakPolarHBondContact OE2-CG 3.13Å; E433-Q458 PolarHBondContact OE2-NE2 3.32Å; E433-R461 IonicContact OE1-CZ 3.12Å; E433-R461 IonicContact OE1-NE 3.63Å; E433-R461 PolarHBondContact OE1-NE 3.2Å; E433-R461 IonicContact OE1-NH2 2.65Å; E433-R461 PolarHBondContact OE1-NH2 3.3Å; E433-R461 IonicContact OE2-CZ 3.93Å; E433-R461 IonicContact OE2-NE 2.73Å; E433-R461 IonicContact OE2-NH2 2.85Å; E433-R461 PolarHBondContact OE2-NH2 3.09Å; E433-V462 HydrophobicContact CG-CG2 4.04Å
434	E	98.8	Very high	96.9	Very high	160 Å²	160	38.8 Å²	38.8	75%	0.748	22%	0.218	S	C	*	.	H	α-helix	trans	-60.6	-44.3	178.1	-176.1	177.7	-175.1	0	0	111.8	T432 I437 A438	T432-E434 VanDerWaalsContact C-N 3.29Å; T432-E434 PolarHBondContact O-N 3.36Å; E434-I437 PolarHBondContact O-N 3.28Å; E434-A438 WeakPolarHBondContact O-CB 3.48Å; E434-A438 PolarHBondContact O-N 2.97Å
435	E	98.6	Very high	96.4	Very high	70 Å²	70	40.1 Å²	40.1	33%	0.327	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-46.1	175.7	-179.7	-171.2	-177.6	0	0	111.8	F430 D431 T432 E433 I437 A438 I439	F430-E435 HydrophobicContact CB-CG 4.28Å; D431-E435 PolarHBondContact N-OE2 3.37Å; T432-E435 PolarHBondContact N-OE2 2.95Å; T432-E435 PolarHBondContact O-N 3.38Å; T432-E435 VanDerWaalsContact OG1-CB 3.24Å; T432-E435 WeakPolarHBondContact OG1-CB 3.47Å; T432-E435 PolarHBondContact OG1-N 3.5Å; E433-E435 PolarHBondContact O-N 3.2Å; E435-I437 VanDerWaalsContact C-N 3.34Å; E435-I437 PolarHBondContact O-N 3.19Å; E435-A438 PolarHBondContact O-N 3.38Å; E435-I439 HydrophobicContact CG-CD1 3.89Å; E435-I439 VanDerWaalsContact O-CG1 3.3Å; E435-I439 WeakPolarHBondContact O-CG1 3.38Å; E435-I439 PolarHBondContact O-N 3.48Å
436	A	98.4	Very high	96.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-42.9	178.3	0	0	0	0	0	112.2	I295 F430 T432 E433 A440	I295-A436 HydrophobicContact CD1-CB 4.44Å; I295-A436 HydrophobicContact CG2-CB 3.96Å; F430-A436 HydrophobicContact CD1-CB 3.94Å; F430-A436 HydrophobicContact CD2-CB 3.7Å; F430-A436 HydrophobicContact CE1-CB 3.87Å; F430-A436 HydrophobicContact CE2-CB 3.65Å; F430-A436 HydrophobicContact CG-CB 3.84Å; F430-A436 HydrophobicContact CZ-CB 3.72Å; T432-A436 PolarHBondContact O-N 3.49Å; T432-A436 VanDerWaalsContact O-N 3.08Å; E433-A436 PolarHBondContact O-N 3.06Å; A436-A440 VanDerWaalsContact O-CB 3.24Å; A436-A440 WeakPolarHBondContact O-CB 3.43Å; A436-A440 PolarHBondContact O-N 3.04Å
437	I	98.4	Very high	96.1	Very high	13 Å²	13	40.2 Å²	40.2	7%	0.067	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-44	176.4	-67.3	169.2	0	0	0	110.2	E433 E434 E435 I439 A440 N441 V462 Q465	E433-I437 HydrophobicContact CG-CD1 3.97Å; E433-I437 WeakPolarHBondContact O-CG1 3.36Å; E433-I437 PolarHBondContact O-N 3.37Å; E434-I437 PolarHBondContact O-N 3.28Å; E435-I437 VanDerWaalsContact C-N 3.34Å; E435-I437 PolarHBondContact O-N 3.19Å; I437-I439 PolarHBondContact O-N 3.18Å; I437-A440 PolarHBondContact O-N 2.85Å; I437-N441 WeakPolarHBondContact CG2-ND2 3.42Å; I437-N441 WeakPolarHBondContact O-CB 3.43Å; I437-N441 PolarHBondContact O-N 2.77Å; I437-V462 HydrophobicContact CD1-CG2 4.22Å; I437-Q465 HydrophobicContact CD1-CB 4.2Å; I437-Q465 HydrophobicContact CG2-CB 4.15Å
438	A	98	Very high	96	Very high	60 Å²	60	40.2 Å²	40.2	50%	0.496	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-44.7	178.9	0	0	0	0	0	112	E434 E435 N441 A442	E434-A438 WeakPolarHBondContact O-CB 3.48Å; E434-A438 PolarHBondContact O-N 2.97Å; E435-A438 PolarHBondContact O-N 3.38Å; A438-N441 PolarHBondContact O-N 3.28Å; A438-A442 WeakPolarHBondContact O-CB 3.24Å; A438-A442 PolarHBondContact O-N 3.42Å; A438-A442 VanDerWaalsContact O-N 3.08Å
439	I	96.1	Very high	96	Very high	17 Å²	17	39.9 Å²	39.9	9%	0.087	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-46.3	176.1	-63.1	164.8	0	0	0	110.4	L328 E435 I437 N441 A442	L328-I439 HydrophobicContact CD1-CB 4.31Å; L328-I439 HydrophobicContact CD1-CG2 4.2Å; L328-I439 HydrophobicContact CD2-CB 4.12Å; L328-I439 HydrophobicContact CD2-CD1 4.17Å; L328-I439 HydrophobicContact CD2-CG2 3.61Å; E435-I439 HydrophobicContact CG-CD1 3.89Å; E435-I439 VanDerWaalsContact O-CG1 3.3Å; E435-I439 WeakPolarHBondContact O-CG1 3.38Å; E435-I439 PolarHBondContact O-N 3.48Å; I437-I439 PolarHBondContact O-N 3.18Å; I439-N441 VanDerWaalsContact C-N 3.32Å; I439-N441 PolarHBondContact O-N 3.01Å; I439-A442 WeakPolarHBondContact O-CB 3.34Å; I439-A442 PolarHBondContact O-N 3.28Å
440	A	96.1	Very high	96	Very high	9 Å²	9	36 Å²	36	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-40.1	179.5	0	0	0	0	0	112.8	P293 I295 L328 A436 I437 L466	P293-A440 HydrophobicContact CB-CB 3.74Å; P293-A440 HydrophobicContact CG-CB 3.86Å; I295-A440 HydrophobicContact CD1-CB 4.17Å; L328-A440 HydrophobicContact CD1-CB 4.02Å; A436-A440 VanDerWaalsContact O-CB 3.24Å; A436-A440 WeakPolarHBondContact O-CB 3.43Å; A436-A440 PolarHBondContact O-N 3.04Å; I437-A440 PolarHBondContact O-N 2.85Å; A440-L466 HydrophobicContact CB-CD2 3.62Å
441	N	96.6	Very high	96	Very high	28 Å²	28	36 Å²	36	15%	0.15	21%	0.208	C	C	.	.	H	α-helix	trans	-85.1	-9.6	-177.7	-71.2	-14.1	0	0	0	113.9	I437 A438 I439 A443 Q465 E467 K489	I437-N441 WeakPolarHBondContact CG2-ND2 3.42Å; I437-N441 WeakPolarHBondContact O-CB 3.43Å; I437-N441 PolarHBondContact O-N 2.77Å; A438-N441 PolarHBondContact O-N 3.28Å; I439-N441 VanDerWaalsContact C-N 3.32Å; I439-N441 PolarHBondContact O-N 3.01Å; N441-A443 PolarHBondContact O-N 3.01Å; N441-Q465 PolarHBondContact ND2-O 2.89Å; N441-E467 HydrophobicContact CB-CG 4.44Å; N441-E467 PolarHBondContact OD1-N 3.32Å; N441-K489 PolarHBondContact O-NZ 3.04Å
442	A	92.3	Very high	96	Very high	58 Å²	58	32.9 Å²	32.9	48%	0.479	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.7	-178.8	0	0	0	0	0	113.7	Q411 A438 I439	Q411-A442 VanDerWaalsContact NE2-CB 3.35Å; A438-A442 WeakPolarHBondContact O-CB 3.24Å; A438-A442 PolarHBondContact O-N 3.42Å; A438-A442 VanDerWaalsContact O-N 3.08Å; I439-A442 WeakPolarHBondContact O-CB 3.34Å; I439-A442 PolarHBondContact O-N 3.28Å
443	A	87.4	Confident	96	Very high	21 Å²	21	29.5 Å²	29.5	17%	0.174	17%	0.17	C	C	.	.	S	Bend	trans	-74.1	140.4	177.4	0	0	0	0	0	112	L291 N441 V445 K489	L291-A443 HydrophobicContact CD1-CB 4.37Å; N441-A443 PolarHBondContact O-N 3.01Å; A443-V445 HydrophobicContact CB-CG2 3.8Å; A443-V445 PolarHBondContact O-N 2.95Å; A443-V445 VanDerWaalsContact O-N 3.14Å; A443-K489 PolarHBondContact O-NZ 3.34Å; A443-K489 VanDerWaalsContact O-NZ 3.16Å
444	D	88.1	Confident	96	Very high	113 Å²	113	33.4 Å²	33.4	60%	0.604	19%	0.189	S	C	*	.	S	Bend	trans	-68.3	-6.1	171.3	-80.5	-27.7	0	0	0	113.6	K489 Q490	D444-K489 VanDerWaalsContact O-CB 3.26Å; D444-K489 WeakPolarHBondContact O-CB 3.42Å; D444-Q490 WeakPolarHBondContact O-CB 3.2Å; D444-Q490 PolarHBondContact O-N 2.89Å; D444-Q490 VanDerWaalsContact O-N 3.16Å
445	V	88.7	Confident	96	Very high	27 Å²	27	29 Å²	29	16%	0.164	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.9	-179.9	-70.2	0	0	0	0	109.4	G289 L291 A443 S491	G289-V445 WeakPolarHBondContact O-CG1 3.4Å; L291-V445 HydrophobicContact CB-CG2 3.84Å; L291-V445 HydrophobicContact CD1-CG2 4.11Å; L291-V445 HydrophobicContact CG-CG2 4.01Å; A443-V445 HydrophobicContact CB-CG2 3.8Å; A443-V445 PolarHBondContact O-N 2.95Å; A443-V445 VanDerWaalsContact O-N 3.14Å; V445-S491 WeakPolarHBondContact CA-OG 3.35Å; V445-S491 VanDerWaalsContact CB-OG 3.24Å; V445-S491 WeakPolarHBondContact CB-OG 3.2Å
446	G	93.9	Very high	96	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	76	-177.3	0	0	0	0	0	111	E467 G469 G487 V488 S491	G446-E467 WeakPolarHBondContact CA-O 3.31Å; G446-G469 PolarHBondContact O-N 3.41Å; G446-G487 CarbonylContact O-C 3.55Å; G446-G487 WeakPolarHBondContact O-CA 3.08Å; G446-V488 WeakPolarHBondContact O-CG2 3.47Å; G446-V488 PolarHBondContact O-N 3.04Å; G446-S491 PolarHBondContact N-OG 3.38Å
447	L	95.8	Very high	96	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	20%	0.204	C	C	.	.	S	Bend	trans	-95.9	-75.5	-178	-174.4	62.2	0	0	0	111.8	E287 C321 V322 G469 M470	E287-L447 HydrophobicContact CG-CD1 3.99Å; E287-L447 HydrophobicContact CG-CD2 4.45Å; C321-L447 HydrophobicContact CB-CD2 3.55Å; V322-L447 HydrophobicContact CG1-CD2 3.98Å; V322-L447 HydrophobicContact CG1-CG 4.18Å; L447-G469 WeakPolarHBondContact O-CA 3.18Å; L447-G469 PolarHBondContact O-N 3.25Å; L447-M470 HydrophobicContact CD1-CE 3.54Å; L447-M470 HydrophobicContact CG-CE 3.67Å; L447-M470 WeakPolarHBondContact O-CE 3.24Å; L447-M470 PolarHBondContact O-N 3Å; L447-M470 VanDerWaalsContact O-N 3.12Å
448	A	97.1	Very high	96	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	152.5	175.5	0	0	0	0	0	110.1	A292 P293 V322 Y450 M470	A292-A448 WeakPolarHBondContact CA-O 3.5Å; A292-A448 HydrophobicContact CB-CB 4.31Å; A292-A448 VanDerWaalsContact CB-O 3.23Å; A292-A448 WeakPolarHBondContact CB-O 3.5Å; P293-A448 WeakPolarHBondContact CD-O 3.29Å; V322-A448 HydrophobicContact CB-CB 3.82Å; V322-A448 HydrophobicContact CG1-CB 3.65Å; A448-Y450 HydrophobicContact CB-CE2 4.03Å; A448-M470 CarbonylContact C-O 3.45Å; A448-M470 WeakPolarHBondContact CA-O 3.31Å; A448-M470 HydrophobicContact CB-CE 4.21Å
449	G	97.9	Very high	96.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.1	169	0	0	0	0	0	110	M470 V471 G472	G449-M470 PolarHBondContact N-O 3.49Å; G449-V471 CarbonylContact O-C 3.52Å; G449-V471 VanDerWaalsContact O-CA 3.27Å; G449-V471 WeakPolarHBondContact O-CA 3.32Å; G449-G472 PolarHBondContact O-N 2.96Å
450	Y	98.7	Very high	96.2	Very high	1 Å²	1	39.3 Å²	39.3	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.1	-178.2	-56.6	-86.3	0	0	0	109	A292 P293 F294 I295 V322 A448 G472 E475 G476 I478	A292-Y450 HydrophobicContact CB-CD2 4.4Å; A292-Y450 HydrophobicContact CB-CE2 4.07Å; P293-Y450 PolarHBondContact O-N 2.93Å; F294-Y450 CarbonylContact C-O 3.47Å; F294-Y450 WeakPolarHBondContact CA-O 3.26Å; F294-Y450 VanDerWaalsContact CD2-CB 3.45Å; F294-Y450 HydrophobicContact CD2-CD2 4.25Å; F294-Y450 AromaticContact CD2-CG 3.95Å; F294-Y450 HydrophobicContact CD2-CG 3.95Å; F294-Y450 HydrophobicContact CE2-CG 4.47Å; I295-Y450 PolarHBondContact N-O 3.02Å; V322-Y450 WeakPolarHBondContact O-CE2 3.28Å; V322-Y450 PolarHBondContact O-OH 2.78Å; V322-Y450 VanDerWaalsContact O-OH 3.05Å; A448-Y450 HydrophobicContact CB-CE2 4.03Å; Y450-G472 CarbonylContact C-O 3.53Å; Y450-G472 WeakPolarHBondContact CA-O 3.26Å; Y450-E475 WeakPolarHBondContact CD1-O 3.45Å; Y450-G476 WeakPolarHBondContact CE1-O 3.17Å; Y450-I478 HydrophobicContact CE1-CD1 4.15Å; Y450-I478 HydrophobicContact CE1-CG1 4.23Å; Y450-I478 HydrophobicContact CE1-CG2 4.25Å
451	F	98.9	Very high	96.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.8	165.4	72.4	-88.3	0	0	0	113.5	I295 F297 I459 V462 A463 L466 V471 G472 V473 N474	I295-F451 HydrophobicContact CB-CB 3.79Å; I295-F451 HydrophobicContact CG1-CB 4.48Å; I295-F451 CarbonylContact O-C 3.58Å; I295-F451 WeakPolarHBondContact O-CA 3.5Å; I295-F451 WeakPolarHBondContact O-CB 3.21Å; F297-F451 HydrophobicContact CD2-CD2 4.27Å; F297-F451 HydrophobicContact CE2-CB 4.11Å; F297-F451 AromaticContact CE2-CD2 3.97Å; F297-F451 HydrophobicContact CE2-CD2 3.97Å; F297-F451 HydrophobicContact CE2-CG 4.29Å; F451-I459 HydrophobicContact CE2-CB 4.29Å; F451-I459 HydrophobicContact CE2-CG1 3.94Å; F451-I459 HydrophobicContact CZ-CB 4.35Å; F451-I459 HydrophobicContact CZ-CG1 4.44Å; F451-I459 HydrophobicContact CZ-CG2 4.25Å; F451-I459 WeakPolarHBondContact CZ-O 3.48Å; F451-V462 HydrophobicContact CB-CG1 4.39Å; F451-V462 HydrophobicContact CD1-CB 4.29Å; F451-V462 HydrophobicContact CD1-CG1 3.58Å; F451-V462 HydrophobicContact CD2-CB 4.49Å; F451-V462 HydrophobicContact CD2-CG1 4.25Å; F451-V462 HydrophobicContact CE1-CB 4.05Å; F451-V462 HydrophobicContact CE1-CG1 3.8Å; F451-V462 HydrophobicContact CE2-CB 4.28Å; F451-V462 HydrophobicContact CE2-CG1 4.46Å; F451-V462 HydrophobicContact CG-CB 4.5Å; F451-V462 HydrophobicContact CG-CG1 3.82Å; F451-V462 HydrophobicContact CZ-CB 4.06Å; F451-V462 HydrophobicContact CZ-CG1 4.25Å; F451-A463 HydrophobicContact CE1-CB 4.06Å; F451-A463 HydrophobicContact CZ-CB 4.25Å; F451-L466 HydrophobicContact CD1-CD1 4.11Å; F451-V471 HydrophobicContact CD1-CG1 3.99Å; F451-V471 HydrophobicContact CE1-CG1 3.72Å; F451-G472 PolarHBondContact N-O 3.15Å; F451-V473 HydrophobicContact CE1-CB 4.48Å; F451-V473 HydrophobicContact CE1-CG2 3.63Å; F451-V473 HydrophobicContact CE2-CG1 3.89Å; F451-V473 HydrophobicContact CE2-CG2 4.46Å; F451-V473 HydrophobicContact CZ-CB 4.21Å; F451-V473 HydrophobicContact CZ-CG1 3.79Å; F451-V473 HydrophobicContact CZ-CG2 3.58Å; F451-N474 PolarHBondContact O-N 3.13Å
452	Y	98.9	Very high	96.4	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.9	175.5	-78.9	-104.9	0	0	0	110.1	F294 I295 F297 Q304 A305 G308 N474 E475 G476	F294-Y452 AromaticContact CE1-CD2 3.84Å; F294-Y452 HydrophobicContact CE1-CD2 3.84Å; F294-Y452 HydrophobicContact CE1-CE2 4.07Å; F294-Y452 HydrophobicContact CE2-CD2 4.26Å; F294-Y452 AromaticContact CE2-CE2 3.77Å; F294-Y452 HydrophobicContact CE2-CE2 3.77Å; F294-Y452 AromaticContact CZ-CD2 3.5Å; F294-Y452 HydrophobicContact CZ-CD2 3.5Å; F294-Y452 AromaticContact CZ-CE2 3.25Å; F294-Y452 HydrophobicContact CZ-CE2 3.25Å; I295-Y452 PolarHBondContact O-N 3.32Å; F297-Y452 WeakPolarHBondContact CD2-O 3.46Å; F297-Y452 PolarHBondContact N-O 3.16Å; Q304-Y452 HydrophobicContact CB-CD1 4.27Å; Q304-Y452 HydrophobicContact CB-CE1 3.93Å; Q304-Y452 VanDerWaalsContact O-CE1 3.23Å; Q304-Y452 WeakPolarHBondContact O-CE1 3.45Å; Q304-Y452 PolarHBondContact O-OH 2.97Å; A305-Y452 VanDerWaalsContact CA-CD1 3.48Å; A305-Y452 HydrophobicContact CB-CD1 3.84Å; A305-Y452 HydrophobicContact CB-CD2 4.22Å; A305-Y452 HydrophobicContact CB-CE1 4.45Å; A305-Y452 HydrophobicContact CB-CG 3.72Å; G308-Y452 WeakPolarHBondContact CA-OH 3.27Å; Y452-N474 VanDerWaalsContact CA-OD1 3.26Å; Y452-N474 WeakPolarHBondContact CA-OD1 3.43Å; Y452-N474 HydrophobicContact CD1-CB 4.13Å; Y452-N474 WeakPolarHBondContact CD1-OD1 3.47Å; Y452-N474 VanDerWaalsContact CE1-C 3.42Å; Y452-N474 VanDerWaalsContact CE1-CA 3.45Å; Y452-N474 HydrophobicContact CE1-CB 4.15Å; Y452-N474 WeakPolarHBondContact CE1-O 3.32Å; Y452-N474 PolarHBondContact OH-O 3.24Å; Y452-E475 WeakPolarHBondContact OH-CA 3.41Å; Y452-E475 PolarHBondContact OH-N 2.95Å; Y452-G476 PolarHBondContact OH-N 3.22Å
453	S	98.8	Very high	96.7	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.			trans	-159.7	151.8	-179.2	179.1	0	0	0	0	109.9	S299 D455 Q458 N474	S299-S453 PolarHBondContact OG-OG 3.03Å; S299-S453 VanDerWaalsContact OG-OG 3.07Å; S453-D455 PolarHBondContact OG-N 2.94Å; S453-D455 VanDerWaalsContact OG-N 3.14Å; S453-Q458 PolarHBondContact OG-OE1 2.55Å; S453-N474 PolarHBondContact N-OD1 3.46Å; S453-N474 PolarHBondContact O-ND2 3.39Å; S453-N474 PolarHBondContact O-OD1 3.36Å; S453-N474 VanDerWaalsContact O-OD1 3.13Å
454	Q	98.7	Very high	97.3	Very high	118 Å²	118	46.8 Å²	46.8	55%	0.551	24%	0.238	S	C	*	.	S	Bend	trans	-109.9	0.1	170	-65.6	-64.9	-61.6	0	0	112.9	S299 P456	S299-Q454 WeakPolarHBondContact O-CB 3.39Å; S299-Q454 WeakPolarHBondContact O-CG 3.26Å; S299-Q454 PolarHBondContact OG-N 3.49Å; S299-Q454 VanDerWaalsContact OG-N 3.07Å; Q454-P456 WeakPolarHBondContact O-CD 3.3Å
455	D	98.8	Very high	97.8	Very high	67 Å²	67	45.8 Å²	45.8	36%	0.358	23%	0.23	S	C	.	.			trans	-86.6	115.1	177.6	177.1	-32.2	0	0	0	109.9	S453 A457 Q458 I459	S453-D455 PolarHBondContact OG-N 2.94Å; S453-D455 VanDerWaalsContact OG-N 3.14Å; D455-A457 VanDerWaalsContact C-N 3.3Å; D455-A457 PolarHBondContact O-N 2.96Å; D455-A457 WeakPolarHBondContact OD1-CA 3.39Å; D455-A457 WeakPolarHBondContact OD1-CB 3.49Å; D455-A457 PolarHBondContact OD1-N 3.42Å; D455-Q458 HydrophobicContact CB-CB 3.74Å; D455-Q458 PolarHBondContact O-N 3.45Å; D455-Q458 PolarHBondContact OD1-N 3.34Å; D455-I459 VanDerWaalsContact O-CG1 3.27Å; D455-I459 WeakPolarHBondContact O-CG1 3.42Å; D455-I459 PolarHBondContact O-N 2.97Å
456	P	98.5	Very high	98.2	Very high	94 Å²	94	44.9 Å²	44.9	61%	0.61	22%	0.224	S	C	*	.	H	α-helix	trans	-60	-36	-178.6	-25.1	35.9	0	0	0	114	Q454 W460	Q454-P456 WeakPolarHBondContact O-CD 3.3Å; P456-W460 VanDerWaalsContact O-CD1 3.28Å; P456-W460 PolarHBondContact O-N 3.18Å
457	A	98.7	Very high	98.4	Very high	51 Å²	51	49.6 Å²	49.6	42%	0.421	25%	0.246	S	C	.	.	H	α-helix	trans	-73.4	-40	179.9	0	0	0	0	0	111	D455 I459 W460 R461	D455-A457 VanDerWaalsContact C-N 3.3Å; D455-A457 PolarHBondContact O-N 2.96Å; D455-A457 WeakPolarHBondContact OD1-CA 3.39Å; D455-A457 WeakPolarHBondContact OD1-CB 3.49Å; D455-A457 PolarHBondContact OD1-N 3.42Å; A457-I459 VanDerWaalsContact C-N 3.31Å; A457-W460 PolarHBondContact O-N 3.32Å; A457-R461 WeakPolarHBondContact O-CG 3.33Å; A457-R461 PolarHBondContact O-N 3.09Å; A457-R461 VanDerWaalsContact O-N 3.07Å; A457-R461 PolarHBondContact O-NH1 2.83Å
458	Q	98.8	Very high	98.5	Very high	16 Å²	16	50.6 Å²	50.6	8%	0.075	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-40.2	172.8	179.5	169.1	79.8	0	0	111.6	F297 E433 S453 D455 W460 R461 V462	F297-Q458 HydrophobicContact CD2-CG 4.37Å; F297-Q458 HydrophobicContact CE2-CG 4.3Å; F297-Q458 HydrophobicContact CZ-CG 4.48Å; E433-Q458 VanDerWaalsContact OE2-CG 3.26Å; E433-Q458 WeakPolarHBondContact OE2-CG 3.13Å; E433-Q458 PolarHBondContact OE2-NE2 3.32Å; S453-Q458 PolarHBondContact OG-OE1 2.55Å; D455-Q458 HydrophobicContact CB-CB 3.74Å; D455-Q458 PolarHBondContact O-N 3.45Å; D455-Q458 PolarHBondContact OD1-N 3.34Å; Q458-W460 VanDerWaalsContact C-N 3.35Å; Q458-W460 PolarHBondContact O-N 2.75Å; Q458-R461 PolarHBondContact O-N 2.9Å; Q458-V462 HydrophobicContact CG-CG2 3.87Å; Q458-V462 WeakPolarHBondContact O-CB 3.41Å; Q458-V462 VanDerWaalsContact O-CG2 3.27Å; Q458-V462 WeakPolarHBondContact O-CG2 3.37Å; Q458-V462 PolarHBondContact O-N 3.06Å
459	I	98.8	Very high	98.6	Very high	40 Å²	40	51.6 Å²	51.6	21%	0.205	26%	0.263	C	S	.	.	H	α-helix	trans	-55.4	-50.2	177.2	-74.4	164.6	0	0	0	111.1	F451 D455 A457 A463 V473	F451-I459 HydrophobicContact CE2-CB 4.29Å; F451-I459 HydrophobicContact CE2-CG1 3.94Å; F451-I459 HydrophobicContact CZ-CB 4.35Å; F451-I459 HydrophobicContact CZ-CG1 4.44Å; F451-I459 HydrophobicContact CZ-CG2 4.25Å; F451-I459 WeakPolarHBondContact CZ-O 3.48Å; D455-I459 VanDerWaalsContact O-CG1 3.27Å; D455-I459 WeakPolarHBondContact O-CG1 3.42Å; D455-I459 PolarHBondContact O-N 2.97Å; A457-I459 VanDerWaalsContact C-N 3.31Å; I459-A463 WeakPolarHBondContact O-CB 3.28Å; I459-A463 PolarHBondContact O-N 3.49Å; I459-V473 HydrophobicContact CB-CG1 4.49Å; I459-V473 HydrophobicContact CD1-CG1 4.35Å; I459-V473 HydrophobicContact CG1-CG1 4.03Å; I459-V473 HydrophobicContact CG2-CG1 3.76Å
460	W	98.7	Very high	98.6	Very high	175 Å²	175	52.4 Å²	52.4	66%	0.663	27%	0.267	S	S	*	.	H	α-helix	trans	-64.9	-48.8	178.4	-79.6	100.3	0	0	0	112.2	P456 A457 Q458 V462 A463 E464	P456-W460 VanDerWaalsContact O-CD1 3.28Å; P456-W460 PolarHBondContact O-N 3.18Å; A457-W460 PolarHBondContact O-N 3.32Å; Q458-W460 VanDerWaalsContact C-N 3.35Å; Q458-W460 PolarHBondContact O-N 2.75Å; W460-V462 PolarHBondContact O-N 2.78Å; W460-A463 PolarHBondContact O-N 3.22Å; W460-E464 WeakPolarHBondContact O-CB 3.35Å; W460-E464 WeakPolarHBondContact O-CG 3.43Å; W460-E464 PolarHBondContact O-N 3.02Å
461	R	98.8	Very high	98.6	Very high	97 Å²	97	54.6 Å²	54.6	37%	0.366	28%	0.28	S	S	.	.	H	α-helix	trans	-56.3	-48.3	-179.3	-76.8	-165.9	-49.8	-86.8	0.7	112.5	E433 A457 Q458 Q465	E433-R461 IonicContact OE1-CZ 3.12Å; E433-R461 IonicContact OE1-NE 3.63Å; E433-R461 PolarHBondContact OE1-NE 3.2Å; E433-R461 IonicContact OE1-NH2 2.65Å; E433-R461 PolarHBondContact OE1-NH2 3.3Å; E433-R461 IonicContact OE2-CZ 3.93Å; E433-R461 IonicContact OE2-NE 2.73Å; E433-R461 IonicContact OE2-NH2 2.85Å; E433-R461 PolarHBondContact OE2-NH2 3.09Å; A457-R461 WeakPolarHBondContact O-CG 3.33Å; A457-R461 PolarHBondContact O-N 3.09Å; A457-R461 VanDerWaalsContact O-N 3.07Å; A457-R461 PolarHBondContact O-NH1 2.83Å; Q458-R461 PolarHBondContact O-N 2.9Å; R461-Q465 VanDerWaalsContact O-CB 3.22Å; R461-Q465 WeakPolarHBondContact O-CB 3.28Å; R461-Q465 WeakPolarHBondContact O-CG 3.39Å; R461-Q465 PolarHBondContact O-N 2.82Å; R461-Q465 PolarHBondContact O-NE2 3.33Å
462	V	98.8	Very high	98.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-73	-39.9	-176.4	178.7	0	0	0	0	110.8	I295 F297 E433 I437 F451 Q458 W460 E464 Q465 L466	I295-V462 HydrophobicContact CD1-CG1 4.48Å; F297-V462 HydrophobicContact CE2-CG1 4.2Å; F297-V462 HydrophobicContact CE2-CG2 3.83Å; F297-V462 HydrophobicContact CZ-CG1 4.3Å; F297-V462 HydrophobicContact CZ-CG2 3.6Å; E433-V462 HydrophobicContact CG-CG2 4.04Å; I437-V462 HydrophobicContact CD1-CG2 4.22Å; F451-V462 HydrophobicContact CB-CG1 4.39Å; F451-V462 HydrophobicContact CD1-CB 4.29Å; F451-V462 HydrophobicContact CD1-CG1 3.58Å; F451-V462 HydrophobicContact CD2-CB 4.49Å; F451-V462 HydrophobicContact CD2-CG1 4.25Å; F451-V462 HydrophobicContact CE1-CB 4.05Å; F451-V462 HydrophobicContact CE1-CG1 3.8Å; F451-V462 HydrophobicContact CE2-CB 4.28Å; F451-V462 HydrophobicContact CE2-CG1 4.46Å; F451-V462 HydrophobicContact CG-CB 4.5Å; F451-V462 HydrophobicContact CG-CG1 3.82Å; F451-V462 HydrophobicContact CZ-CB 4.06Å; F451-V462 HydrophobicContact CZ-CG1 4.25Å; Q458-V462 HydrophobicContact CG-CG2 3.87Å; Q458-V462 WeakPolarHBondContact O-CB 3.41Å; Q458-V462 VanDerWaalsContact O-CG2 3.27Å; Q458-V462 WeakPolarHBondContact O-CG2 3.37Å; Q458-V462 PolarHBondContact O-N 3.06Å; W460-V462 PolarHBondContact O-N 2.78Å; V462-E464 VanDerWaalsContact C-N 3.28Å; V462-E464 PolarHBondContact O-N 3.33Å; V462-Q465 PolarHBondContact O-N 2.72Å; V462-L466 HydrophobicContact CG1-CD1 3.83Å; V462-L466 HydrophobicContact CG1-CG 4.07Å; V462-L466 WeakPolarHBondContact O-CB 3.46Å; V462-L466 WeakPolarHBondContact O-CG 3.32Å; V462-L466 PolarHBondContact O-N 3.17Å
463	A	98.6	Very high	98.6	Very high	33 Å²	33	57 Å²	57	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-62.6	-35.1	178	0	0	0	0	0	112.8	F451 I459 W460 V471	F451-A463 HydrophobicContact CE1-CB 4.06Å; F451-A463 HydrophobicContact CZ-CB 4.25Å; I459-A463 WeakPolarHBondContact O-CB 3.28Å; I459-A463 PolarHBondContact O-N 3.49Å; W460-A463 PolarHBondContact O-N 3.22Å; A463-V471 HydrophobicContact CB-CG1 4.4Å
464	E	98.6	Very high	98.6	Very high	143 Å²	143	59.1 Å²	59.1	67%	0.668	31%	0.307	S	S	*	.	H	α-helix	trans	-81.4	-33.1	178	-68.3	176.7	160.7	0	0	113.1	W460 V462	W460-E464 WeakPolarHBondContact O-CB 3.35Å; W460-E464 WeakPolarHBondContact O-CG 3.43Å; W460-E464 PolarHBondContact O-N 3.02Å; V462-E464 VanDerWaalsContact C-N 3.28Å; V462-E464 PolarHBondContact O-N 3.33Å
465	Q	98.7	Very high	98.5	Very high	92 Å²	92	57.8 Å²	57.8	43%	0.43	30%	0.301	S	S	.	.	H	α-helix	trans	-88	-18.8	-175.4	-72.1	175.8	75.1	0	0	114.4	I437 N441 R461 V462 E467	I437-Q465 HydrophobicContact CD1-CB 4.2Å; I437-Q465 HydrophobicContact CG2-CB 4.15Å; N441-Q465 PolarHBondContact ND2-O 2.89Å; R461-Q465 VanDerWaalsContact O-CB 3.22Å; R461-Q465 WeakPolarHBondContact O-CB 3.28Å; R461-Q465 WeakPolarHBondContact O-CG 3.39Å; R461-Q465 PolarHBondContact O-N 2.82Å; R461-Q465 PolarHBondContact O-NE2 3.33Å; V462-Q465 PolarHBondContact O-N 2.72Å; Q465-E467 PolarHBondContact O-N 2.8Å
466	L	98.4	Very high	98.3	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.047	28%	0.284	C	S	.	.	S	Bend	trans	-67.3	118.4	173.9	-83.9	173.3	0	0	0	110.4	P293 I295 A440 F451 V462 V468 V471	P293-L466 HydrophobicContact CG-CD2 4.23Å; I295-L466 HydrophobicContact CD1-CD1 4.5Å; I295-L466 HydrophobicContact CD1-CD2 4.12Å; A440-L466 HydrophobicContact CB-CD2 3.62Å; F451-L466 HydrophobicContact CD1-CD1 4.11Å; V462-L466 HydrophobicContact CG1-CD1 3.83Å; V462-L466 HydrophobicContact CG1-CG 4.07Å; V462-L466 WeakPolarHBondContact O-CB 3.46Å; V462-L466 WeakPolarHBondContact O-CG 3.32Å; V462-L466 PolarHBondContact O-N 3.17Å; L466-V468 HydrophobicContact CB-CG2 4.05Å; L466-V468 PolarHBondContact O-N 2.69Å; L466-V471 HydrophobicContact CB-CG2 4.44Å; L466-V471 HydrophobicContact CD1-CG1 4.47Å
467	E	98.1	Very high	98.1	Very high	100 Å²	100	53.7 Å²	53.7	47%	0.467	27%	0.273	S	S	.	.			trans	-81.7	59.9	-178	-66.3	-178.5	170.9	0	0	111.7	N441 G446 Q465 V488 K489	N441-E467 HydrophobicContact CB-CG 4.44Å; N441-E467 PolarHBondContact OD1-N 3.32Å; G446-E467 WeakPolarHBondContact CA-O 3.31Å; Q465-E467 PolarHBondContact O-N 2.8Å; E467-V488 VanDerWaalsContact O-CG2 3.25Å; E467-V488 WeakPolarHBondContact O-CG2 3.45Å; E467-K489 WeakPolarHBondContact OE2-CE 3.45Å; E467-K489 IonicContact OE2-NZ 3.49Å; E467-K489 PolarHBondContact OE2-NZ 3.4Å
468	V	98.2	Very high	97.9	Very high	21 Å²	21	53.3 Å²	53.3	13%	0.127	26%	0.264	C	S	.	.	S	Bend	trans	-127.1	161.8	-178.6	-60.5	0	0	0	0	110.8	L466 M470 V471	L466-V468 HydrophobicContact CB-CG2 4.05Å; L466-V468 PolarHBondContact O-N 2.69Å; V468-M470 VanDerWaalsContact CG2-O 3.25Å; V468-M470 WeakPolarHBondContact CG2-O 3.36Å; V468-V471 HydrophobicContact CG2-CG2 3.5Å; V468-V471 VanDerWaalsContact CG2-CG2 3.5Å
469	G	97.9	Very high	97.6	Very high	23 Å²	23	55.5 Å²	55.5	24%	0.237	28%	0.28	C	S	.	.	S	Bend	trans	-79.3	-21.4	177.4	0	0	0	0	0	114.5	G446 L447 G486	G446-G469 PolarHBondContact O-N 3.41Å; L447-G469 WeakPolarHBondContact O-CA 3.18Å; L447-G469 PolarHBondContact O-N 3.25Å; G469-G486 WeakPolarHBondContact CA-O 3.4Å
470	M	98.4	Very high	97.2	Very high	17 Å²	17	55.2 Å²	55.2	8%	0.084	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	136.2	-174.4	-59.2	162.8	-73.5	0	0	110.5	V322 L447 A448 G449 V468 I478 F485	V322-M470 HydrophobicContact CG1-CE 4.06Å; L447-M470 HydrophobicContact CD1-CE 3.54Å; L447-M470 HydrophobicContact CG-CE 3.67Å; L447-M470 WeakPolarHBondContact O-CE 3.24Å; L447-M470 PolarHBondContact O-N 3Å; L447-M470 VanDerWaalsContact O-N 3.12Å; A448-M470 CarbonylContact C-O 3.45Å; A448-M470 WeakPolarHBondContact CA-O 3.31Å; A448-M470 HydrophobicContact CB-CE 4.21Å; G449-M470 PolarHBondContact N-O 3.49Å; V468-M470 VanDerWaalsContact CG2-O 3.25Å; V468-M470 WeakPolarHBondContact CG2-O 3.36Å; M470-I478 HydrophobicContact CB-CD1 3.81Å; M470-F485 HydrophobicContact CE-CD1 4.14Å; M470-F485 HydrophobicContact CE-CD2 4.35Å; M470-F485 HydrophobicContact CE-CE1 3.96Å; M470-F485 HydrophobicContact CE-CE2 4.18Å; M470-F485 HydrophobicContact CE-CG 4.34Å; M470-F485 HydrophobicContact CE-CZ 4Å; M470-F485 HydrophobicContact SD-CB 4.15Å; M470-F485 HydrophobicContact SD-CD1 3.92Å; M470-F485 HydrophobicContact SD-CD2 3.27Å; M470-F485 WeakPolarHBondContact SD-CD2 3.32Å; M470-F485 HydrophobicContact SD-CE1 4.12Å; M470-F485 HydrophobicContact SD-CE2 3.51Å; M470-F485 VanDerWaalsContact SD-CE2 3.51Å; M470-F485 HydrophobicContact SD-CG 3.51Å; M470-F485 VanDerWaalsContact SD-CG 3.51Å; M470-F485 HydrophobicContact SD-CZ 3.94Å
471	V	98.7	Very high	96.6	Very high	47 Å²	47	48.4 Å²	48.4	29%	0.285	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129	-178.9	-178.9	0	0	0	0	110.8	G449 F451 A463 L466 V468 V473	G449-V471 CarbonylContact O-C 3.52Å; G449-V471 VanDerWaalsContact O-CA 3.27Å; G449-V471 WeakPolarHBondContact O-CA 3.32Å; F451-V471 HydrophobicContact CD1-CG1 3.99Å; F451-V471 HydrophobicContact CE1-CG1 3.72Å; A463-V471 HydrophobicContact CB-CG1 4.4Å; L466-V471 HydrophobicContact CB-CG2 4.44Å; L466-V471 HydrophobicContact CD1-CG1 4.47Å; V468-V471 HydrophobicContact CG2-CG2 3.5Å; V468-V471 VanDerWaalsContact CG2-CG2 3.5Å; V471-V473 HydrophobicContact CG1-CG2 4.12Å
472	G	98.6	Very high	96	Very high	2 Å²	2	48.6 Å²	48.6	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.7	167.4	0	0	0	0	0	111.4	G449 Y450 F451	G449-G472 PolarHBondContact O-N 2.96Å; Y450-G472 CarbonylContact C-O 3.53Å; Y450-G472 WeakPolarHBondContact CA-O 3.26Å; F451-G472 PolarHBondContact N-O 3.15Å
473	V	98.8	Very high	95.8	Very high	53 Å²	53	51.6 Å²	51.6	32%	0.321	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.2	177.8	-175.5	0	0	0	0	108.7	F451 I459 V471 E475	F451-V473 HydrophobicContact CE1-CB 4.48Å; F451-V473 HydrophobicContact CE1-CG2 3.63Å; F451-V473 HydrophobicContact CE2-CG1 3.89Å; F451-V473 HydrophobicContact CE2-CG2 4.46Å; F451-V473 HydrophobicContact CZ-CB 4.21Å; F451-V473 HydrophobicContact CZ-CG1 3.79Å; F451-V473 HydrophobicContact CZ-CG2 3.58Å; I459-V473 HydrophobicContact CB-CG1 4.49Å; I459-V473 HydrophobicContact CD1-CG1 4.35Å; I459-V473 HydrophobicContact CG1-CG1 4.03Å; I459-V473 HydrophobicContact CG2-CG1 3.76Å; V471-V473 HydrophobicContact CG1-CG2 4.12Å; V473-E475 PolarHBondContact O-N 2.92Å; V473-E475 VanDerWaalsContact O-N 3.09Å
474	N	98.6	Very high	95.7	Very high	44 Å²	44	52.7 Å²	52.7	24%	0.235	29%	0.289	C	S	.	.	S	Bend	trans	53.9	24	-174.6	-62.3	-49.4	0	0	0	114.1	F451 Y452 S453	F451-N474 PolarHBondContact O-N 3.13Å; Y452-N474 VanDerWaalsContact CA-OD1 3.26Å; Y452-N474 WeakPolarHBondContact CA-OD1 3.43Å; Y452-N474 HydrophobicContact CD1-CB 4.13Å; Y452-N474 WeakPolarHBondContact CD1-OD1 3.47Å; Y452-N474 VanDerWaalsContact CE1-C 3.42Å; Y452-N474 VanDerWaalsContact CE1-CA 3.45Å; Y452-N474 HydrophobicContact CE1-CB 4.15Å; Y452-N474 WeakPolarHBondContact CE1-O 3.32Å; Y452-N474 PolarHBondContact OH-O 3.24Å; S453-N474 PolarHBondContact N-OD1 3.46Å; S453-N474 PolarHBondContact O-ND2 3.39Å; S453-N474 PolarHBondContact O-OD1 3.36Å; S453-N474 VanDerWaalsContact O-OD1 3.13Å
475	E	98	Very high	95.7	Very high	90 Å²	90	46.8 Å²	46.8	42%	0.421	26%	0.261	S	S	.	.			trans	-145.3	133.1	179.8	177.7	53.9	-100	0	0	109.8	Y450 Y452 V473 L477 I478	Y450-E475 WeakPolarHBondContact CD1-O 3.45Å; Y452-E475 WeakPolarHBondContact OH-CA 3.41Å; Y452-E475 PolarHBondContact OH-N 2.95Å; V473-E475 PolarHBondContact O-N 2.92Å; V473-E475 VanDerWaalsContact O-N 3.09Å; E475-L477 PolarHBondContact OE1-N 2.95Å; E475-I478 HydrophobicContact CG-CG2 4.37Å
476	G	93.6	Very high	95.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-96.7	-14.4	179.9	0	0	0	0	0	114.1	Y450 Y452	Y450-G476 WeakPolarHBondContact CE1-O 3.17Å; Y452-G476 PolarHBondContact OH-N 3.22Å
477	L	93.6	Very high	95.6	Very high	75 Å²	75	42.1 Å²	42.1	39%	0.393	24%	0.241	S	C	.	.			trans	-120.4	94.3	-179	-64.3	-178.1	0	0	0	111.5	A311 E475	A311-L477 HydrophobicContact CB-CD1 3.97Å; A311-L477 HydrophobicContact CB-CD2 4.15Å; A311-L477 HydrophobicContact CB-CG 3.82Å; E475-L477 PolarHBondContact OE1-N 2.95Å
478	I	94.8	Very high	95.5	Very high	43 Å²	43	39.7 Å²	39.7	22%	0.221	23%	0.232	C	C	.	.			trans	-102.4	9.6	-175.8	64.7	174.7	0	0	0	114.1	Y450 M470 E475 S480	Y450-I478 HydrophobicContact CE1-CD1 4.15Å; Y450-I478 HydrophobicContact CE1-CG1 4.23Å; Y450-I478 HydrophobicContact CE1-CG2 4.25Å; M470-I478 HydrophobicContact CB-CD1 3.81Å; E475-I478 HydrophobicContact CG-CG2 4.37Å; I478-S480 PolarHBondContact O-N 3.02Å
479	S	92.2	Very high	95.4	Very high	61 Å²	61	43 Å²	43	43%	0.427	25%	0.245	S	C	.	.			trans	-64.8	118.8	-178.7	-61.1	0	0	0	0	110.5	R315	R315-S479 PolarHBondContact NH1-OG 3.27Å
480	S	91.4	Very high	95.4	Very high	34 Å²	34	45.2 Å²	45.2	24%	0.238	25%	0.249	C	C	.	.			trans	-150.3	135.5	177.8	156.9	0	0	0	0	108.7	I478 E482 C483	I478-S480 PolarHBondContact O-N 3.02Å; S480-E482 WeakPolarHBondContact OG-CG 3.29Å; S480-E482 PolarHBondContact OG-OE1 2.91Å; S480-E482 PolarHBondContact OG-OE2 3.29Å; S480-C483 PolarHBondContact O-N 2.9Å; S480-C483 PolarHBondContact OG-SG 3.26Å
481	V	85.7	Confident	95.3	Very high	32 Å²	32	44.4 Å²	44.4	19%	0.194	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-25.9	-174.6	-65.8	0	0	0	0	112.8	E145 W147 G497 S498	E145-V481 HydrophobicContact CB-CG1 4.39Å; E145-V481 HydrophobicContact CG-CG1 3.59Å; E145-V481 WeakPolarHBondContact OE1-CG1 3.47Å; E145-V481 WeakPolarHBondContact OE2-CG1 3.35Å; W147-V481 HydrophobicContact CB-CB 3.66Å; W147-V481 HydrophobicContact CB-CG1 4.45Å; W147-V481 HydrophobicContact CB-CG2 3.68Å; W147-V481 HydrophobicContact CD2-CG2 4.03Å; W147-V481 HydrophobicContact CE3-CG2 3.9Å; W147-V481 HydrophobicContact CG-CB 4.05Å; W147-V481 HydrophobicContact CG-CG2 3.97Å; V481-G497 CarbonylContact O-C 3.44Å; V481-G497 WeakPolarHBondContact O-CA 3.35Å; V481-S498 PolarHBondContact O-N 2.67Å
482	E	86.9	Confident	95.2	Very high	102 Å²	102	42.6 Å²	42.6	48%	0.477	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.2	177.3	62	-81.3	178.5	0	0	113.7	W147 S480 S498	W147-E482 HydrophobicContact CD2-CB 4.44Å; W147-E482 HydrophobicContact CE3-CB 4.43Å; W147-E482 HydrophobicContact CH2-CB 3.69Å; W147-E482 HydrophobicContact CZ2-CB 3.67Å; W147-E482 HydrophobicContact CZ3-CB 4.07Å; S480-E482 WeakPolarHBondContact OG-CG 3.29Å; S480-E482 PolarHBondContact OG-OE1 2.91Å; S480-E482 PolarHBondContact OG-OE2 3.29Å; E482-S498 VanDerWaalsContact C-CA 3.5Å; E482-S498 WeakPolarHBondContact O-CA 3.29Å; E482-S498 WeakPolarHBondContact O-CB 3.35Å
483	C	94.5	Very high	95.2	Very high	62 Å²	62	46.5 Å²	46.5	42%	0.419	26%	0.256	S	S	.	.	S	Bend	trans	-99.7	145.6	177.7	-72.2	0	0	0	0	112.4	S480 F485 S498	S480-C483 PolarHBondContact O-N 2.9Å; S480-C483 PolarHBondContact OG-SG 3.26Å; C483-F485 PolarHBondContact O-N 3.28Å; C483-S498 VanDerWaalsContact C-CB 3.5Å
484	P	96.8	Very high	95.2	Very high	56 Å²	56	45.1 Å²	45.1	36%	0.364	25%	0.252	S	S	.	.			trans	-73	127.3	-179.4	27.9	-32.7	0	0	0	110.7	R495 Y500	P484-R495 HydrophobicContact CB-CB 4.19Å; P484-R495 HydrophobicContact CB-CG 4.16Å; P484-Y500 HydrophobicContact CB-CD2 4.19Å; P484-Y500 HydrophobicContact CG-CD2 4.46Å
485	F	97.8	Very high	95.2	Very high	19 Å²	19	45.9 Å²	45.9	8%	0.083	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-114.6	129.3	-179.4	-158.3	-81.4	0	0	0	110.7	E287 V322 M470 C483 R495 E496	E287-F485 WeakPolarHBondContact OE2-CD1 3.41Å; E287-F485 WeakPolarHBondContact OE2-CE1 3.38Å; V322-F485 HydrophobicContact CG1-CE1 4.17Å; V322-F485 HydrophobicContact CG1-CE2 4.17Å; V322-F485 HydrophobicContact CG1-CZ 3.42Å; V322-F485 VanDerWaalsContact CG1-CZ 3.42Å; V322-F485 HydrophobicContact CG2-CZ 4.37Å; M470-F485 HydrophobicContact CE-CD1 4.14Å; M470-F485 HydrophobicContact CE-CD2 4.35Å; M470-F485 HydrophobicContact CE-CE1 3.96Å; M470-F485 HydrophobicContact CE-CE2 4.18Å; M470-F485 HydrophobicContact CE-CG 4.34Å; M470-F485 HydrophobicContact CE-CZ 4Å; M470-F485 HydrophobicContact SD-CB 4.15Å; M470-F485 HydrophobicContact SD-CD1 3.92Å; M470-F485 HydrophobicContact SD-CD2 3.27Å; M470-F485 WeakPolarHBondContact SD-CD2 3.32Å; M470-F485 HydrophobicContact SD-CE1 4.12Å; M470-F485 HydrophobicContact SD-CE2 3.51Å; M470-F485 VanDerWaalsContact SD-CE2 3.51Å; M470-F485 HydrophobicContact SD-CG 3.51Å; M470-F485 VanDerWaalsContact SD-CG 3.51Å; M470-F485 HydrophobicContact SD-CZ 3.94Å; C483-F485 PolarHBondContact O-N 3.28Å; F485-R495 CarbonylContact O-C 3.43Å; F485-R495 WeakPolarHBondContact O-CA 3.4Å; F485-E496 PolarHBondContact N-O 3.32Å; F485-E496 PolarHBondContact O-N 3.28Å
486	G	97.2	Very high	95.1	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.021	24%	0.235	C	C	.	.			trans	151.2	166.1	177.2	0	0	0	0	0	112.3	G469 R495	G469-G486 WeakPolarHBondContact CA-O 3.4Å; G486-R495 PolarHBondContact O-NE 3.04Å
487	G	97.1	Very high	95	Very high	2 Å²	2	42.7 Å²	42.7	2%	0.021	24%	0.24	C	C	.	.			trans	-98.4	173.5	-169.9	0	0	0	0	0	115.5	G446 R495	G446-G487 CarbonylContact O-C 3.55Å; G446-G487 WeakPolarHBondContact O-CA 3.08Å; G487-R495 PolarHBondContact O-NH1 3.42Å; G487-R495 PolarHBondContact O-NH2 3.32Å
488	V	97.5	Very high	95	Very high	48 Å²	48	39.2 Å²	39.2	29%	0.291	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	178.1	164.2	-61.9	0	0	0	0	109.6	G446 E467 Q490 S491	G446-V488 WeakPolarHBondContact O-CG2 3.47Å; G446-V488 PolarHBondContact O-N 3.04Å; E467-V488 VanDerWaalsContact O-CG2 3.25Å; E467-V488 WeakPolarHBondContact O-CG2 3.45Å; V488-Q490 PolarHBondContact O-N 3.07Å; V488-S491 WeakPolarHBondContact O-CB 3.37Å; V488-S491 PolarHBondContact O-N 3.38Å
489	K	96.2	Very high	94.9	Very high	92 Å²	92	43.1 Å²	43.1	40%	0.4	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52	-129.9	-178.8	-56.4	178	178.4	176.6	0	111.7	N441 A443 D444 E467 S491	N441-K489 PolarHBondContact O-NZ 3.04Å; A443-K489 PolarHBondContact O-NZ 3.34Å; A443-K489 VanDerWaalsContact O-NZ 3.16Å; D444-K489 VanDerWaalsContact O-CB 3.26Å; D444-K489 WeakPolarHBondContact O-CB 3.42Å; E467-K489 WeakPolarHBondContact OE2-CE 3.45Å; E467-K489 IonicContact OE2-NZ 3.49Å; E467-K489 PolarHBondContact OE2-NZ 3.4Å; K489-S491 VanDerWaalsContact C-N 3.29Å; K489-S491 PolarHBondContact O-N 3.15Å
490	Q	96.9	Very high	95.1	Very high	69 Å²	69	45.9 Å²	45.9	32%	0.322	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	1	179.1	-56.3	-170.4	47.9	0	0	113.6	K271 L288 D444 V488 G492	K271-Q490 VanDerWaalsContact CE-OE1 3.32Å; L288-Q490 WeakPolarHBondContact CD1-O 3.36Å; D444-Q490 WeakPolarHBondContact O-CB 3.2Å; D444-Q490 PolarHBondContact O-N 2.89Å; D444-Q490 VanDerWaalsContact O-N 3.16Å; V488-Q490 PolarHBondContact O-N 3.07Å; Q490-G492 VanDerWaalsContact C-N 3.25Å; Q490-G492 PolarHBondContact O-N 3.26Å
491	S	97	Very high	95.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-2.2	176.3	-70.3	0	0	0	0	113.7	L288 G289 V445 G446 V488 K489	L288-S491 PolarHBondContact N-O 3.01Å; G289-S491 PolarHBondContact O-OG 3.5Å; V445-S491 WeakPolarHBondContact CA-OG 3.35Å; V445-S491 VanDerWaalsContact CB-OG 3.24Å; V445-S491 WeakPolarHBondContact CB-OG 3.2Å; G446-S491 PolarHBondContact N-OG 3.38Å; V488-S491 WeakPolarHBondContact O-CB 3.37Å; V488-S491 PolarHBondContact O-N 3.38Å; K489-S491 VanDerWaalsContact C-N 3.29Å; K489-S491 PolarHBondContact O-N 3.15Å
492	G	97.4	Very high	95.9	Very high	9 Å²	9	43.1 Å²	43.1	9%	0.093	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.5	-169.7	168	0	0	0	0	0	116.7	M286 Q490	M286-G492 CarbonylContact O-C 3.45Å; M286-G492 WeakPolarHBondContact O-CA 3.22Å; Q490-G492 VanDerWaalsContact C-N 3.25Å; Q490-G492 PolarHBondContact O-N 3.26Å
493	L	98.6	Very high	96.5	Very high	83 Å²	83	41 Å²	41	44%	0.435	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	134.4	179.5	-65.6	171.8	0	0	0	109	L274 V284 S285 M286	L274-L493 HydrophobicContact CD2-CD1 3.94Å; V284-L493 HydrophobicContact CG1-CD1 4.49Å; S285-L493 CarbonylContact C-O 3.55Å; S285-L493 VanDerWaalsContact CA-O 3.25Å; S285-L493 WeakPolarHBondContact CA-O 3.29Å; S285-L493 WeakPolarHBondContact CB-O 3.47Å; M286-L493 PolarHBondContact N-O 2.81Å; M286-L493 PolarHBondContact O-N 2.84Å
494	G	97.9	Very high	96.7	Very high	24 Å²	24	39.7 Å²	39.7	25%	0.247	20%	0.2	C	C	.	.	S	Bend	trans	78.5	-174.9	178.9	0	0	0	0	0	114.1	E504	G494-E504 WeakPolarHBondContact CA-OE1 3.25Å
495	R	98.1	Very high	96.8	Very high	61 Å²	61	37.2 Å²	37.2	23%	0.23	18%	0.184	C	C	.	.			trans	-135.1	151.5	177	-66.2	-66.5	-179.9	-88.3	5.9	111.1	P484 F485 G486 G487 G501 E504	P484-R495 HydrophobicContact CB-CB 4.19Å; P484-R495 HydrophobicContact CB-CG 4.16Å; F485-R495 CarbonylContact O-C 3.43Å; F485-R495 WeakPolarHBondContact O-CA 3.4Å; G486-R495 PolarHBondContact O-NE 3.04Å; G487-R495 PolarHBondContact O-NH1 3.42Å; G487-R495 PolarHBondContact O-NH2 3.32Å; R495-G501 WeakPolarHBondContact O-CA 3.38Å; R495-E504 WeakPolarHBondContact O-CG 3.49Å
496	E	97.2	Very high	96.8	Very high	14 Å²	14	36.7 Å²	36.7	7%	0.065	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-117.5	158.4	175.3	-51.1	-172.4	124.2	0	0	109.9	R194 K195 F485	R194-E496 WeakPolarHBondContact CD-OE2 3.47Å; R194-E496 HydrophobicContact CG-CB 4.48Å; R194-E496 IonicContact NH1-OE2 3.28Å; R194-E496 PolarHBondContact NH1-OE2 3.05Å; K195-E496 VanDerWaalsContact CE-OE1 3.25Å; K195-E496 WeakPolarHBondContact CE-OE1 3.46Å; K195-E496 WeakPolarHBondContact CG-OE1 3.49Å; K195-E496 IonicContact NZ-OE1 3.47Å; K195-E496 PolarHBondContact NZ-OE1 3.22Å; K195-E496 IonicContact NZ-OE2 3.74Å; F485-E496 PolarHBondContact N-O 3.32Å; F485-E496 PolarHBondContact O-N 3.28Å
497	G	91	Very high	96.9	Very high	9 Å²	9	40.7 Å²	40.7	9%	0.093	20%	0.2	C	C	.	.	S	Bend	trans	69	-172.9	-171.2	0	0	0	0	0	112.8	V481 G501	V481-G497 CarbonylContact O-C 3.44Å; V481-G497 WeakPolarHBondContact O-CA 3.35Å; G497-G501 VanDerWaalsContact O-CA 3.31Å; G497-G501 WeakPolarHBondContact O-CA 3.42Å; G497-G501 PolarHBondContact O-N 3.36Å
498	S	93.3	Very high	97	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.014	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	-168.6	-178.2	76.7	0	0	0	0	115.5	W147 V481 E482 C483 Y500	W147-S498 PolarHBondContact NE1-O 2.96Å; V481-S498 PolarHBondContact O-N 2.67Å; E482-S498 VanDerWaalsContact C-CA 3.5Å; E482-S498 WeakPolarHBondContact O-CA 3.29Å; E482-S498 WeakPolarHBondContact O-CB 3.35Å; C483-S498 VanDerWaalsContact C-CB 3.5Å; S498-Y500 VanDerWaalsContact C-N 3.26Å; S498-Y500 WeakPolarHBondContact OG-CD2 3.39Å; S498-Y500 PolarHBondContact OG-N 3.47Å
499	K	92.2	Very high	97	Very high	124 Å²	124	48.9 Å²	48.9	54%	0.539	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-21.7	167.3	67.7	179.4	-173	174.9	0	113.5
500	Y	97.5	Very high	97.1	Very high	119 Å²	119	51.2 Å²	51.2	47%	0.467	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-25	-175.3	-58.5	-69.2	0	0	0	113.2	P484 S498 I502 D503	P484-Y500 HydrophobicContact CB-CD2 4.19Å; P484-Y500 HydrophobicContact CG-CD2 4.46Å; S498-Y500 VanDerWaalsContact C-N 3.26Å; S498-Y500 WeakPolarHBondContact OG-CD2 3.39Å; S498-Y500 PolarHBondContact OG-N 3.47Å; Y500-I502 PolarHBondContact O-N 2.73Å; Y500-I502 VanDerWaalsContact O-N 3.16Å; Y500-D503 WeakPolarHBondContact O-CB 3.32Å; Y500-D503 PolarHBondContact O-N 2.88Å
501	G	96.4	Very high	97.2	Very high	2 Å²	2	50.2 Å²	50.2	2%	0.021	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.6	-175.9	0	0	0	0	0	114.1	R495 G497 D503	R495-G501 WeakPolarHBondContact O-CA 3.38Å; G497-G501 VanDerWaalsContact O-CA 3.31Å; G497-G501 WeakPolarHBondContact O-CA 3.42Å; G497-G501 PolarHBondContact O-N 3.36Å; G501-D503 VanDerWaalsContact C-N 3.35Å
502	I	97.3	Very high	97.2	Very high	7 Å²	7	52.9 Å²	52.9	4%	0.036	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-28.4	176.6	-159.4	165.6	0	0	0	112.5	E151 V155 A201 A202 Y500 E504 Y505 L506	E151-I502 HydrophobicContact CB-CD1 4.25Å; V155-I502 HydrophobicContact CG2-CD1 3.52Å; V155-I502 HydrophobicContact CG2-CG1 4.31Å; A201-I502 HydrophobicContact CB-CD1 3.88Å; A202-I502 HydrophobicContact CB-CG1 3.97Å; Y500-I502 PolarHBondContact O-N 2.73Å; Y500-I502 VanDerWaalsContact O-N 3.16Å; I502-E504 PolarHBondContact O-N 3Å; I502-Y505 PolarHBondContact O-N 2.83Å; I502-L506 HydrophobicContact CG1-CD1 4.26Å; I502-L506 HydrophobicContact CG2-CD1 4.31Å; I502-L506 WeakPolarHBondContact O-CG 3.5Å
503	D	98.4	Very high	97.2	Very high	58 Å²	58	59.2 Å²	59.2	31%	0.31	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-67	-23.3	-178.6	-68.6	-44.1	0	0	0	112	K173 Y500 G501 Y505 L506	K173-D503 IonicContact NZ-OD1 2.72Å; K173-D503 PolarHBondContact NZ-OD1 2.94Å; Y500-D503 WeakPolarHBondContact O-CB 3.32Å; Y500-D503 PolarHBondContact O-N 2.88Å; G501-D503 VanDerWaalsContact C-N 3.35Å; D503-Y505 PolarHBondContact O-N 2.7Å; D503-Y505 VanDerWaalsContact O-N 3.11Å; D503-L506 PolarHBondContact O-N 2.87Å
504	E	98.6	Very high	97.1	Very high	33 Å²	33	57 Å²	57	15%	0.154	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-62.3	-17.2	172.8	-70.5	-56.6	149.3	0	0	114	I176 K260 G494 R495 I502	I176-E504 VanDerWaalsContact CD1-O 3.26Å; I176-E504 WeakPolarHBondContact CD1-O 3.47Å; K260-E504 WeakPolarHBondContact CD-O 3.21Å; K260-E504 WeakPolarHBondContact CE-O 3.22Å; K260-E504 PolarHBondContact NZ-O 3.21Å; K260-E504 IonicContact NZ-OE2 2.9Å; K260-E504 PolarHBondContact NZ-OE2 3.09Å; G494-E504 WeakPolarHBondContact CA-OE1 3.25Å; R495-E504 WeakPolarHBondContact O-CG 3.49Å; I502-E504 PolarHBondContact O-N 3Å
505	Y	98.8	Very high	96.8	Very high	5 Å²	5	59.8 Å²	59.8	2%	0.02	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-115.3	9.2	-175.8	-63.2	-83.6	0	0	0	113.2	P175 I176 A179 K195 A198 A199 C204 K260 S262 I502 D503	P175-Y505 WeakPolarHBondContact CA-O 3.26Å; I176-Y505 VanDerWaalsContact CD1-C 3.45Å; I176-Y505 WeakPolarHBondContact CG1-O 3.33Å; I176-Y505 PolarHBondContact N-O 2.7Å; A179-Y505 HydrophobicContact CB-CD1 4.39Å; A179-Y505 HydrophobicContact CB-CE1 3.99Å; K195-Y505 PolarHBondContact O-OH 2.8Å; A198-Y505 HydrophobicContact CB-CD2 3.71Å; A198-Y505 HydrophobicContact CB-CE2 3.63Å; A199-Y505 HydrophobicContact CB-CD1 3.65Å; A199-Y505 HydrophobicContact CB-CE1 3.59Å; A199-Y505 HydrophobicContact CB-CG 4.17Å; C204-Y505 PolarHBondContact SG-O 3.29Å; C204-Y505 VanDerWaalsContact SG-O 3.4Å; K260-Y505 HydrophobicContact CG-CD1 4.15Å; K260-Y505 HydrophobicContact CG-CE1 4.02Å; S262-Y505 WeakPolarHBondContact CB-OH 3.46Å; S262-Y505 PolarHBondContact OG-OH 3.05Å; I502-Y505 PolarHBondContact O-N 2.83Å; D503-Y505 PolarHBondContact O-N 2.7Å; D503-Y505 VanDerWaalsContact O-N 3.11Å
506	L	98.7	Very high	96.7	Very high	8 Å²	8	63.2 Å²	63.2	4%	0.042	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	152.9	-178.2	-65.7	168.9	0	0	0	112.6	V155 K173 Q174 A202 R283 I502 D503	V155-L506 HydrophobicContact CG1-CD1 3.66Å; V155-L506 HydrophobicContact CG1-CD2 4.09Å; V155-L506 HydrophobicContact CG2-CD1 4.06Å; K173-L506 HydrophobicContact CB-CD1 4.35Å; K173-L506 HydrophobicContact CB-CD2 4.47Å; K173-L506 HydrophobicContact CD-CD1 4.05Å; Q174-L506 CarbonylContact O-C 3.57Å; Q174-L506 WeakPolarHBondContact O-CA 3.49Å; A202-L506 HydrophobicContact CB-CD2 3.88Å; A202-L506 HydrophobicContact CB-CG 4.18Å; R283-L506 PolarHBondContact NH1-O 2.88Å; I502-L506 HydrophobicContact CG1-CD1 4.26Å; I502-L506 HydrophobicContact CG2-CD1 4.31Å; I502-L506 WeakPolarHBondContact O-CG 3.5Å; D503-L506 PolarHBondContact O-N 2.87Å
507	E	98.6	Very high	96.7	Very high	85 Å²	85	65.7 Å²	65.7	40%	0.397	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.6	166	-75.3	-57.2	153.5	0	0	110.5	K173 Q174 I176 R283	K173-E507 WeakPolarHBondContact CA-O 3.3Å; Q174-E507 PolarHBondContact N-O 3.28Å; Q174-E507 PolarHBondContact O-N 2.95Å; I176-E507 HydrophobicContact CG1-CG 3.93Å; R283-E507 IonicContact CZ-OE1 3.66Å; R283-E507 VanDerWaalsContact NH1-CD 3.35Å; R283-E507 IonicContact NH1-OE1 3.98Å; R283-E507 PolarHBondContact NH1-OE1 2.85Å; R283-E507 IonicContact NH1-OE2 2.63Å
508	L	98.6	Very high	97	Very high	117 Å²	117	68.6 Å²	68.6	61%	0.613	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	136.6	171.8	-64.6	173.5	0	0	0	110	V171 L172 K173	V171-L508 HydrophobicContact CG1-CB 4.29Å; V171-L508 HydrophobicContact CG1-CD2 3.81Å; L172-L508 CarbonylContact O-C 3.46Å; L172-L508 WeakPolarHBondContact O-CA 3.49Å; K173-L508 HydrophobicContact CD-CD2 4.32Å; K173-L508 HydrophobicContact CG-CD2 3.67Å
509	K	98.6	Very high	97.2	Very high	105 Å²	105	72.3 Å²	72.3	46%	0.457	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	112.3	174.7	178.7	177	-70.4	172.3	0	110.4	V171 L172 V511	V171-K509 CarbonylContact C-O 3.57Å; V171-K509 WeakPolarHBondContact CA-O 3.37Å; L172-K509 HydrophobicContact CB-CB 4.35Å; L172-K509 PolarHBondContact N-O 3.07Å; L172-K509 PolarHBondContact O-N 3.19Å; K509-V511 HydrophobicContact CD-CG2 4.47Å; K509-V511 HydrophobicContact CG-CG2 4.21Å
510	Y	98.2	Very high	97.4	Very high	142 Å²	142	69.3 Å²	69.3	56%	0.557	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.8	168.9	169.4	-129.2	0	0	0	110.7	A169 L170 C512	A169-Y510 HydrophobicContact CB-CD2 4.43Å; A169-Y510 HydrophobicContact CB-CE2 3.62Å; L170-Y510 CarbonylContact O-C 3.59Å; L170-Y510 WeakPolarHBondContact O-CA 3.48Å; Y510-C512 HydrophobicContact CE1-CB 4.04Å; Y510-C512 HydrophobicContact CE2-CB 4.22Å; Y510-C512 VanDerWaalsContact OH-CB 3.3Å; Y510-C512 WeakPolarHBondContact OH-CB 3.48Å
511	V	98.1	Very high	97.4	Very high	48 Å²	48	66.2 Å²	66.2	29%	0.291	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	111.8	173	-177	0	0	0	0	108.5	L170 L172 K509 Y513	L170-V511 HydrophobicContact CB-CB 4.23Å; L170-V511 PolarHBondContact N-O 2.82Å; L170-V511 PolarHBondContact O-N 2.87Å; L172-V511 HydrophobicContact CD1-CG2 3.98Å; L172-V511 HydrophobicContact CG-CG2 4.23Å; K509-V511 HydrophobicContact CD-CG2 4.47Å; K509-V511 HydrophobicContact CG-CG2 4.21Å; V511-Y513 PolarHBondContact O-N 2.81Å
512	C	97.8	Very high	97.5	Very high	56 Å²	56	70.5 Å²	70.5	38%	0.378	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	98.2	169.5	-175.4	0	0	0	0	109.2	Y510 G514	Y510-C512 HydrophobicContact CE1-CB 4.04Å; Y510-C512 HydrophobicContact CE2-CB 4.22Å; Y510-C512 VanDerWaalsContact OH-CB 3.3Å; Y510-C512 WeakPolarHBondContact OH-CB 3.48Å; C512-G514 PolarHBondContact O-N 3.34Å
513	Y	97.3	Very high	97.5	Very high	141 Å²	141	75 Å²	75	55%	0.553	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	97.1	174.4	-158.7	-55.4	0	0	0	108.8	R167 R168 V511 L516	R167-Y513 CarbonylContact C-O 3.59Å; R167-Y513 WeakPolarHBondContact CA-O 2.82Å; R167-Y513 WeakPolarHBondContact CB-O 3.28Å; R168-Y513 PolarHBondContact N-O 3.1Å; R168-Y513 PolarHBondContact O-N 3.13Å; V511-Y513 PolarHBondContact O-N 2.81Å; Y513-L516 HydrophobicContact CD1-CD2 4.1Å; Y513-L516 HydrophobicContact CD1-CG 4.41Å; Y513-L516 HydrophobicContact CE1-CD2 4.1Å
514	G	96.1	Very high	97.5	Very high	37 Å²	37	76.3 Å²	76.3	38%	0.381	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-177.8	176.8	0	0	0	0	0	113.8	D166 C512	D166-G514 WeakPolarHBondContact O-CA 3.35Å; C512-G514 PolarHBondContact O-N 3.34Å
515	G	93	Very high	97.4	Very high	82 Å²	82	79.9 Å²	79.9	85%	0.845	44%	0.436	S	S	*	.			trans	78.8	30.9	179.1	0	0	0	0	0	113.5	D166	D166-G515 PolarHBondContact O-N 2.89Å
516	L	94.7	Very high	97.2	Very high	133 Å²	133	86.7 Å²	86.7	70%	0.696	47%	0.474	S	S	*	.			trans	-97.3	0	179.9	-59.6	179.1	0	0	0	113.5	D166 R168 Y513	D166-L516 PolarHBondContact O-N 2.91Å; R168-L516 HydrophobicContact CB-CD1 4.44Å; R168-L516 HydrophobicContact CG-CD1 3.6Å; Y513-L516 HydrophobicContact CD1-CD2 4.1Å; Y513-L516 HydrophobicContact CD1-CG 4.41Å; Y513-L516 HydrophobicContact CE1-CD2 4.1Å

Retrieved 516 of 516 residues in 174.2 ms (Link to these results)

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