G4VQ87_SCHMA Loading...

Mitochondrial import inner membrane translocase subunit TIM50

Essential component of the TIM23 complex, a complex that mediates the translocation of transit peptide-containing proteins across the mitochondrial inner membrane.

AlphaFold DB , UniProt , Accession G4VQ87, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 336 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	43.2	Very low	41.1	Very low	240 Å²	240	159.6 Å²	159.6	100%	1.182	84%	0.839	S	S	*	*				0	114.7	0	-84.1	174.7	169.1	0	0	107.8
2	L	42.3	Very low	41.5	Very low	172 Å²	172	155 Å²	155	90%	0.901	82%	0.816	S	S	*	*			trans	57.6	82	170.7	-59.1	162.9	0	0	0	115.9
3	L	38.5	Very low	41.8	Very low	159 Å²	159	163.5 Å²	163.5	83%	0.832	83%	0.83	S	S	*	*				54.9	93	54	-88.6	165	0	0	0	116.2
4	S	38.6	Very low	42.4	Very low	99 Å²	99	159.3 Å²	159.3	69%	0.692	82%	0.821	S	S	*	*				48.4	123.6	129.3	66.6	0	0	0	0	120.9
5	A	44.2	Very low	43.3	Very low	102 Å²	102	154.4 Å²	154.4	84%	0.843	80%	0.797	S	S	*	*			trans	-168.1	76.4	133.2	0	0	0	0	0	112.3
6	T	41.6	Very low	43.7	Very low	137 Å²	137	158.9 Å²	158.9	84%	0.84	80%	0.801	S	S	*	*			trans	-72.2	115.3	144.9	28.7	0	0	0	0	107.9
7	R	42.7	Very low	43.9	Very low	207 Å²	207	162 Å²	162	78%	0.781	80%	0.801	S	S	*	*			trans	-176.3	125.7	151.2	-107	170.6	-178.5	-156.5	3.1	112.6
8	R	36.5	Very low	44.6	Very low	186 Å²	186	157.1 Å²	157.1	70%	0.702	78%	0.781	S	S	*	*			trans	69.1	89.9	145.2	-63	173.6	-155.5	-154.2	0.6	117.8
9	F	39	Very low	45	Very low	219 Å²	219	157.7 Å²	157.7	96%	0.961	78%	0.775	S	S	*	*			trans	-111.7	82.7	140.6	-111.8	-91.8	0	0	0	108.3
10	A	40.8	Very low	45.3	Very low	88 Å²	88	158.1 Å²	158.1	73%	0.727	77%	0.773	S	S	*	*			trans	-139.3	73.2	167.6	0	0	0	0	0	106.4
11	L	44.4	Very low	45.6	Very low	147 Å²	147	158.6 Å²	158.6	77%	0.77	77%	0.771	S	S	*	*			trans	-140.6	120	170.9	-83.8	170.2	0	0	0	109.5
12	N	45.9	Very low	46.2	Very low	104 Å²	104	153.8 Å²	153.8	56%	0.556	75%	0.745	S	S	*	*			trans	69	85.8	142.7	-60.5	-2.2	0	0	0	119	C14 D15	N12-C14 PolarHBondContact O-N 2.81Å; N12-D15 WeakPolarHBondContact CB-OD2 3.09Å; N12-D15 PolarHBondContact ND2-OD2 3.38Å
13	R	45.2	Very low	46.7	Very low	265 Å²	265	154 Å²	154	100%	1	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	10	150.7	-92.5	-173.8	-164.7	-179.3	5.7	114
14	C	51.2	Low	47.4	Very low	105 Å²	105	150.3 Å²	150.3	71%	0.709	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-7.9	-175.8	-107.4	0	0	0	0	115.8	N12	N12-C14 PolarHBondContact O-N 2.81Å
15	D	54.8	Low	48	Very low	86 Å²	86	148.7 Å²	148.7	46%	0.46	72%	0.715	S	S	.	*	S	Bend	trans	-100.9	7.8	-168	-71.7	-42.9	0	0	0	116.4	N12 T18	N12-D15 WeakPolarHBondContact CB-OD2 3.09Å; N12-D15 PolarHBondContact ND2-OD2 3.38Å; D15-T18 PolarHBondContact O-OG1 3.13Å
16	R	50.1	Low	48.5	Very low	227 Å²	227	153 Å²	153	86%	0.857	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-18.8	178.3	-159.1	172.9	-79.7	-166.4	-3.8	113.7
17	W	47.4	Very low	49	Very low	211 Å²	211	156.7 Å²	156.7	80%	0.799	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-20.9	178.4	-82.3	93.1	0	0	0	114	K21	W17-K21 PolarHBondContact O-N 2.93Å
18	T	57.2	Low	49.4	Very low	73 Å²	73	151 Å²	151	45%	0.448	70%	0.703	S	S	.	*	H	α-helix	trans	-72.4	-36.3	177.9	39.8	0	0	0	0	111.9	D15 F20 K21 Q22	D15-T18 PolarHBondContact O-OG1 3.13Å; T18-F20 VanDerWaalsContact C-N 3.33Å; T18-F20 PolarHBondContact O-N 3.13Å; T18-K21 PolarHBondContact O-N 3.5Å; T18-Q22 PolarHBondContact O-N 3.29Å
19	Y	52.2	Low	50	Low	169 Å²	169	149.5 Å²	149.5	66%	0.663	71%	0.708	S	S	*	*	H	α-helix	trans	-64.9	-33	175.5	-110.6	-89.3	0	0	0	113.7	Y23	Y19-Y23 PolarHBondContact O-N 3.37Å
20	F	50.4	Low	50.2	Low	166 Å²	166	142.5 Å²	142.5	73%	0.728	70%	0.697	S	S	*	*	H	α-helix	trans	-74.3	-32	178.7	-132.3	-90	0	0	0	112.4	T18 S24	T18-F20 VanDerWaalsContact C-N 3.33Å; T18-F20 PolarHBondContact O-N 3.13Å; F20-S24 PolarHBondContact O-N 3.43Å
21	K	51.5	Low	50.5	Low	168 Å²	168	143.2 Å²	143.2	73%	0.73	70%	0.697	S	S	*	*	H	α-helix	trans	-69.9	-34.1	174.2	-82.6	-168.8	172.7	-175	0	112.7	W17 T18 A25	W17-K21 PolarHBondContact O-N 2.93Å; T18-K21 PolarHBondContact O-N 3.5Å; K21-A25 PolarHBondContact O-N 2.93Å
22	Q	55.3	Low	50.4	Low	140 Å²	140	144.4 Å²	144.4	65%	0.654	70%	0.704	S	S	*	*	H	α-helix	trans	-75.4	-30.8	-179	-151.1	163.3	-4.3	0	0	112.4	T18	T18-Q22 PolarHBondContact O-N 3.29Å
23	Y	52.5	Low	50.6	Low	177 Å²	177	146.1 Å²	146.1	69%	0.694	71%	0.713	S	S	*	*	H	α-helix	trans	-73.8	-33.3	173.7	-112.2	-92.1	0	0	0	113.6	Y19 A25 Y26	Y19-Y23 PolarHBondContact O-N 3.37Å; Y23-A25 VanDerWaalsContact C-N 3.33Å; Y23-Y26 PolarHBondContact O-N 3.38Å
24	S	54	Low	50.5	Low	80 Å²	80	136.4 Å²	136.4	56%	0.559	69%	0.685	S	S	*	*	H	α-helix	trans	-69.8	-29.4	175.2	-177.7	0	0	0	0	113	F20 Y26 S28	F20-S24 PolarHBondContact O-N 3.43Å; S24-Y26 VanDerWaalsContact C-N 3.35Å; S24-S28 PolarHBondContact O-OG 3.12Å; S24-S28 VanDerWaalsContact O-OG 3.1Å
25	A	51.8	Low	50.5	Low	65 Å²	65	136.6 Å²	136.6	54%	0.537	69%	0.688	S	S	.	*	H	α-helix	trans	-73.1	-27.5	179.1	0	0	0	0	0	112.7	K21 Y23 Y27	K21-A25 PolarHBondContact O-N 2.93Å; Y23-A25 VanDerWaalsContact C-N 3.33Å; A25-Y27 PolarHBondContact O-N 3.38Å
26	Y	54.7	Low	50.5	Low	194 Å²	194	139.5 Å²	139.5	76%	0.761	70%	0.699	S	S	*	*	H	α-helix	trans	-76.4	-20.2	-176.2	-130.4	-90.7	0	0	0	114	Y23 S24	Y23-Y26 PolarHBondContact O-N 3.38Å; S24-Y26 VanDerWaalsContact C-N 3.35Å
27	Y	51.7	Low	50.7	Low	214 Å²	214	133.1 Å²	133.1	84%	0.839	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	6.2	178.6	-104.5	-87.1	0	0	0	114.6	A25	A25-Y27 PolarHBondContact O-N 3.38Å
28	S	50.4	Low	51	Low	88 Å²	88	130.3 Å²	130.3	62%	0.615	68%	0.675	S	S	*	*			trans	-98.9	12.7	-175.4	-57.2	0	0	0	0	114.3	S24 G30	S24-S28 PolarHBondContact O-OG 3.12Å; S24-S28 VanDerWaalsContact O-OG 3.1Å; S28-G30 PolarHBondContact O-N 2.81Å
29	I	48.8	Very low	50.8	Low	154 Å²	154	130.2 Å²	130.2	79%	0.79	68%	0.678	S	S	*	*			trans	-94	91.7	-179.9	-58.4	172.8	0	0	0	108.4
30	G	44.4	Very low	50.8	Low	71 Å²	71	128.7 Å²	128.7	73%	0.732	67%	0.674	S	S	*	*	S	Bend	trans	158.2	49.9	176.3	0	0	0	0	0	114.9	S28	S28-G30 PolarHBondContact O-N 2.81Å
31	S	46.9	Very low	51	Low	104 Å²	104	128 Å²	128	73%	0.727	67%	0.674	S	S	*	*			trans	-170.5	99.9	159.2	26.4	0	0	0	0	108.4	D33	S31-D33 PolarHBondContact O-N 3.43Å; S31-D33 VanDerWaalsContact O-N 3.17Å
32	N	43	Very low	51.1	Low	171 Å²	171	123.5 Å²	123.5	91%	0.914	66%	0.663	S	S	*	*			trans	-72.9	95.1	161.6	-96.7	-9.2	0	0	0	106.9
33	D	49	Very low	50.5	Low	140 Å²	140	124.2 Å²	124.2	75%	0.749	66%	0.66	S	S	*	*			trans	-149.5	128.7	157	-104.6	-25.9	0	0	0	110.2	S31	S31-D33 PolarHBondContact O-N 3.43Å; S31-D33 VanDerWaalsContact O-N 3.17Å
34	S	43.6	Very low	50.5	Low	61 Å²	61	123.9 Å²	123.9	43%	0.427	66%	0.658	S	S	.	*			trans	33.2	100.8	166.6	54.3	0	0	0	0	120	E36 D37	S34-E36 PolarHBondContact O-N 3.34Å; S34-D37 WeakPolarHBondContact CB-OD2 3.4Å; S34-D37 PolarHBondContact O-N 3.49Å; S34-D37 PolarHBondContact OG-OD2 3.15Å
35	S	51.8	Low	50.8	Low	110 Å²	110	123.4 Å²	123.4	77%	0.769	65%	0.654	S	S	*	*	H	α-helix	trans	-63.8	-13.9	168	44.6	0	0	0	0	115.1
36	E	54.4	Low	51.4	Low	146 Å²	146	128.3 Å²	128.3	68%	0.682	67%	0.666	S	S	*	*	H	α-helix	trans	-75.5	-30.7	176.2	-80.4	-171.7	145.2	0	0	113.3	S34 K38 S39	S34-E36 PolarHBondContact O-N 3.34Å; E36-K38 PolarHBondContact O-N 2.9Å; E36-S39 PolarHBondContact O-N 2.95Å; E36-S39 PolarHBondContact O-OG 2.96Å
37	D	54.3	Low	52	Low	93 Å²	93	126.1 Å²	126.1	50%	0.497	66%	0.661	S	S	.	*	H	α-helix	trans	-73.2	-30.6	-175.7	-71.3	-39.7	0	0	0	112.7	S34 S39 K40 Q41	S34-D37 WeakPolarHBondContact CB-OD2 3.4Å; S34-D37 PolarHBondContact O-N 3.49Å; S34-D37 PolarHBondContact OG-OD2 3.15Å; D37-S39 VanDerWaalsContact C-N 3.3Å; D37-S39 PolarHBondContact O-N 3.08Å; D37-K40 PolarHBondContact O-N 3.45Å; D37-Q41 PolarHBondContact O-N 3.09Å
38	K	52.3	Low	53.2	Low	152 Å²	152	117.5 Å²	117.5	66%	0.661	63%	0.629	S	S	*	*	H	α-helix	trans	-65.9	-29.7	178.8	-69.7	-177.1	-179.9	174.3	0	113.3	E36	E36-K38 PolarHBondContact O-N 2.9Å
39	S	53.5	Low	54.7	Low	72 Å²	72	115.9 Å²	115.9	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-76.3	-36.5	-179.5	72.4	0	0	0	0	112.9	E36 D37 Q41 S42	E36-S39 PolarHBondContact O-N 2.95Å; E36-S39 PolarHBondContact O-OG 2.96Å; D37-S39 VanDerWaalsContact C-N 3.3Å; D37-S39 PolarHBondContact O-N 3.08Å; S39-Q41 VanDerWaalsContact C-N 3.34Å; S39-S42 PolarHBondContact O-OG 2.89Å
40	K	52	Low	56.3	Low	136 Å²	136	118.5 Å²	118.5	59%	0.591	62%	0.621	S	S	*	*	H	α-helix	trans	-70.9	-33.4	177.7	-68.9	177.5	-177.5	167.3	0	111.5	D37	D37-K40 PolarHBondContact O-N 3.45Å
41	Q	54.7	Low	58.4	Low	152 Å²	152	121.6 Å²	121.6	71%	0.71	61%	0.614	S	S	*	*	H	α-helix	trans	-70.3	-34.2	-179.6	-156.7	173.6	10.6	0	0	113	D37 S39	D37-Q41 PolarHBondContact O-N 3.09Å; S39-Q41 VanDerWaalsContact C-N 3.34Å
42	S	53.6	Low	60.3	Low	74 Å²	74	121 Å²	121	52%	0.517	60%	0.601	S	S	.	*	H	α-helix	trans	-75.3	-34.8	177.9	74.3	0	0	0	0	113	S39 W44 S45	S39-S42 PolarHBondContact O-OG 2.89Å; S42-W44 VanDerWaalsContact C-N 3.34Å; S42-W44 PolarHBondContact O-N 3.02Å; S42-S45 WeakPolarHBondContact O-CB 3.25Å; S42-S45 PolarHBondContact O-N 3.34Å; S42-S45 VanDerWaalsContact O-N 3.15Å
43	W	43.3	Very low	62.3	Low	155 Å²	155	114.2 Å²	114.2	59%	0.587	57%	0.572	S	S	*	*	H	α-helix	trans	-65.5	-33.4	179.7	-175.5	83.9	0	0	0	113.4	S45	W43-S45 VanDerWaalsContact C-N 3.35Å
44	W	53.4	Low	64.3	Low	170 Å²	170	110 Å²	110	64%	0.644	55%	0.553	S	S	*	*	H	α-helix	trans	-72	-27.5	174.3	-92.2	83.2	0	0	0	113.4	S42 N48	S42-W44 VanDerWaalsContact C-N 3.34Å; S42-W44 PolarHBondContact O-N 3.02Å; W44-N48 WeakPolarHBondContact O-CB 3.44Å; W44-N48 PolarHBondContact O-ND2 2.93Å
45	S	59.8	Low	66.5	Low	69 Å²	69	113.8 Å²	113.8	48%	0.483	56%	0.562	S	S	.	*	H	α-helix	trans	-74.2	-45.4	-173.6	-176.3	0	0	0	0	112.4	S42 W43 A49	S42-S45 WeakPolarHBondContact O-CB 3.25Å; S42-S45 PolarHBondContact O-N 3.34Å; S42-S45 VanDerWaalsContact O-N 3.15Å; W43-S45 VanDerWaalsContact C-N 3.35Å; S45-A49 WeakPolarHBondContact O-CA 3.38Å; S45-A49 VanDerWaalsContact O-CB 3.3Å; S45-A49 WeakPolarHBondContact O-CB 3.38Å; S45-A49 PolarHBondContact O-N 3.42Å
46	E	64.3	Low	68.4	Low	169 Å²	169	112.1 Å²	112.1	79%	0.79	55%	0.548	S	S	*	.	H	α-helix	trans	-75.3	-39	-172.8	-73.4	-177.2	166.8	0	0	114
47	K	66.6	Low	70.2	Confident	148 Å²	148	111.4 Å²	111.4	64%	0.643	55%	0.548	S	S	*	.	H	α-helix	trans	-77.8	-22.1	179.8	-69.4	-174.8	-179.8	-179.1	0	113.5
48	N	77.5	Confident	72	Confident	33 Å²	33	109.5 Å²	109.5	18%	0.176	55%	0.545	C	S	.	.	H	α-helix	trans	-108	-0.6	-179.3	-59.1	-49.7	0	0	0	113.4	W44 W50 K51 I52	W44-N48 WeakPolarHBondContact O-CB 3.44Å; W44-N48 PolarHBondContact O-ND2 2.93Å; N48-W50 VanDerWaalsContact C-N 3.33Å; N48-W50 PolarHBondContact O-N 3.23Å; N48-K51 CarbonylContact O-C 3.58Å; N48-K51 WeakPolarHBondContact O-CA 3.46Å; N48-K51 WeakPolarHBondContact O-CB 3.38Å; N48-K51 PolarHBondContact O-N 2.94Å; N48-K51 PolarHBondContact OD1-NZ 2.85Å; N48-I52 HydrophobicContact CB-CD1 4.25Å; N48-I52 HydrophobicContact CB-CG1 4.47Å; N48-I52 VanDerWaalsContact O-CG1 3.32Å; N48-I52 WeakPolarHBondContact O-CG1 3.19Å; N48-I52 PolarHBondContact O-N 3.3Å
49	A	81.3	Confident	74	Confident	53 Å²	53	104.9 Å²	104.9	44%	0.438	53%	0.531	S	S	.	.	H	α-helix	trans	-52.9	-46.4	-179.5	0	0	0	0	0	113.1	S45 K51 I52 G53	S45-A49 WeakPolarHBondContact O-CA 3.38Å; S45-A49 VanDerWaalsContact O-CB 3.3Å; S45-A49 WeakPolarHBondContact O-CB 3.38Å; S45-A49 PolarHBondContact O-N 3.42Å; A49-K51 PolarHBondContact O-N 2.75Å; A49-I52 PolarHBondContact O-N 3.48Å; A49-G53 PolarHBondContact O-N 3.42Å
50	W	83.5	Confident	76	Confident	210 Å²	210	105.1 Å²	105.1	80%	0.795	53%	0.533	S	S	*	.	H	α-helix	trans	-62.1	-41.3	174.9	163.4	-92.1	0	0	0	112.1	N48 G53 C54	N48-W50 VanDerWaalsContact C-N 3.33Å; N48-W50 PolarHBondContact O-N 3.23Å; W50-G53 CarbonylContact O-C 3.54Å; W50-G53 PolarHBondContact O-N 3.39Å; W50-C54 VanDerWaalsContact CZ2-SG 3.54Å; W50-C54 PolarHBondContact O-N 3.04Å; W50-C54 PolarHBondContact O-SG 2.88Å
51	K	87.3	Confident	77.9	Confident	136 Å²	136	100.4 Å²	100.4	59%	0.591	52%	0.523	S	S	*	.	H	α-helix	trans	-65.8	-41.7	178	-62.8	179.6	-175.6	168	0	111.5	N48 A49 G53 C54 F55	N48-K51 CarbonylContact O-C 3.58Å; N48-K51 WeakPolarHBondContact O-CA 3.46Å; N48-K51 WeakPolarHBondContact O-CB 3.38Å; N48-K51 PolarHBondContact O-N 2.94Å; N48-K51 PolarHBondContact OD1-NZ 2.85Å; A49-K51 PolarHBondContact O-N 2.75Å; K51-G53 VanDerWaalsContact C-N 3.33Å; K51-C54 PolarHBondContact O-N 3.11Å; K51-F55 VanDerWaalsContact O-CB 3.3Å; K51-F55 WeakPolarHBondContact O-CB 3.39Å; K51-F55 PolarHBondContact O-N 2.95Å
52	I	86.9	Confident	79.7	Confident	90 Å²	90	99.3 Å²	99.3	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-62.7	-44.1	174.1	-63.7	163.6	0	0	0	109	N48 A49 F55 T56	N48-I52 HydrophobicContact CB-CD1 4.25Å; N48-I52 HydrophobicContact CB-CG1 4.47Å; N48-I52 VanDerWaalsContact O-CG1 3.32Å; N48-I52 WeakPolarHBondContact O-CG1 3.19Å; N48-I52 PolarHBondContact O-N 3.3Å; A49-I52 PolarHBondContact O-N 3.48Å; I52-F55 PolarHBondContact O-N 2.66Å; I52-T56 HydrophobicContact CG2-CG2 4.28Å; I52-T56 VanDerWaalsContact O-CG2 3.3Å; I52-T56 WeakPolarHBondContact O-CG2 3.35Å; I52-T56 PolarHBondContact O-N 3.21Å; I52-T56 PolarHBondContact O-OG1 3.48Å
53	G	86	Confident	81.7	Confident	29 Å²	29	103.2 Å²	103.2	30%	0.299	53%	0.529	S	S	.	.	H	α-helix	trans	-60.6	-42.8	174.8	0	0	0	0	0	113.6	A49 W50 K51 T56 L57	A49-G53 PolarHBondContact O-N 3.42Å; W50-G53 CarbonylContact O-C 3.54Å; W50-G53 PolarHBondContact O-N 3.39Å; K51-G53 VanDerWaalsContact C-N 3.33Å; G53-T56 WeakPolarHBondContact CA-OG1 3.37Å; G53-T56 PolarHBondContact O-OG1 3.37Å; G53-L57 WeakPolarHBondContact O-CB 3.49Å; G53-L57 WeakPolarHBondContact O-CG 3.39Å; G53-L57 PolarHBondContact O-N 3.16Å
54	C	89.6	Confident	84	Confident	51 Å²	51	98.4 Å²	98.4	35%	0.345	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-41.7	173.3	-69.6	0	0	0	0	111.7	W50 K51 L57 A58	W50-C54 VanDerWaalsContact CZ2-SG 3.54Å; W50-C54 PolarHBondContact O-N 3.04Å; W50-C54 PolarHBondContact O-SG 2.88Å; K51-C54 PolarHBondContact O-N 3.11Å; C54-L57 PolarHBondContact O-N 3.33Å; C54-A58 WeakPolarHBondContact O-CB 3.37Å; C54-A58 PolarHBondContact O-N 2.92Å
55	F	91.2	Very high	85.7	Confident	141 Å²	141	94.6 Å²	94.6	62%	0.618	52%	0.517	S	S	*	.	H	α-helix	trans	-65.3	-43.2	178.5	-176.6	-99	0	0	0	111.6	K51 I52 A58 C59	K51-F55 VanDerWaalsContact O-CB 3.3Å; K51-F55 WeakPolarHBondContact O-CB 3.39Å; K51-F55 PolarHBondContact O-N 2.95Å; I52-F55 PolarHBondContact O-N 2.66Å; F55-A58 PolarHBondContact O-N 3.02Å; F55-C59 VanDerWaalsContact CE1-SG 3.54Å; F55-C59 VanDerWaalsContact CZ-SG 3.55Å; F55-C59 WeakPolarHBondContact O-CB 3.25Å; F55-C59 PolarHBondContact O-N 3.38Å; F55-C59 PolarHBondContact O-SG 2.95Å; F55-C59 VanDerWaalsContact O-SG 3.35Å
56	T	90.3	Very high	87.2	Confident	76 Å²	76	93.3 Å²	93.3	47%	0.466	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-40.9	176.9	55.2	0	0	0	0	111.8	I52 G53 C59 S60	I52-T56 HydrophobicContact CG2-CG2 4.28Å; I52-T56 VanDerWaalsContact O-CG2 3.3Å; I52-T56 WeakPolarHBondContact O-CG2 3.35Å; I52-T56 PolarHBondContact O-N 3.21Å; I52-T56 PolarHBondContact O-OG1 3.48Å; G53-T56 WeakPolarHBondContact CA-OG1 3.37Å; G53-T56 PolarHBondContact O-OG1 3.37Å; T56-C59 PolarHBondContact O-N 2.76Å; T56-S60 VanDerWaalsContact O-CB 3.28Å; T56-S60 WeakPolarHBondContact O-CB 3.43Å; T56-S60 PolarHBondContact O-N 2.94Å
57	L	92.9	Very high	88.6	Confident	130 Å²	130	91.2 Å²	91.2	68%	0.681	50%	0.504	S	S	*	.	H	α-helix	trans	-63.3	-41.6	173	-73.5	175.2	0	0	0	112.1	G53 C54 S60 G61	G53-L57 WeakPolarHBondContact O-CB 3.49Å; G53-L57 WeakPolarHBondContact O-CG 3.39Å; G53-L57 PolarHBondContact O-N 3.16Å; C54-L57 PolarHBondContact O-N 3.33Å; L57-S60 PolarHBondContact O-N 3.48Å; L57-G61 PolarHBondContact O-N 3.48Å
58	A	92.9	Very high	89.7	Confident	54 Å²	54	85.4 Å²	85.4	45%	0.446	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-45.6	177	0	0	0	0	0	111.9	C54 F55 S60 G61 L62	C54-A58 WeakPolarHBondContact O-CB 3.37Å; C54-A58 PolarHBondContact O-N 2.92Å; F55-A58 PolarHBondContact O-N 3.02Å; A58-S60 PolarHBondContact O-N 3.19Å; A58-G61 PolarHBondContact O-N 2.9Å; A58-L62 WeakPolarHBondContact O-CG 3.07Å; A58-L62 PolarHBondContact O-N 2.91Å
59	C	94.5	Very high	90.3	Very high	55 Å²	55	85.2 Å²	85.2	37%	0.372	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-41.1	175.2	-71.4	0	0	0	0	112	F55 T56 L62 F63	F55-C59 VanDerWaalsContact CE1-SG 3.54Å; F55-C59 VanDerWaalsContact CZ-SG 3.55Å; F55-C59 WeakPolarHBondContact O-CB 3.25Å; F55-C59 PolarHBondContact O-N 3.38Å; F55-C59 PolarHBondContact O-SG 2.95Å; F55-C59 VanDerWaalsContact O-SG 3.35Å; T56-C59 PolarHBondContact O-N 2.76Å; C59-L62 PolarHBondContact O-N 3.29Å; C59-F63 VanDerWaalsContact O-CB 3.31Å; C59-F63 WeakPolarHBondContact O-CB 2.94Å; C59-F63 PolarHBondContact O-N 3.08Å
60	S	94	Very high	90.7	Very high	77 Å²	77	85.9 Å²	85.9	54%	0.538	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-41.3	175.3	179.3	0	0	0	0	111.9	T56 L57 A58 F63 A64	T56-S60 VanDerWaalsContact O-CB 3.28Å; T56-S60 WeakPolarHBondContact O-CB 3.43Å; T56-S60 PolarHBondContact O-N 2.94Å; L57-S60 PolarHBondContact O-N 3.48Å; A58-S60 PolarHBondContact O-N 3.19Å; S60-F63 PolarHBondContact O-N 2.74Å; S60-A64 WeakPolarHBondContact O-CB 3.41Å; S60-A64 PolarHBondContact O-N 3.35Å
61	G	92.6	Very high	91	Very high	36 Å²	36	79.2 Å²	79.2	37%	0.371	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-45.5	174.8	0	0	0	0	0	112.9	L57 A58 F63 A64 V65	L57-G61 PolarHBondContact O-N 3.48Å; A58-G61 PolarHBondContact O-N 2.9Å; G61-F63 VanDerWaalsContact C-N 3.32Å; G61-F63 PolarHBondContact O-N 2.94Å; G61-A64 PolarHBondContact O-N 3.3Å; G61-V65 WeakPolarHBondContact O-CG2 3.34Å; G61-V65 PolarHBondContact O-N 3.2Å
62	L	92.8	Very high	91	Very high	130 Å²	130	77.4 Å²	77.4	68%	0.681	46%	0.461	S	S	*	.	H	α-helix	trans	-62.6	-39.8	175.1	-74	172.6	0	0	0	111.9	A58 C59 V65 G66	A58-L62 WeakPolarHBondContact O-CG 3.07Å; A58-L62 PolarHBondContact O-N 2.91Å; C59-L62 PolarHBondContact O-N 3.29Å; L62-V65 PolarHBondContact O-N 3.42Å; L62-G66 PolarHBondContact O-N 2.94Å
63	F	94.2	Very high	90.9	Very high	156 Å²	156	73.1 Å²	73.1	68%	0.684	44%	0.439	S	S	*	.	H	α-helix	trans	-63.7	-43.9	174.8	-175	-95.2	0	0	0	111.5	C59 S60 G61 G66 F67	C59-F63 VanDerWaalsContact O-CB 3.31Å; C59-F63 WeakPolarHBondContact O-CB 2.94Å; C59-F63 PolarHBondContact O-N 3.08Å; S60-F63 PolarHBondContact O-N 2.74Å; G61-F63 VanDerWaalsContact C-N 3.32Å; G61-F63 PolarHBondContact O-N 2.94Å; F63-G66 PolarHBondContact O-N 3.41Å; F63-F67 VanDerWaalsContact O-CB 3.23Å; F63-F67 WeakPolarHBondContact O-CB 3.27Å; F63-F67 PolarHBondContact O-N 2.99Å
64	A	92.1	Very high	90.9	Very high	54 Å²	54	74.6 Å²	74.6	45%	0.446	44%	0.443	S	S	.	.	H	α-helix	trans	-63.9	-42.3	177.4	0	0	0	0	0	112.5	S60 G61 F67 A68	S60-A64 WeakPolarHBondContact O-CB 3.41Å; S60-A64 PolarHBondContact O-N 3.35Å; G61-A64 PolarHBondContact O-N 3.3Å; A64-F67 PolarHBondContact O-N 2.82Å; A64-A68 WeakPolarHBondContact O-CB 3.37Å; A64-A68 PolarHBondContact O-N 2.98Å
65	V	90.3	Very high	90.7	Very high	89 Å²	89	72.9 Å²	72.9	54%	0.539	43%	0.431	S	S	.	.	H	α-helix	trans	-65.2	-46.8	174.8	173.3	0	0	0	0	110.7	G61 L62 F67 A68 V69	G61-V65 WeakPolarHBondContact O-CG2 3.34Å; G61-V65 PolarHBondContact O-N 3.2Å; L62-V65 PolarHBondContact O-N 3.42Å; V65-F67 VanDerWaalsContact C-N 3.3Å; V65-F67 PolarHBondContact O-N 3.01Å; V65-A68 PolarHBondContact O-N 3.38Å; V65-V69 HydrophobicContact CG1-CG2 4.38Å; V65-V69 VanDerWaalsContact O-CG2 3.31Å; V65-V69 WeakPolarHBondContact O-CG2 3.42Å; V65-V69 PolarHBondContact O-N 2.77Å
66	G	91.3	Very high	90.4	Very high	42 Å²	42	72.5 Å²	72.5	43%	0.433	43%	0.429	S	S	.	.	H	α-helix	trans	-59.7	-41	176.8	0	0	0	0	0	112.4	L62 F63 V69 A70	L62-G66 PolarHBondContact O-N 2.94Å; F63-G66 PolarHBondContact O-N 3.41Å; G66-V69 PolarHBondContact O-N 3.36Å; G66-A70 WeakPolarHBondContact O-CB 3.49Å; G66-A70 PolarHBondContact O-N 2.99Å
67	F	92	Very high	90.1	Very high	126 Å²	126	75 Å²	75	55%	0.553	43%	0.434	S	S	*	.	H	α-helix	trans	-63.3	-46.8	174.5	-175.2	-98.2	0	0	0	111.8	F63 A64 V65 V69 A70 T71	F63-F67 VanDerWaalsContact O-CB 3.23Å; F63-F67 WeakPolarHBondContact O-CB 3.27Å; F63-F67 PolarHBondContact O-N 2.99Å; A64-F67 PolarHBondContact O-N 2.82Å; V65-F67 VanDerWaalsContact C-N 3.3Å; V65-F67 PolarHBondContact O-N 3.01Å; F67-V69 VanDerWaalsContact C-N 3.32Å; F67-V69 PolarHBondContact O-N 2.94Å; F67-A70 PolarHBondContact O-N 3.18Å; F67-T71 HydrophobicContact CD1-CG2 4.31Å; F67-T71 HydrophobicContact CD2-CG2 4.49Å; F67-T71 HydrophobicContact CE1-CG2 3.95Å; F67-T71 HydrophobicContact CE2-CG2 4.14Å; F67-T71 HydrophobicContact CZ-CG2 3.85Å; F67-T71 WeakPolarHBondContact O-CG2 3.42Å; F67-T71 PolarHBondContact O-N 2.88Å; F67-T71 PolarHBondContact O-OG1 2.83Å
68	A	90.2	Very high	89.7	Confident	25 Å²	25	71.7 Å²	71.7	21%	0.207	42%	0.417	C	S	.	.	H	α-helix	trans	-61.6	-38.6	176.4	0	0	0	0	0	112.4	A64 V65 T71 W72 T101	A64-A68 WeakPolarHBondContact O-CB 3.37Å; A64-A68 PolarHBondContact O-N 2.98Å; V65-A68 PolarHBondContact O-N 3.38Å; A68-T71 PolarHBondContact O-OG1 3.19Å; A68-W72 WeakPolarHBondContact O-CB 3.29Å; A68-W72 PolarHBondContact O-N 3.24Å; A68-T101 HydrophobicContact CB-CG2 4.05Å
69	V	91	Very high	89.3	Confident	29 Å²	29	77.5 Å²	77.5	18%	0.176	44%	0.44	C	S	.	.	H	α-helix	trans	-67.8	-39.4	176.1	176.1	0	0	0	0	111.7	V65 G66 F67 G73 Y97 L98 T101	V65-V69 HydrophobicContact CG1-CG2 4.38Å; V65-V69 VanDerWaalsContact O-CG2 3.31Å; V65-V69 WeakPolarHBondContact O-CG2 3.42Å; V65-V69 PolarHBondContact O-N 2.77Å; G66-V69 PolarHBondContact O-N 3.36Å; F67-V69 VanDerWaalsContact C-N 3.32Å; F67-V69 PolarHBondContact O-N 2.94Å; V69-G73 WeakPolarHBondContact O-CA 3.5Å; V69-G73 PolarHBondContact O-N 3.33Å; V69-Y97 HydrophobicContact CG1-CD1 4.34Å; V69-L98 HydrophobicContact CG2-CD2 3.76Å; V69-T101 WeakPolarHBondContact CA-OG1 3.2Å; V69-T101 HydrophobicContact CG2-CG2 4.07Å
70	A	89.6	Confident	88.7	Confident	68 Å²	68	81.6 Å²	81.6	56%	0.562	46%	0.458	S	S	*	.	H	α-helix	trans	-67.5	-36.5	177.6	0	0	0	0	0	112.7	G66 F67 P74	G66-A70 WeakPolarHBondContact O-CB 3.49Å; G66-A70 PolarHBondContact O-N 2.99Å; F67-A70 PolarHBondContact O-N 3.18Å; A70-P74 WeakPolarHBondContact O-CD 3.33Å; A70-P74 WeakPolarHBondContact O-CG 3.45Å
71	T	89.2	Confident	88.1	Confident	69 Å²	69	80 Å²	80	42%	0.423	46%	0.455	S	S	.	.	H	α-helix	trans	-87.5	-35.7	-177.3	57.6	0	0	0	0	113.6	F67 A68	F67-T71 HydrophobicContact CD1-CG2 4.31Å; F67-T71 HydrophobicContact CD2-CG2 4.49Å; F67-T71 HydrophobicContact CE1-CG2 3.95Å; F67-T71 HydrophobicContact CE2-CG2 4.14Å; F67-T71 HydrophobicContact CZ-CG2 3.85Å; F67-T71 WeakPolarHBondContact O-CG2 3.42Å; F67-T71 PolarHBondContact O-N 2.88Å; F67-T71 PolarHBondContact O-OG1 2.83Å; A68-T71 PolarHBondContact O-OG1 3.19Å
72	W	86.7	Confident	87.6	Confident	99 Å²	99	82.7 Å²	82.7	38%	0.375	46%	0.464	S	S	.	.	H	α-helix	trans	-111.4	-11.8	-174.9	-60.3	-14.4	0	0	0	114.6	A68 P74 T101 M105 F108	A68-W72 WeakPolarHBondContact O-CB 3.29Å; A68-W72 PolarHBondContact O-N 3.24Å; W72-P74 VanDerWaalsContact C-CD 3.49Å; W72-T101 HydrophobicContact CB-CG2 4.35Å; W72-T101 HydrophobicContact CE3-CG2 4.41Å; W72-M105 HydrophobicContact CE3-CB 4.31Å; W72-M105 HydrophobicContact CZ3-CB 3.9Å; W72-M105 HydrophobicContact CZ3-CG 4.06Å; W72-F108 HydrophobicContact CH2-CD1 4.24Å; W72-F108 HydrophobicContact CH2-CG 4.45Å
73	G	84.7	Confident	87	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	46%	0.456	C	S	.	.	S	Bend	trans	-76.7	-25.5	177.2	0	0	0	0	0	117.2	V69 R100 T101	V69-G73 WeakPolarHBondContact O-CA 3.5Å; V69-G73 PolarHBondContact O-N 3.33Å; G73-R100 WeakPolarHBondContact O-CD 3.47Å; G73-T101 WeakPolarHBondContact CA-OG1 3.26Å; G73-T101 PolarHBondContact N-OG1 3.32Å
74	P	86.5	Confident	86.4	Confident	59 Å²	59	78.5 Å²	78.5	38%	0.383	44%	0.444	S	S	.	.	S	Bend	trans	-62.5	145.6	179.7	-24.3	33.9	0	0	0	113.6	A70 W72 Y97	A70-P74 WeakPolarHBondContact O-CD 3.33Å; A70-P74 WeakPolarHBondContact O-CG 3.45Å; W72-P74 VanDerWaalsContact C-CD 3.49Å; P74-Y97 HydrophobicContact CB-CE1 4.45Å; P74-Y97 HydrophobicContact CG-CE1 4.1Å
75	P	86	Confident	85.8	Confident	15 Å²	15	83.4 Å²	83.4	10%	0.097	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-65.5	146	174.5	28	-33	0	0	0	111.4	E83	P75-E83 HydrophobicContact CG-CG 4.07Å
76	K	83.8	Confident	85.4	Confident	133 Å²	133	81.5 Å²	81.5	58%	0.578	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-66.9	139.7	173.3	-65.6	179.8	-177.5	171.7	0	109	I84 E107	K76-I84 HydrophobicContact CB-CD1 4.05Å; K76-I84 PolarHBondContact O-N 3.26Å; K76-E107 IonicContact NZ-OE2 3.59Å
77	K	85.4	Confident	85	Confident	130 Å²	130	86.6 Å²	86.6	57%	0.565	46%	0.462	S	S	*	.	B	Isolated β-bridge	trans	-111.7	143.4	176.2	-64.4	-178.1	177	-170.9	0	109.4	V82 E83	K77-V82 CarbonylContact C-O 3.47Å; K77-V82 VanDerWaalsContact CA-O 3.26Å; K77-V82 WeakPolarHBondContact CA-O 3.19Å; K77-E83 HydrophobicContact CG-CG 4.26Å
78	D	83.5	Confident	84.6	Confident	60 Å²	60	82.8 Å²	82.8	32%	0.321	45%	0.445	S	S	.	.			trans	-72	177.8	174.1	73.5	-1.4	0	0	0	111.7	N80 G81 V82 I84	D78-N80 PolarHBondContact O-N 2.88Å; D78-N80 VanDerWaalsContact O-N 3.11Å; D78-N80 VanDerWaalsContact OD1-C 3.24Å; D78-N80 WeakPolarHBondContact OD1-CA 3.49Å; D78-N80 WeakPolarHBondContact OD1-CB 3.19Å; D78-N80 PolarHBondContact OD1-N 3.39Å; D78-G81 PolarHBondContact O-N 3.17Å; D78-G81 PolarHBondContact OD1-N 3.26Å; D78-V82 PolarHBondContact N-O 2.58Å; D78-V82 WeakPolarHBondContact OD1-CA 3.45Å; D78-V82 WeakPolarHBondContact OD1-CB 3.45Å; D78-V82 PolarHBondContact OD1-N 3.36Å; D78-I84 HydrophobicContact CB-CG1 4.32Å
79	D	84.5	Confident	84.1	Confident	175 Å²	175	83.9 Å²	83.9	94%	0.936	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.9	178	-64.6	-25.6	0	0	0	113
80	N	82.2	Confident	83.6	Confident	141 Å²	141	93.1 Å²	93.1	75%	0.754	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	0.4	177.6	-57.7	-45.9	0	0	0	112.8	D78 V82	D78-N80 PolarHBondContact O-N 2.88Å; D78-N80 VanDerWaalsContact O-N 3.11Å; D78-N80 VanDerWaalsContact OD1-C 3.24Å; D78-N80 WeakPolarHBondContact OD1-CA 3.49Å; D78-N80 WeakPolarHBondContact OD1-CB 3.19Å; D78-N80 PolarHBondContact OD1-N 3.39Å; N80-V82 VanDerWaalsContact C-N 3.35Å; N80-V82 HydrophobicContact CB-CG2 4.42Å
81	G	80.7	Confident	83.4	Confident	45 Å²	45	94.2 Å²	94.2	46%	0.464	48%	0.476	S	S	.	.	S	Bend	trans	80.3	7.5	-178.9	0	0	0	0	0	115.4	D78	D78-G81 PolarHBondContact O-N 3.17Å; D78-G81 PolarHBondContact OD1-N 3.26Å
82	V	82.5	Confident	83.3	Confident	92 Å²	92	95.5 Å²	95.5	56%	0.558	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-80.2	135.5	175.7	-176	0	0	0	0	109.5	K77 D78 N80 I84	K77-V82 CarbonylContact C-O 3.47Å; K77-V82 VanDerWaalsContact CA-O 3.26Å; K77-V82 WeakPolarHBondContact CA-O 3.19Å; D78-V82 PolarHBondContact N-O 2.58Å; D78-V82 WeakPolarHBondContact OD1-CA 3.45Å; D78-V82 WeakPolarHBondContact OD1-CB 3.45Å; D78-V82 PolarHBondContact OD1-N 3.36Å; N80-V82 VanDerWaalsContact C-N 3.35Å; N80-V82 HydrophobicContact CB-CG2 4.42Å; V82-I84 PolarHBondContact O-N 3.41Å
83	E	80.6	Confident	83.2	Confident	110 Å²	110	97.3 Å²	97.3	51%	0.514	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-65.7	127.4	177.8	-64.1	-175.4	176	0	0	110.9	P75 K77 E85	P75-E83 HydrophobicContact CG-CG 4.07Å; K77-E83 HydrophobicContact CG-CG 4.26Å; E83-E85 PolarHBondContact O-N 2.95Å
84	I	81.7	Confident	83.2	Confident	87 Å²	87	103.7 Å²	103.7	45%	0.446	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-74.4	119.8	175.8	-55.4	176.5	0	0	0	107.5	K76 D78 V82 D86	K76-I84 HydrophobicContact CB-CD1 4.05Å; K76-I84 PolarHBondContact O-N 3.26Å; D78-I84 HydrophobicContact CB-CG1 4.32Å; V82-I84 PolarHBondContact O-N 3.41Å; I84-D86 PolarHBondContact O-N 3.02Å; I84-D86 VanDerWaalsContact O-N 3.15Å
85	E	79.8	Confident	83.2	Confident	157 Å²	157	108 Å²	108	73%	0.734	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-62.8	117.3	177.4	-73.2	-161	173.3	0	0	110.8	E83	E83-E85 PolarHBondContact O-N 2.95Å
86	D	82	Confident	83.2	Confident	50 Å²	50	107.3 Å²	107.3	27%	0.267	54%	0.538	S	S	.	.			trans	-112.3	173.6	173.6	69.4	15	0	0	0	111.4	I84 F88 S89 R100	I84-D86 PolarHBondContact O-N 3.02Å; I84-D86 VanDerWaalsContact O-N 3.15Å; D86-F88 PolarHBondContact O-N 2.94Å; D86-F88 VanDerWaalsContact OD1-C 3.27Å; D86-F88 VanDerWaalsContact OD1-CA 3.28Å; D86-F88 WeakPolarHBondContact OD1-CA 3.29Å; D86-F88 WeakPolarHBondContact OD1-CB 3.42Å; D86-F88 PolarHBondContact OD1-N 3.44Å; D86-S89 PolarHBondContact N-OG 3.04Å; D86-S89 PolarHBondContact O-N 3.39Å; D86-S89 PolarHBondContact OD1-N 3.4Å; D86-S89 PolarHBondContact OD1-OG 3.45Å; D86-R100 IonicContact OD1-CZ 2.73Å; D86-R100 IonicContact OD1-NE 3.52Å; D86-R100 IonicContact OD1-NH2 3.51Å; D86-R100 PolarHBondContact OD1-NH2 3.3Å; D86-R100 IonicContact OD2-CZ 3Å; D86-R100 IonicContact OD2-NE 3.53Å; D86-R100 PolarHBondContact OD2-NE 2.95Å; D86-R100 IonicContact OD2-NH2 3.75Å
87	N	82.6	Confident	83.5	Confident	148 Å²	148	104.9 Å²	104.9	79%	0.791	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-11.7	176.6	-68.4	-40.1	0	0	0	113.4
88	F	82.7	Confident	83.7	Confident	46 Å²	46	102.3 Å²	102.3	20%	0.202	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-16.9	-176.9	-50.1	-66.3	0	0	0	112.8	D86 R90 K91 C99 R100 S103	D86-F88 PolarHBondContact O-N 2.94Å; D86-F88 VanDerWaalsContact OD1-C 3.27Å; D86-F88 VanDerWaalsContact OD1-CA 3.28Å; D86-F88 WeakPolarHBondContact OD1-CA 3.29Å; D86-F88 WeakPolarHBondContact OD1-CB 3.42Å; D86-F88 PolarHBondContact OD1-N 3.44Å; F88-R90 PolarHBondContact O-N 3.01Å; F88-R90 VanDerWaalsContact O-N 3.17Å; F88-K91 HydrophobicContact CD1-CD 4.24Å; F88-K91 WeakPolarHBondContact O-CB 3.48Å; F88-K91 PolarHBondContact O-N 3.01Å; F88-C99 HydrophobicContact CD1-CB 3.55Å; F88-C99 HydrophobicContact CE1-CB 3.69Å; F88-C99 HydrophobicContact CG-CB 4.31Å; F88-R100 HydrophobicContact CB-CG 4Å; F88-R100 HydrophobicContact CD2-CG 3.64Å; F88-R100 HydrophobicContact CE2-CG 4.43Å; F88-R100 HydrophobicContact CG-CG 4.02Å; F88-S103 WeakPolarHBondContact CZ-OG 3.45Å
89	S	80.4	Confident	83.9	Confident	49 Å²	49	100.7 Å²	100.7	34%	0.343	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28	-179.3	-67.3	0	0	0	0	112.8	D86 R100	D86-S89 PolarHBondContact N-OG 3.04Å; D86-S89 PolarHBondContact O-N 3.39Å; D86-S89 PolarHBondContact OD1-N 3.4Å; D86-S89 PolarHBondContact OD1-OG 3.45Å; S89-R100 PolarHBondContact OG-NH2 2.92Å; S89-R100 VanDerWaalsContact OG-NH2 3.13Å
90	R	81.2	Confident	84.2	Confident	222 Å²	222	93.4 Å²	93.4	84%	0.838	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-2.7	177.6	-59.2	-177.5	-174.3	169.4	3.3	114.1	F88	F88-R90 PolarHBondContact O-N 3.01Å; F88-R90 VanDerWaalsContact O-N 3.17Å
91	K	84.5	Confident	84.5	Confident	92 Å²	92	87.4 Å²	87.4	40%	0.4	44%	0.439	S	S	.	.	S	Bend	trans	-92.3	159.2	-179.3	-62	-174.1	-170.5	-71.9	0	110.7	F88 I93	F88-K91 HydrophobicContact CD1-CD 4.24Å; F88-K91 WeakPolarHBondContact O-CB 3.48Å; F88-K91 PolarHBondContact O-N 3.01Å; K91-I93 PolarHBondContact O-N 3.1Å
92	P	86.8	Confident	84.8	Confident	96 Å²	96	91.6 Å²	91.6	62%	0.623	45%	0.445	S	S	*	.			trans	-53.3	139.1	174	-24.8	33.9	0	0	0	111.2	I94 W95 G96	P92-I94 PolarHBondContact O-N 3.28Å; P92-W95 HydrophobicContact CB-CB 4.4Å; P92-W95 CarbonylContact O-C 3.52Å; P92-W95 WeakPolarHBondContact O-CA 3.46Å; P92-W95 WeakPolarHBondContact O-CB 3.22Å; P92-W95 PolarHBondContact O-N 3.43Å; P92-G96 PolarHBondContact O-N 3.36Å
93	I	85	Confident	84.9	Confident	136 Å²	136	88.6 Å²	88.6	70%	0.697	43%	0.427	S	S	*	.	H	α-helix	trans	-47.7	-53.3	-167.7	-60.5	167.5	0	0	0	112.5	K91 W95 G96 Y97	K91-I93 PolarHBondContact O-N 3.1Å; I93-W95 VanDerWaalsContact C-N 3.32Å; I93-W95 PolarHBondContact O-N 3.34Å; I93-G96 PolarHBondContact O-N 3.22Å; I93-Y97 HydrophobicContact CG2-CD2 4.09Å; I93-Y97 HydrophobicContact CG2-CE2 4.03Å; I93-Y97 VanDerWaalsContact O-CD2 3.29Å; I93-Y97 WeakPolarHBondContact O-CD2 3.29Å; I93-Y97 PolarHBondContact O-N 2.9Å
94	I	84.8	Confident	85.1	Confident	135 Å²	135	84.8 Å²	84.8	69%	0.692	41%	0.413	S	S	*	.	H	α-helix	trans	-61	-42.3	-178.5	-61.2	170.5	0	0	0	111.2	P92 Y97 L98	P92-I94 PolarHBondContact O-N 3.28Å; I94-Y97 PolarHBondContact O-N 3.42Å; I94-L98 HydrophobicContact CG2-CD1 4.23Å; I94-L98 WeakPolarHBondContact O-CG 3.45Å; I94-L98 PolarHBondContact O-N 2.69Å
95	W	85.3	Confident	85.2	Confident	149 Å²	149	86 Å²	86	56%	0.564	42%	0.418	S	S	*	.	H	α-helix	trans	-70.1	-37.4	178.9	-169.8	-97.4	0	0	0	111.8	P92 I93 L98 C99	P92-W95 HydrophobicContact CB-CB 4.4Å; P92-W95 CarbonylContact O-C 3.52Å; P92-W95 WeakPolarHBondContact O-CA 3.46Å; P92-W95 WeakPolarHBondContact O-CB 3.22Å; P92-W95 PolarHBondContact O-N 3.43Å; I93-W95 VanDerWaalsContact C-N 3.32Å; I93-W95 PolarHBondContact O-N 3.34Å; W95-L98 PolarHBondContact O-N 3.29Å; W95-C99 PolarHBondContact NE1-SG 3.47Å; W95-C99 WeakPolarHBondContact O-CB 3.32Å; W95-C99 PolarHBondContact O-N 2.89Å; W95-C99 PolarHBondContact O-SG 2.99Å; W95-C99 VanDerWaalsContact O-SG 3.36Å
96	G	87.6	Confident	85.4	Confident	1 Å²	1	83 Å²	83	1%	0.01	41%	0.407	C	S	.	.	H	α-helix	trans	-58.9	-47.3	172.8	0	0	0	0	0	111.7	P92 I93 R100	P92-G96 PolarHBondContact O-N 3.36Å; I93-G96 PolarHBondContact O-N 3.22Å; G96-R100 WeakPolarHBondContact O-CB 3.3Å; G96-R100 VanDerWaalsContact O-CG 3.24Å; G96-R100 WeakPolarHBondContact O-CG 3.47Å; G96-R100 PolarHBondContact O-N 2.75Å
97	Y	89.5	Confident	85.3	Confident	81 Å²	81	85.6 Å²	85.6	32%	0.318	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-49.6	175.9	-88.6	-113.4	0	0	0	111.9	V69 P74 I93 I94 C99 R100 T101	V69-Y97 HydrophobicContact CG1-CD1 4.34Å; P74-Y97 HydrophobicContact CB-CE1 4.45Å; P74-Y97 HydrophobicContact CG-CE1 4.1Å; I93-Y97 HydrophobicContact CG2-CD2 4.09Å; I93-Y97 HydrophobicContact CG2-CE2 4.03Å; I93-Y97 VanDerWaalsContact O-CD2 3.29Å; I93-Y97 WeakPolarHBondContact O-CD2 3.29Å; I93-Y97 PolarHBondContact O-N 2.9Å; I94-Y97 PolarHBondContact O-N 3.42Å; Y97-C99 PolarHBondContact O-N 2.8Å; Y97-R100 PolarHBondContact O-N 3.04Å; Y97-T101 PolarHBondContact O-N 2.94Å; Y97-T101 PolarHBondContact O-OG1 3.47Å
98	L	89.4	Confident	85.1	Confident	76 Å²	76	83.6 Å²	83.6	40%	0.398	40%	0.401	S	S	.	.	H	α-helix	trans	-60.7	-45.9	178.9	-72.3	172.1	0	0	0	112.6	V69 I94 W95 R100 T101 F102	V69-L98 HydrophobicContact CG2-CD2 3.76Å; I94-L98 HydrophobicContact CG2-CD1 4.23Å; I94-L98 WeakPolarHBondContact O-CG 3.45Å; I94-L98 PolarHBondContact O-N 2.69Å; W95-L98 PolarHBondContact O-N 3.29Å; L98-R100 VanDerWaalsContact C-N 3.33Å; L98-R100 PolarHBondContact O-N 2.98Å; L98-T101 PolarHBondContact O-N 2.76Å; L98-F102 PolarHBondContact O-N 3.49Å
99	C	88.7	Confident	85	Confident	27 Å²	27	85 Å²	85	18%	0.182	41%	0.411	C	S	.	.	H	α-helix	trans	-64.4	-37.6	177.3	-73.6	0	0	0	0	112.3	F88 W95 Y97 F102 S103	F88-C99 HydrophobicContact CD1-CB 3.55Å; F88-C99 HydrophobicContact CE1-CB 3.69Å; F88-C99 HydrophobicContact CG-CB 4.31Å; W95-C99 PolarHBondContact NE1-SG 3.47Å; W95-C99 WeakPolarHBondContact O-CB 3.32Å; W95-C99 PolarHBondContact O-N 2.89Å; W95-C99 PolarHBondContact O-SG 2.99Å; W95-C99 VanDerWaalsContact O-SG 3.36Å; Y97-C99 PolarHBondContact O-N 2.8Å; C99-F102 PolarHBondContact O-N 2.84Å; C99-S103 WeakPolarHBondContact O-CB 3.25Å; C99-S103 PolarHBondContact O-N 3.48Å; C99-S103 PolarHBondContact O-OG 3.29Å
100	R	89.7	Confident	84.8	Confident	22 Å²	22	86.3 Å²	86.3	8%	0.083	41%	0.412	C	S	.	.	H	α-helix	trans	-63.6	-48.5	173.3	-78.3	172.6	-173.2	139.7	3.6	111	G73 D86 F88 S89 G96 Y97 L98 F102 S103 S104	G73-R100 WeakPolarHBondContact O-CD 3.47Å; D86-R100 IonicContact OD1-CZ 2.73Å; D86-R100 IonicContact OD1-NE 3.52Å; D86-R100 IonicContact OD1-NH2 3.51Å; D86-R100 PolarHBondContact OD1-NH2 3.3Å; D86-R100 IonicContact OD2-CZ 3Å; D86-R100 IonicContact OD2-NE 3.53Å; D86-R100 PolarHBondContact OD2-NE 2.95Å; D86-R100 IonicContact OD2-NH2 3.75Å; F88-R100 HydrophobicContact CB-CG 4Å; F88-R100 HydrophobicContact CD2-CG 3.64Å; F88-R100 HydrophobicContact CE2-CG 4.43Å; F88-R100 HydrophobicContact CG-CG 4.02Å; S89-R100 PolarHBondContact OG-NH2 2.92Å; S89-R100 VanDerWaalsContact OG-NH2 3.13Å; G96-R100 WeakPolarHBondContact O-CB 3.3Å; G96-R100 VanDerWaalsContact O-CG 3.24Å; G96-R100 WeakPolarHBondContact O-CG 3.47Å; G96-R100 PolarHBondContact O-N 2.75Å; Y97-R100 PolarHBondContact O-N 3.04Å; L98-R100 VanDerWaalsContact C-N 3.33Å; L98-R100 PolarHBondContact O-N 2.98Å; R100-F102 VanDerWaalsContact C-N 3.29Å; R100-F102 PolarHBondContact O-N 3.04Å; R100-S103 CarbonylContact O-C 3.55Å; R100-S103 PolarHBondContact O-N 2.97Å; R100-S103 VanDerWaalsContact O-N 3.09Å; R100-S104 WeakPolarHBondContact O-CB 3.45Å; R100-S104 PolarHBondContact O-N 2.98Å; R100-S104 PolarHBondContact O-OG 2.94Å; R100-S104 VanDerWaalsContact O-OG 3.08Å
101	T	88.6	Confident	84.4	Confident	14 Å²	14	79.1 Å²	79.1	9%	0.086	40%	0.396	C	S	.	.	H	α-helix	trans	-56.1	-44.6	176.4	-52.6	0	0	0	0	111.9	A68 V69 W72 G73 Y97 L98 M105	A68-T101 HydrophobicContact CB-CG2 4.05Å; V69-T101 WeakPolarHBondContact CA-OG1 3.2Å; V69-T101 HydrophobicContact CG2-CG2 4.07Å; W72-T101 HydrophobicContact CB-CG2 4.35Å; W72-T101 HydrophobicContact CE3-CG2 4.41Å; G73-T101 WeakPolarHBondContact CA-OG1 3.26Å; G73-T101 PolarHBondContact N-OG1 3.32Å; Y97-T101 PolarHBondContact O-N 2.94Å; Y97-T101 PolarHBondContact O-OG1 3.47Å; L98-T101 PolarHBondContact O-N 2.76Å; T101-M105 VanDerWaalsContact O-CB 3.3Å; T101-M105 WeakPolarHBondContact O-CB 2.98Å; T101-M105 PolarHBondContact O-N 3.19Å
102	F	86.9	Confident	83.9	Confident	134 Å²	134	80.3 Å²	80.3	59%	0.588	41%	0.405	S	S	*	.	H	α-helix	trans	-65.8	-42.2	177.1	-170.7	-103.8	0	0	0	112.1	L98 C99 R100 M105 L106	L98-F102 PolarHBondContact O-N 3.49Å; C99-F102 PolarHBondContact O-N 2.84Å; R100-F102 VanDerWaalsContact C-N 3.29Å; R100-F102 PolarHBondContact O-N 3.04Å; F102-M105 WeakPolarHBondContact O-CB 3.44Å; F102-M105 PolarHBondContact O-N 2.92Å; F102-L106 HydrophobicContact CD1-CD1 3.91Å; F102-L106 HydrophobicContact CD1-CG 4.41Å; F102-L106 HydrophobicContact CE1-CD1 3.57Å; F102-L106 HydrophobicContact CE1-CG 4.16Å; F102-L106 HydrophobicContact CZ-CD1 4.28Å; F102-L106 HydrophobicContact CZ-CG 4.5Å; F102-L106 WeakPolarHBondContact O-CG 3.38Å; F102-L106 PolarHBondContact O-N 3.14Å
103	S	85.6	Confident	83.2	Confident	28 Å²	28	79.5 Å²	79.5	20%	0.196	39%	0.392	C	S	.	.	H	α-helix	trans	-66.1	-44.1	177.7	-55.9	0	0	0	0	111.6	F88 C99 R100 M105 L106 E107	F88-S103 WeakPolarHBondContact CZ-OG 3.45Å; C99-S103 WeakPolarHBondContact O-CB 3.25Å; C99-S103 PolarHBondContact O-N 3.48Å; C99-S103 PolarHBondContact O-OG 3.29Å; R100-S103 CarbonylContact O-C 3.55Å; R100-S103 PolarHBondContact O-N 2.97Å; R100-S103 VanDerWaalsContact O-N 3.09Å; S103-M105 VanDerWaalsContact C-N 3.29Å; S103-M105 PolarHBondContact O-N 3.36Å; S103-L106 CarbonylContact O-C 3.57Å; S103-L106 WeakPolarHBondContact O-CB 3.33Å; S103-L106 PolarHBondContact O-N 2.96Å; S103-L106 VanDerWaalsContact O-N 3.15Å; S103-E107 WeakPolarHBondContact O-CB 3.23Å; S103-E107 WeakPolarHBondContact O-CG 3.45Å; S103-E107 PolarHBondContact O-N 2.92Å
104	S	84.1	Confident	82.7	Confident	30 Å²	30	75.1 Å²	75.1	21%	0.21	37%	0.37	C	S	.	.	H	α-helix	trans	-62.9	-34.6	173.5	-62.5	0	0	0	0	112.2	R100 E107 F108	R100-S104 WeakPolarHBondContact O-CB 3.45Å; R100-S104 PolarHBondContact O-N 2.98Å; R100-S104 PolarHBondContact O-OG 2.94Å; R100-S104 VanDerWaalsContact O-OG 3.08Å; S104-E107 PolarHBondContact O-N 3.43Å; S104-F108 WeakPolarHBondContact O-CB 3.44Å; S104-F108 PolarHBondContact O-N 3.47Å
105	M	84.5	Confident	82.1	Confident	112 Å²	112	69.4 Å²	69.4	55%	0.552	34%	0.342	S	S	*	.	H	α-helix	trans	-67	-39.6	173.3	-171.6	-179.7	-174.1	0	0	111.6	W72 T101 F102 S103 N109	W72-M105 HydrophobicContact CE3-CB 4.31Å; W72-M105 HydrophobicContact CZ3-CB 3.9Å; W72-M105 HydrophobicContact CZ3-CG 4.06Å; T101-M105 VanDerWaalsContact O-CB 3.3Å; T101-M105 WeakPolarHBondContact O-CB 2.98Å; T101-M105 PolarHBondContact O-N 3.19Å; F102-M105 WeakPolarHBondContact O-CB 3.44Å; F102-M105 PolarHBondContact O-N 2.92Å; S103-M105 VanDerWaalsContact C-N 3.29Å; S103-M105 PolarHBondContact O-N 3.36Å; M105-N109 WeakPolarHBondContact O-CB 3.31Å; M105-N109 PolarHBondContact O-N 3.42Å
106	L	83.5	Confident	81.3	Confident	95 Å²	95	69.8 Å²	69.8	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-66.8	-43.9	173.1	-69.1	175.9	0	0	0	111.5	F102 S103 F108 N109 Q110	F102-L106 HydrophobicContact CD1-CD1 3.91Å; F102-L106 HydrophobicContact CD1-CG 4.41Å; F102-L106 HydrophobicContact CE1-CD1 3.57Å; F102-L106 HydrophobicContact CE1-CG 4.16Å; F102-L106 HydrophobicContact CZ-CD1 4.28Å; F102-L106 HydrophobicContact CZ-CG 4.5Å; F102-L106 WeakPolarHBondContact O-CG 3.38Å; F102-L106 PolarHBondContact O-N 3.14Å; S103-L106 CarbonylContact O-C 3.57Å; S103-L106 WeakPolarHBondContact O-CB 3.33Å; S103-L106 PolarHBondContact O-N 2.96Å; S103-L106 VanDerWaalsContact O-N 3.15Å; L106-F108 VanDerWaalsContact C-N 3.34Å; L106-F108 PolarHBondContact O-N 3.28Å; L106-N109 WeakPolarHBondContact O-CB 3.3Å; L106-N109 PolarHBondContact O-N 3.42Å; L106-Q110 WeakPolarHBondContact O-CB 3.5Å; L106-Q110 PolarHBondContact O-N 3.46Å
107	E	80	Confident	80.8	Confident	105 Å²	105	72.4 Å²	72.4	49%	0.491	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-42.5	174	-75.4	175.8	-166.1	0	0	111.2	K76 S103 S104 Q110 S111	K76-E107 IonicContact NZ-OE2 3.59Å; S103-E107 WeakPolarHBondContact O-CB 3.23Å; S103-E107 WeakPolarHBondContact O-CG 3.45Å; S103-E107 PolarHBondContact O-N 2.92Å; S104-E107 PolarHBondContact O-N 3.43Å; E107-Q110 CarbonylContact O-C 3.6Å; E107-Q110 WeakPolarHBondContact O-CA 3.43Å; E107-Q110 WeakPolarHBondContact O-CB 3.39Å; E107-Q110 PolarHBondContact O-N 3Å; E107-S111 WeakPolarHBondContact O-CB 3.47Å; E107-S111 PolarHBondContact O-N 3.18Å
108	F	78.5	Confident	80.5	Confident	105 Å²	105	76.9 Å²	76.9	46%	0.461	40%	0.402	S	S	.	.	H	α-helix	trans	-65.1	-40.8	177	-179.6	-106.1	0	0	0	111.9	W72 S104 L106 Q110 S111 I112	W72-F108 HydrophobicContact CH2-CD1 4.24Å; W72-F108 HydrophobicContact CH2-CG 4.45Å; S104-F108 WeakPolarHBondContact O-CB 3.44Å; S104-F108 PolarHBondContact O-N 3.47Å; L106-F108 VanDerWaalsContact C-N 3.34Å; L106-F108 PolarHBondContact O-N 3.28Å; F108-Q110 VanDerWaalsContact C-N 3.3Å; F108-Q110 PolarHBondContact O-N 3.03Å; F108-S111 WeakPolarHBondContact CA-OG 3.49Å; F108-S111 PolarHBondContact O-N 3Å; F108-S111 PolarHBondContact O-OG 3.36Å; F108-I112 HydrophobicContact CD1-CD1 3.72Å; F108-I112 HydrophobicContact CE1-CD1 3.29Å; F108-I112 HydrophobicContact CE1-CG1 4.33Å; F108-I112 HydrophobicContact CE2-CD1 4.28Å; F108-I112 HydrophobicContact CG-CD1 4.39Å; F108-I112 HydrophobicContact CZ-CD1 3.61Å; F108-I112 HydrophobicContact CZ-CG1 4.29Å; F108-I112 VanDerWaalsContact O-CG1 3.31Å; F108-I112 WeakPolarHBondContact O-CG1 3.32Å; F108-I112 PolarHBondContact O-N 3.23Å
109	N	79.5	Confident	80.5	Confident	75 Å²	75	78.6 Å²	78.6	40%	0.401	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-40.6	172.8	-168.7	-27.8	0	0	0	110.9	M105 L106 K113	M105-N109 WeakPolarHBondContact O-CB 3.31Å; M105-N109 PolarHBondContact O-N 3.42Å; L106-N109 WeakPolarHBondContact O-CB 3.3Å; L106-N109 PolarHBondContact O-N 3.42Å; N109-K113 WeakPolarHBondContact O-CD 3.43Å; N109-K113 WeakPolarHBondContact O-CG 3.5Å; N109-K113 PolarHBondContact O-N 3.08Å; N109-K113 VanDerWaalsContact OD1-CE 3.22Å; N109-K113 WeakPolarHBondContact OD1-CE 3.29Å; N109-K113 PolarHBondContact OD1-NZ 2.97Å
110	Q	77.1	Confident	80.7	Confident	77 Å²	77	78.9 Å²	78.9	36%	0.36	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-40.9	174.9	-166.9	71.7	28.4	0	0	111.7	L106 E107 F108 I112 K113 D114 Y212	L106-Q110 WeakPolarHBondContact O-CB 3.5Å; L106-Q110 PolarHBondContact O-N 3.46Å; E107-Q110 CarbonylContact O-C 3.6Å; E107-Q110 WeakPolarHBondContact O-CA 3.43Å; E107-Q110 WeakPolarHBondContact O-CB 3.39Å; E107-Q110 PolarHBondContact O-N 3Å; F108-Q110 VanDerWaalsContact C-N 3.3Å; F108-Q110 PolarHBondContact O-N 3.03Å; Q110-I112 VanDerWaalsContact C-N 3.33Å; Q110-I112 PolarHBondContact O-N 2.91Å; Q110-K113 CarbonylContact O-C 3.6Å; Q110-K113 WeakPolarHBondContact O-CA 3.33Å; Q110-K113 WeakPolarHBondContact O-CB 3.37Å; Q110-K113 PolarHBondContact O-N 2.88Å; Q110-D114 PolarHBondContact O-N 3.18Å; Q110-Y212 PolarHBondContact NE2-O 3.36Å
111	S	72.2	Confident	80.9	Confident	72 Å²	72	78.1 Å²	78.1	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-70.1	-29.5	179.8	71.3	0	0	0	0	112.8	E107 F108 K113	E107-S111 WeakPolarHBondContact O-CB 3.47Å; E107-S111 PolarHBondContact O-N 3.18Å; F108-S111 WeakPolarHBondContact CA-OG 3.49Å; F108-S111 PolarHBondContact O-N 3Å; F108-S111 PolarHBondContact O-OG 3.36Å; S111-K113 PolarHBondContact O-N 2.96Å
112	I	75	Confident	81.2	Confident	116 Å²	116	81 Å²	81	60%	0.595	42%	0.422	S	S	*	.	H	α-helix	trans	-67.5	-28.4	170.1	-71.9	167.2	0	0	0	111.2	F108 Q110	F108-I112 HydrophobicContact CD1-CD1 3.72Å; F108-I112 HydrophobicContact CE1-CD1 3.29Å; F108-I112 HydrophobicContact CE1-CG1 4.33Å; F108-I112 HydrophobicContact CE2-CD1 4.28Å; F108-I112 HydrophobicContact CG-CD1 4.39Å; F108-I112 HydrophobicContact CZ-CD1 3.61Å; F108-I112 HydrophobicContact CZ-CG1 4.29Å; F108-I112 VanDerWaalsContact O-CG1 3.31Å; F108-I112 WeakPolarHBondContact O-CG1 3.32Å; F108-I112 PolarHBondContact O-N 3.23Å; Q110-I112 VanDerWaalsContact C-N 3.33Å; Q110-I112 PolarHBondContact O-N 2.91Å
113	K	71.7	Confident	81.5	Confident	80 Å²	80	79.6 Å²	79.6	35%	0.348	42%	0.421	S	S	.	.	H	α-helix	trans	-90.9	-28.1	-176.6	-83	166.4	170.8	161.4	0	114	N109 Q110 S111 Y212	N109-K113 WeakPolarHBondContact O-CD 3.43Å; N109-K113 WeakPolarHBondContact O-CG 3.5Å; N109-K113 PolarHBondContact O-N 3.08Å; N109-K113 VanDerWaalsContact OD1-CE 3.22Å; N109-K113 WeakPolarHBondContact OD1-CE 3.29Å; N109-K113 PolarHBondContact OD1-NZ 2.97Å; Q110-K113 CarbonylContact O-C 3.6Å; Q110-K113 WeakPolarHBondContact O-CA 3.33Å; Q110-K113 WeakPolarHBondContact O-CB 3.37Å; Q110-K113 PolarHBondContact O-N 2.88Å; S111-K113 PolarHBondContact O-N 2.96Å; K113-Y212 HydrophobicContact CD-CD1 3.77Å; K113-Y212 HydrophobicContact CD-CE1 4.44Å; K113-Y212 HydrophobicContact CG-CD1 4.25Å
114	D	75.2	Confident	81.8	Confident	43 Å²	43	80.8 Å²	80.8	23%	0.23	43%	0.428	C	S	.	.	S	Bend	trans	-74.9	152.2	176.7	-77.6	-21.6	0	0	0	110.3	Q110 R211	Q110-D114 PolarHBondContact O-N 3.18Å; D114-R211 IonicContact OD1-NH1 2.8Å; D114-R211 IonicContact OD2-NH1 3.68Å
115	P	71.1	Confident	82.2	Confident	16 Å²	16	82.5 Å²	82.5	10%	0.104	44%	0.437	C	S	.	.			trans	-61.3	142.6	-179.8	24.9	-33.2	0	0	0	110.8	S117 L120 A209 R211	P115-S117 PolarHBondContact O-N 3.29Å; P115-S117 VanDerWaalsContact O-N 3.11Å; P115-L120 HydrophobicContact CB-CD2 4.31Å; P115-A209 WeakPolarHBondContact CB-O 3.39Å; P115-R211 HydrophobicContact CG-CG 4.2Å
116	V	68.2	Low	82.4	Confident	156 Å²	156	83.7 Å²	83.7	95%	0.945	44%	0.441	S	S	*	.	S	Bend	trans	-61	-25	-175.1	-177.5	0	0	0	0	112.7
117	S	78.6	Confident	82.6	Confident	57 Å²	57	84.5 Å²	84.5	40%	0.399	45%	0.452	S	S	.	.			trans	-122.3	138.5	-175.5	-172.3	0	0	0	0	112.2	P115 K119	P115-S117 PolarHBondContact O-N 3.29Å; P115-S117 VanDerWaalsContact O-N 3.11Å; S117-K119 VanDerWaalsContact C-N 3.28Å; S117-K119 WeakPolarHBondContact CB-O 3.41Å; S117-K119 PolarHBondContact OG-N 3.49Å; S117-K119 PolarHBondContact OG-O 3.4Å
118	E	81.8	Confident	83.1	Confident	174 Å²	174	85.5 Å²	85.5	81%	0.813	47%	0.468	S	S	*	.	S	Bend	trans	-67.7	-30	169.4	-63.8	-176.1	170.5	0	0	112.2	C223	E118-C223 WeakPolarHBondContact O-CA 3.32Å; E118-C223 WeakPolarHBondContact O-CB 3.25Å
119	K	90	Very high	83.6	Confident	112 Å²	112	88.8 Å²	88.8	49%	0.487	48%	0.478	S	S	.	.			trans	-113.9	112.3	176.3	-64.7	-175.8	175.9	-169	0	109.8	S117 D123 C223 N225	S117-K119 VanDerWaalsContact C-N 3.28Å; S117-K119 WeakPolarHBondContact CB-O 3.41Å; S117-K119 PolarHBondContact OG-N 3.49Å; S117-K119 PolarHBondContact OG-O 3.4Å; K119-D123 IonicContact NZ-OD1 3.6Å; K119-C223 CarbonylContact C-O 3.53Å; K119-C223 WeakPolarHBondContact CA-O 3.39Å; K119-N225 HydrophobicContact CB-CB 4.37Å; K119-N225 HydrophobicContact CD-CB 4.41Å; K119-N225 HydrophobicContact CG-CB 4.28Å
120	L	92.4	Very high	84	Confident	34 Å²	34	92.9 Å²	92.9	18%	0.178	49%	0.489	C	S	.	.	S	Bend	trans	-81.4	-28.7	179.9	-63.4	177.5	0	0	0	112.4	P115 Y179 L205 A209 C223 L224	P115-L120 HydrophobicContact CB-CD2 4.31Å; L120-Y179 HydrophobicContact CD1-CE1 4.26Å; L120-L205 HydrophobicContact CB-CD1 4.2Å; L120-L205 HydrophobicContact CB-CD2 4.12Å; L120-L205 HydrophobicContact CD1-CD1 4.17Å; L120-A209 HydrophobicContact CD1-CB 4.21Å; L120-A209 HydrophobicContact CD2-CB 3.87Å; L120-C223 WeakPolarHBondContact CB-O 3.34Å; L120-C223 HydrophobicContact CD1-CB 3.77Å; L120-C223 HydrophobicContact CG-CB 3.78Å; L120-C223 PolarHBondContact N-O 3.33Å; L120-L224 HydrophobicContact CB-CD2 4.39Å; L120-L224 HydrophobicContact CD1-CD2 4.29Å
121	L	94.4	Very high	84.6	Confident	5 Å²	5	91.5 Å²	91.5	3%	0.026	48%	0.483	C	S	.	.	S	Bend	trans	-115.9	148.3	178.3	-51	-178.9	0	0	0	110.9	V177 F203 L205 L224 N225 R226	L121-V177 HydrophobicContact CD1-CG2 3.95Å; L121-V177 HydrophobicContact CD2-CG1 4.41Å; L121-F203 HydrophobicContact CD1-CD2 4.45Å; L121-F203 HydrophobicContact CD2-CB 3.68Å; L121-F203 HydrophobicContact CD2-CD1 4.14Å; L121-F203 HydrophobicContact CD2-CD2 3.94Å; L121-F203 HydrophobicContact CD2-CG 3.65Å; L121-L205 HydrophobicContact CD2-CD1 4.28Å; L121-L205 HydrophobicContact CD2-CD2 4.4Å; L121-L224 VanDerWaalsContact CB-O 3.28Å; L121-L224 WeakPolarHBondContact CB-O 3.21Å; L121-L224 HydrophobicContact CD1-CB 4.15Å; L121-L224 HydrophobicContact CD1-CD2 4.12Å; L121-L224 WeakPolarHBondContact CD1-O 3.41Å; L121-L224 HydrophobicContact CG-CB 4.48Å; L121-L224 HydrophobicContact CG-CD2 4.13Å; L121-L224 WeakPolarHBondContact CG-O 3.29Å; L121-N225 PolarHBondContact O-ND2 2.74Å; L121-R226 HydrophobicContact CD1-CG 4.25Å
122	P	94.1	Very high	85.6	Confident	75 Å²	75	88.5 Å²	88.5	49%	0.487	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-62.6	164.9	171.5	29.6	-36.1	0	0	0	111	F203 R226	P122-F203 HydrophobicContact CG-CE1 3.68Å; P122-F203 HydrophobicContact CG-CZ 3.53Å; P122-R226 PolarHBondContact O-NH1 3.45Å; P122-R226 PolarHBondContact O-NH2 3.42Å
123	D	93.6	Very high	86.5	Confident	105 Å²	105	85.8 Å²	85.8	56%	0.561	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-58.6	144.7	174.7	-62.3	-36.8	0	0	0	110.6	K119 N225	K119-D123 IonicContact NZ-OD1 3.6Å; D123-N225 PolarHBondContact OD1-ND2 3.15Å
124	P	92.1	Very high	87.7	Confident	53 Å²	53	82.7 Å²	82.7	34%	0.344	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-54.9	142.2	178.9	-24.9	33.3	0	0	0	112.3	Q126 Q131	P124-Q126 PolarHBondContact O-NE2 2.72Å; P124-Q131 HydrophobicContact CB-CG 4.29Å
125	V	91.4	Very high	88.7	Confident	66 Å²	66	81 Å²	81	40%	0.4	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-66	141.4	-178.8	-56.3	0	0	0	0	110.8	Q131	V125-Q131 HydrophobicContact CG2-CB 3.69Å; V125-Q131 VanDerWaalsContact N-OE1 3.07Å
126	Q	89.5	Confident	90	Very high	137 Å²	137	80.2 Å²	80.2	64%	0.64	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-92.4	154.3	176.9	-60.9	-61.1	-44.1	0	0	110.4	P124 Y129	P124-Q126 PolarHBondContact O-NE2 2.72Å; Q126-Y129 PolarHBondContact O-N 3.13Å; Q126-Y129 VanDerWaalsContact O-N 3.11Å
127	P	87.9	Confident	91.5	Very high	111 Å²	111	72.8 Å²	72.8	72%	0.721	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	134	169.1	-25.5	34.8	0	0	0	110.5
128	P	89.8	Confident	92.4	Very high	126 Å²	126	70 Å²	70	82%	0.818	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.3	0	23.3	36.2	-37.7	0	0	0	115.7
129	Y	88.8	Confident	93.1	Very high	175 Å²	175	62 Å²	62	69%	0.686	32%	0.322	S	S	*	.	S	Bend	trans	-76.9	141.2	178.9	-59.8	-78.1	0	0	0	110.8	Q126	Q126-Y129 PolarHBondContact O-N 3.13Å; Q126-Y129 VanDerWaalsContact O-N 3.11Å
130	Y	88.6	Confident	93.4	Very high	161 Å²	161	56.6 Å²	56.6	63%	0.631	30%	0.299	S	S	*	.			trans	-82.4	121.6	178.7	179.8	-101.7	0	0	0	110.5	P132 P172	Y130-P132 HydrophobicContact CE1-CB 4.42Å; Y130-P132 HydrophobicContact CE1-CG 4.08Å; Y130-P172 PolarHBondContact OH-O 3.39Å; Y130-P172 VanDerWaalsContact OH-O 3.11Å
131	Q	90.5	Very high	93.6	Very high	47 Å²	47	55.7 Å²	55.7	22%	0.22	30%	0.295	C	S	.	.			trans	-105	126.1	167.1	-175.5	71.6	43.5	0	0	108.2	P124 V125 E175	P124-Q131 HydrophobicContact CB-CG 4.29Å; V125-Q131 HydrophobicContact CG2-CB 3.69Å; V125-Q131 VanDerWaalsContact N-OE1 3.07Å; Q131-E175 PolarHBondContact NE2-OE1 2.63Å
132	P	93.1	Very high	93.7	Very high	10 Å²	10	55.5 Å²	55.5	7%	0.065	29%	0.294	C	S	.	.			trans	-58.9	143.3	171.7	-23.7	33.6	0	0	0	111.7	Y130 Y134 Y174 E175	Y130-P132 HydrophobicContact CE1-CB 4.42Å; Y130-P132 HydrophobicContact CE1-CG 4.08Å; P132-Y134 VanDerWaalsContact C-N 3.29Å; P132-Y134 PolarHBondContact O-N 3.25Å; P132-Y174 VanDerWaalsContact CB-C 3.42Å; P132-E175 HydrophobicContact CB-CB 4.37Å; P132-E175 VanDerWaalsContact CB-N 3.33Å; P132-E175 HydrophobicContact CG-CB 4.25Å
133	P	93	Very high	93.8	Very high	59 Å²	59	51.9 Å²	51.9	38%	0.383	27%	0.27	S	S	.	.	S	Bend	trans	-67.8	-25.7	-174.2	24	-33.3	0	0	0	114.2	H173 R230	P133-H173 WeakPolarHBondContact CD-O 3.49Å; P133-R230 WeakPolarHBondContact O-CD 3.34Å
134	Y	97	Very high	94	Very high	14 Å²	14	46.9 Å²	46.9	6%	0.055	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	155.5	-179.1	-60.5	-80.8	0	0	0	110.9	P132 Y174 E175 R230 A274 S277 V278 V281	P132-Y134 VanDerWaalsContact C-N 3.29Å; P132-Y134 PolarHBondContact O-N 3.25Å; Y134-Y174 HydrophobicContact CD2-CE1 4.45Å; Y134-Y174 HydrophobicContact CG-CD1 4.41Å; Y134-Y174 AromaticContact CG-CE1 3.98Å; Y134-Y174 HydrophobicContact CG-CE1 3.98Å; Y134-Y174 CarbonylContact O-C 3.5Å; Y134-Y174 VanDerWaalsContact O-CA 3.31Å; Y134-Y174 WeakPolarHBondContact O-CA 3.11Å; Y134-E175 PolarHBondContact O-N 3.39Å; Y134-R230 WeakPolarHBondContact CA-O 3.37Å; Y134-R230 HydrophobicContact CD1-CB 3.86Å; Y134-R230 HydrophobicContact CD1-CG 4.32Å; Y134-R230 HydrophobicContact CE1-CB 4.4Å; Y134-R230 HydrophobicContact CE1-CG 4.39Å; Y134-A274 HydrophobicContact CD2-CB 4.27Å; Y134-A274 HydrophobicContact CE2-CB 4.32Å; Y134-S277 VanDerWaalsContact OH-C 3.29Å; Y134-S277 WeakPolarHBondContact OH-CA 3.43Å; Y134-V278 WeakPolarHBondContact CE1-O 3.33Å; Y134-V278 PolarHBondContact OH-N 3.41Å; Y134-V278 PolarHBondContact OH-O 2.95Å; Y134-V281 HydrophobicContact CD1-CG1 3.82Å; Y134-V281 HydrophobicContact CE1-CG1 3.72Å
135	T	97.7	Very high	94.2	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.2	171.8	-58	0	0	0	0	108.9	V137 E175 V177 R226 R230 V231 V232	T135-V137 HydrophobicContact CG2-CG2 4.27Å; T135-E175 WeakPolarHBondContact CA-O 3.44Å; T135-E175 PolarHBondContact OG1-OE2 3.35Å; T135-V177 HydrophobicContact CG2-CG2 3.82Å; T135-R226 HydrophobicContact CG2-CG 4.34Å; T135-R230 PolarHBondContact N-O 3Å; T135-V231 WeakPolarHBondContact O-CA 3.48Å; T135-V232 PolarHBondContact O-N 3.32Å
136	L	98	Very high	94.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.9	177	176.7	63.9	0	0	0	109.2	L138 F166 L170 Y174 E175 V177 V232 V234 L270	L136-L138 HydrophobicContact CD1-CD2 4.27Å; L136-L138 HydrophobicContact CD1-CG 4.45Å; L136-L138 HydrophobicContact CD2-CD1 3.92Å; L136-L138 HydrophobicContact CD2-CD2 4.28Å; L136-L138 HydrophobicContact CD2-CG 4.16Å; L136-L138 HydrophobicContact CG-CD1 4.18Å; L136-L138 HydrophobicContact CG-CD2 4.22Å; L136-L138 HydrophobicContact CG-CG 3.94Å; L136-F166 HydrophobicContact CD2-CZ 4.39Å; L136-L170 HydrophobicContact CD2-CD1 3.79Å; L136-Y174 HydrophobicContact CB-CD1 3.62Å; L136-Y174 HydrophobicContact CB-CE1 4.47Å; L136-Y174 HydrophobicContact CB-CG 3.82Å; L136-E175 PolarHBondContact N-O 3.1Å; L136-V177 PolarHBondContact O-N 2.82Å; L136-V232 WeakPolarHBondContact CA-O 3.37Å; L136-V232 HydrophobicContact CD1-CB 4.28Å; L136-V232 HydrophobicContact CD1-CG1 4.33Å; L136-V234 HydrophobicContact CD1-CG2 4.04Å; L136-L270 HydrophobicContact CD1-CD1 3.77Å; L136-L270 HydrophobicContact CD1-CD2 3.96Å; L136-L270 HydrophobicContact CD2-CD1 3.76Å; L136-L270 HydrophobicContact CG-CD1 4.43Å
137	V	98.1	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.7	177	-173.6	0	0	0	0	108.7	T135 V177 Y179 L221 L224 V231 V232 F233 V234	T135-V137 HydrophobicContact CG2-CG2 4.27Å; V137-V177 CarbonylContact C-O 3.55Å; V137-V177 VanDerWaalsContact CA-O 3.26Å; V137-V177 WeakPolarHBondContact CA-O 3.41Å; V137-V177 HydrophobicContact CG2-CB 4.42Å; V137-Y179 HydrophobicContact CG1-CD1 4.07Å; V137-Y179 HydrophobicContact CG1-CG 4.32Å; V137-L221 HydrophobicContact CG1-CD2 4.38Å; V137-L221 HydrophobicContact CG2-CD2 4.42Å; V137-L224 HydrophobicContact CG2-CD1 3.55Å; V137-V231 HydrophobicContact CG2-CG1 3.98Å; V137-V232 PolarHBondContact N-O 2.72Å; V137-F233 HydrophobicContact CB-CB 4.24Å; V137-F233 HydrophobicContact CB-CD2 3.76Å; V137-F233 HydrophobicContact CB-CG 4.36Å; V137-F233 HydrophobicContact CG1-CD2 3.57Å; V137-F233 HydrophobicContact CG1-CE2 4.03Å; V137-F233 HydrophobicContact CG1-CG 4.43Å; V137-F233 CarbonylContact O-C 3.34Å; V137-F233 WeakPolarHBondContact O-CA 3.41Å; V137-V234 PolarHBondContact O-N 3.11Å
138	L	97.8	Very high	95	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.7	-177.3	-66.6	161.4	0	0	0	110.7	L136 L144 F166 V176 V177 V178 Y179 V234	L136-L138 HydrophobicContact CD1-CD2 4.27Å; L136-L138 HydrophobicContact CD1-CG 4.45Å; L136-L138 HydrophobicContact CD2-CD1 3.92Å; L136-L138 HydrophobicContact CD2-CD2 4.28Å; L136-L138 HydrophobicContact CD2-CG 4.16Å; L136-L138 HydrophobicContact CG-CD1 4.18Å; L136-L138 HydrophobicContact CG-CD2 4.22Å; L136-L138 HydrophobicContact CG-CG 3.94Å; L138-L144 HydrophobicContact CB-CD1 4.27Å; L138-L144 HydrophobicContact CD1-CD1 4.42Å; L138-L144 HydrophobicContact CD1-CD2 4.44Å; L138-F166 HydrophobicContact CD1-CE1 3.73Å; L138-F166 HydrophobicContact CD1-CZ 4.14Å; L138-F166 HydrophobicContact CD2-CE1 4.31Å; L138-F166 HydrophobicContact CD2-CZ 3.97Å; L138-V176 HydrophobicContact CD1-CG1 3.82Å; L138-V177 PolarHBondContact N-O 2.74Å; L138-V178 CarbonylContact O-C 3.15Å; L138-V178 WeakPolarHBondContact O-CA 3.4Å; L138-Y179 PolarHBondContact O-N 3.08Å; L138-V234 HydrophobicContact CD2-CB 3.88Å; L138-V234 HydrophobicContact CD2-CG1 4.44Å; L138-V234 HydrophobicContact CD2-CG2 4.22Å
139	E	97.4	Very high	95.1	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.019	16%	0.159	C	C	.	.			trans	-66.9	148.4	157.5	174.8	55.8	-105.6	0	0	109.8	T141 V143 L144 T180 N181 K219 V234 D235	E139-T141 WeakPolarHBondContact CG-O 3.35Å; E139-T141 PolarHBondContact OE1-N 3.48Å; E139-V143 HydrophobicContact CB-CB 4.45Å; E139-V143 HydrophobicContact CB-CG2 3.84Å; E139-V143 HydrophobicContact CG-CG2 4.18Å; E139-V143 WeakPolarHBondContact O-CB 3.26Å; E139-L144 WeakPolarHBondContact O-CG 3.25Å; E139-T180 WeakPolarHBondContact OE1-CA 3.45Å; E139-T180 WeakPolarHBondContact OE1-CB 3.35Å; E139-T180 PolarHBondContact OE1-OG1 2.91Å; E139-T180 WeakPolarHBondContact OE2-CA 3.39Å; E139-N181 PolarHBondContact OE2-N 2.89Å; E139-N181 VanDerWaalsContact OE2-N 3.1Å; E139-K219 WeakPolarHBondContact OE2-CE 3.34Å; E139-K219 IonicContact OE2-NZ 3.64Å; E139-K219 PolarHBondContact OE2-NZ 3.46Å; E139-V234 PolarHBondContact N-O 2.69Å; E139-D235 HydrophobicContact CB-CB 4.41Å
140	M	96.8	Very high	95.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.15	C	C	.	.			trans	-87.6	-55.8	176.6	179.2	-172.8	71.9	0	0	110.8	L144 V145 V178 T180 E182 V190 L191	M140-L144 PolarHBondContact O-N 3.07Å; M140-V145 HydrophobicContact CG-CG2 3.47Å; M140-V145 VanDerWaalsContact CG-CG2 3.47Å; M140-V145 WeakPolarHBondContact O-CG2 3.39Å; M140-V145 PolarHBondContact O-N 2.91Å; M140-V145 HydrophobicContact SD-CG2 4.28Å; M140-V178 HydrophobicContact CB-CG1 3.89Å; M140-T180 HydrophobicContact CE-CG2 4.43Å; M140-E182 HydrophobicContact CE-CB 3.89Å; M140-E182 HydrophobicContact CE-CG 3.6Å; M140-V190 HydrophobicContact SD-CB 4.2Å; M140-V190 HydrophobicContact SD-CG1 4.03Å; M140-L191 HydrophobicContact CG-CD2 3.97Å; M140-L191 HydrophobicContact SD-CD1 4.32Å; M140-L191 HydrophobicContact SD-CD2 3.71Å; M140-L191 HydrophobicContact SD-CG 3.73Å
141	T	96.3	Very high	95.6	Very high	14 Å²	14	33.2 Å²	33.2	9%	0.086	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-75.6	128.1	-172	-61.9	0	0	0	0	110.8	E139 V143 V145 P147 E182 W236	E139-T141 WeakPolarHBondContact CG-O 3.35Å; E139-T141 PolarHBondContact OE1-N 3.48Å; T141-V143 PolarHBondContact O-N 2.96Å; T141-V143 VanDerWaalsContact O-N 3.07Å; T141-V145 CarbonylContact C-O 3.53Å; T141-V145 WeakPolarHBondContact CA-O 3.32Å; T141-P147 HydrophobicContact CG2-CG 4.25Å; T141-E182 WeakPolarHBondContact OG1-CG 3.45Å; T141-W236 VanDerWaalsContact O-CD1 3.23Å; T141-W236 PolarHBondContact O-NE1 2.78Å
142	D	96	Very high	95.8	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	11.2	-178.7	-51.5	-25.9	0	0	0	115.1	V145 H146 W236 R253 W254	D142-V145 PolarHBondContact N-O 3.47Å; D142-H146 IonicContact OD1-CE1 3.8Å; D142-H146 IonicContact OD1-CG 3.08Å; D142-H146 IonicContact OD1-ND1 2.76Å; D142-H146 PolarHBondContact OD1-ND1 3.2Å; D142-W236 HydrophobicContact CB-CG 4.44Å; D142-R253 HydrophobicContact CB-CG 3.68Å; D142-R253 IonicContact OD2-CZ 3.86Å; D142-R253 IonicContact OD2-NE 3.87Å; D142-R253 PolarHBondContact OD2-NE 3.4Å; D142-R253 IonicContact OD2-NH2 2.94Å; D142-R253 PolarHBondContact OD2-NH2 3.47Å; D142-W254 WeakPolarHBondContact CB-O 3.39Å; D142-W254 VanDerWaalsContact O-CB 3.26Å; D142-W254 WeakPolarHBondContact O-CB 3.31Å; D142-W254 PolarHBondContact O-N 3.46Å
143	V	96.7	Very high	95.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-53.5	164.7	174.4	0	0	0	0	110.4	E139 T141 R160 V234 I251	E139-V143 HydrophobicContact CB-CB 4.45Å; E139-V143 HydrophobicContact CB-CG2 3.84Å; E139-V143 HydrophobicContact CG-CG2 4.18Å; E139-V143 WeakPolarHBondContact O-CB 3.26Å; T141-V143 PolarHBondContact O-N 2.96Å; T141-V143 VanDerWaalsContact O-N 3.07Å; V143-R160 WeakPolarHBondContact O-CD 3.5Å; V143-R160 PolarHBondContact O-NH1 3Å; V143-V234 HydrophobicContact CG1-CG1 4.47Å; V143-I251 HydrophobicContact CB-CD1 4.46Å; V143-I251 HydrophobicContact CG1-CD1 3.94Å; V143-I251 HydrophobicContact CG2-CD1 4.19Å
144	L	96.5	Very high	95.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-37.5	-177.6	-53.5	178.4	0	0	0	112.3	L138 E139 M140 R160 L163 F166 V178 M194	L138-L144 HydrophobicContact CB-CD1 4.27Å; L138-L144 HydrophobicContact CD1-CD1 4.42Å; L138-L144 HydrophobicContact CD1-CD2 4.44Å; E139-L144 WeakPolarHBondContact O-CG 3.25Å; M140-L144 PolarHBondContact O-N 3.07Å; L144-R160 WeakPolarHBondContact O-CB 3.47Å; L144-R160 PolarHBondContact O-N 3.38Å; L144-L163 HydrophobicContact CB-CD1 4.01Å; L144-L163 HydrophobicContact CB-CD2 4.19Å; L144-L163 HydrophobicContact CD2-CD1 3.61Å; L144-L163 HydrophobicContact CG-CD1 4.24Å; L144-F166 HydrophobicContact CD2-CE1 4.17Å; L144-V178 HydrophobicContact CD1-CG2 4.36Å; L144-M194 HydrophobicContact CB-CE 4.19Å; L144-M194 HydrophobicContact CD1-SD 4.25Å
145	V	96.4	Very high	95.5	Very high	6 Å²	6	49.9 Å²	49.9	4%	0.036	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.2	-178.9	-68.7	0	0	0	0	111.2	M140 T141 D142 F157 K158 V190 M194	M140-V145 HydrophobicContact CG-CG2 3.47Å; M140-V145 VanDerWaalsContact CG-CG2 3.47Å; M140-V145 WeakPolarHBondContact O-CG2 3.39Å; M140-V145 PolarHBondContact O-N 2.91Å; M140-V145 HydrophobicContact SD-CG2 4.28Å; T141-V145 CarbonylContact C-O 3.53Å; T141-V145 WeakPolarHBondContact CA-O 3.32Å; D142-V145 PolarHBondContact N-O 3.47Å; V145-F157 HydrophobicContact CB-CB 4.41Å; V145-F157 HydrophobicContact CB-CD1 4.29Å; V145-F157 HydrophobicContact CG2-CD1 4Å; V145-K158 CarbonylContact C-O 3.54Å; V145-K158 WeakPolarHBondContact CA-O 3.39Å; V145-K158 WeakPolarHBondContact CB-O 3.27Å; V145-V190 HydrophobicContact CG1-CG1 4.45Å; V145-V190 HydrophobicContact CG2-CG1 4.1Å; V145-M194 HydrophobicContact CG1-CE 3.39Å; V145-M194 HydrophobicContact CG2-CE 4.37Å
146	H	96.3	Very high	95.3	Very high	35 Å²	35	57 Å²	57	16%	0.162	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125	179	-177.2	71.1	0	0	0	110	D142 D148 F157 K158 W254	D142-H146 IonicContact OD1-CE1 3.8Å; D142-H146 IonicContact OD1-CG 3.08Å; D142-H146 IonicContact OD1-ND1 2.76Å; D142-H146 PolarHBondContact OD1-ND1 3.2Å; H146-D148 PolarHBondContact O-N 3.16Å; H146-F157 WeakPolarHBondContact O-CA 3.42Å; H146-K158 PolarHBondContact N-O 3.46Å; H146-K158 PolarHBondContact O-N 3.35Å; H146-W254 HydrophobicContact CB-CE3 3.7Å; H146-W254 HydrophobicContact CB-CH2 4.15Å; H146-W254 HydrophobicContact CB-CZ3 3.48Å; H146-W254 VanDerWaalsContact CB-CZ3 3.48Å; H146-W254 PolarHBondContact ND1-O 3.32Å
147	P	95.1	Very high	95.1	Very high	34 Å²	34	60.2 Å²	60.2	22%	0.221	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.5	174.6	28.6	-32.5	0	0	0	110.2	T141 W155 R156 F157	T141-P147 HydrophobicContact CG2-CG 4.25Å; P147-W155 HydrophobicContact CB-CE3 4.28Å; P147-W155 HydrophobicContact CB-CZ3 4.17Å; P147-R156 CarbonylContact C-O 3.59Å; P147-F157 HydrophobicContact CB-CD1 4.2Å; P147-F157 HydrophobicContact CB-CE1 3.86Å; P147-F157 HydrophobicContact CB-CZ 4.37Å
148	D	94.4	Very high	95	Very high	37 Å²	37	63.5 Å²	63.5	20%	0.198	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.7	175.8	-174.6	23.6	0	0	0	109.4	H146 K150 R156 K158	H146-D148 PolarHBondContact O-N 3.16Å; D148-K150 WeakPolarHBondContact OD2-CE 3.31Å; D148-K150 IonicContact OD2-NZ 3.5Å; D148-R156 PolarHBondContact N-O 2.83Å; D148-R156 PolarHBondContact O-N 2.82Å; D148-R156 VanDerWaalsContact O-O 3.1Å; D148-K158 HydrophobicContact CB-CD 4.33Å; D148-K158 HydrophobicContact CB-CG 4.23Å; D148-K158 WeakPolarHBondContact OD2-CE 3.25Å; D148-K158 IonicContact OD2-NZ 3.63Å
149	W	93.1	Very high	94.8	Very high	137 Å²	137	67.9 Å²	67.9	52%	0.519	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.1	175.6	-177.4	90.1	0	0	0	110.1	F151 W155	W149-F151 HydrophobicContact CH2-CB 4.02Å; W149-F151 HydrophobicContact CH2-CD2 4.11Å; W149-F151 HydrophobicContact CZ3-CB 4.38Å; W149-W155 HydrophobicContact CB-CD2 4.04Å; W149-W155 HydrophobicContact CB-CE3 3.82Å; W149-W155 HydrophobicContact CB-CH2 4.09Å; W149-W155 HydrophobicContact CB-CZ2 4.29Å; W149-W155 HydrophobicContact CB-CZ3 3.85Å; W149-W155 AromaticContact CD1-CD1 3.77Å; W149-W155 AromaticContact CD1-CD2 3.73Å; W149-W155 AromaticContact CD1-CE2 3.6Å; W149-W155 AromaticContact CD1-CG 3.83Å; W149-W155 AromaticContact CD1-NE1 3.62Å; W149-W155 HydrophobicContact CG-CD2 4.28Å; W149-W155 HydrophobicContact CG-CZ2 4.43Å
150	K	93.3	Very high	94.8	Very high	116 Å²	116	67.8 Å²	67.8	50%	0.504	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142.4	168	-38.3	-178.6	175.6	-177.8	0	110.2	D148 R152 S153 G154	D148-K150 WeakPolarHBondContact OD2-CE 3.31Å; D148-K150 IonicContact OD2-NZ 3.5Å; K150-R152 VanDerWaalsContact C-N 3.26Å; K150-R152 PolarHBondContact O-N 3.02Å; K150-R152 VanDerWaalsContact O-N 3.11Å; K150-S153 VanDerWaalsContact CB-OG 3.25Å; K150-S153 WeakPolarHBondContact CB-OG 3.41Å; K150-S153 PolarHBondContact O-N 3.19Å; K150-S153 PolarHBondContact O-OG 3.37Å; K150-G154 PolarHBondContact N-O 3.43Å; K150-G154 WeakPolarHBondContact O-CA 3.4Å; K150-G154 PolarHBondContact O-N 2.92Å
151	F	93.5	Very high	94.7	Very high	177 Å²	177	69.7 Å²	69.7	78%	0.776	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-42.8	-177.5	-179.6	-99.9	0	0	0	114	W149	W149-F151 HydrophobicContact CH2-CB 4.02Å; W149-F151 HydrophobicContact CH2-CD2 4.11Å; W149-F151 HydrophobicContact CZ3-CB 4.38Å
152	R	94.5	Very high	94.6	Very high	244 Å²	244	70.5 Å²	70.5	92%	0.921	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-28.4	-178.5	-66	-174.6	-178.9	-86.6	0.4	114	K150	K150-R152 VanDerWaalsContact C-N 3.26Å; K150-R152 PolarHBondContact O-N 3.02Å; K150-R152 VanDerWaalsContact O-N 3.11Å
153	S	91.6	Very high	94.6	Very high	29 Å²	29	70.5 Å²	70.5	20%	0.203	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-16.9	-172.6	55.4	0	0	0	0	114.5	K150	K150-S153 VanDerWaalsContact CB-OG 3.25Å; K150-S153 WeakPolarHBondContact CB-OG 3.41Å; K150-S153 PolarHBondContact O-N 3.19Å; K150-S153 PolarHBondContact O-OG 3.37Å
154	G	93.8	Very high	94.5	Very high	25 Å²	25	74.4 Å²	74.4	26%	0.258	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65	-155.2	-161.8	0	0	0	0	0	111.7	K150	K150-G154 PolarHBondContact N-O 3.43Å; K150-G154 WeakPolarHBondContact O-CA 3.4Å; K150-G154 PolarHBondContact O-N 2.92Å
155	W	92	Very high	94.4	Very high	182 Å²	182	79 Å²	79	69%	0.689	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.6	176.5	-69.7	103.7	0	0	0	111.5	P147 W149	P147-W155 HydrophobicContact CB-CE3 4.28Å; P147-W155 HydrophobicContact CB-CZ3 4.17Å; W149-W155 HydrophobicContact CB-CD2 4.04Å; W149-W155 HydrophobicContact CB-CE3 3.82Å; W149-W155 HydrophobicContact CB-CH2 4.09Å; W149-W155 HydrophobicContact CB-CZ2 4.29Å; W149-W155 HydrophobicContact CB-CZ3 3.85Å; W149-W155 AromaticContact CD1-CD1 3.77Å; W149-W155 AromaticContact CD1-CD2 3.73Å; W149-W155 AromaticContact CD1-CE2 3.6Å; W149-W155 AromaticContact CD1-CG 3.83Å; W149-W155 AromaticContact CD1-NE1 3.62Å; W149-W155 HydrophobicContact CG-CD2 4.28Å; W149-W155 HydrophobicContact CG-CZ2 4.43Å
156	R	93.3	Very high	94.4	Very high	155 Å²	155	78.9 Å²	78.9	59%	0.585	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	159.8	169.7	-67.8	-169.7	173.4	140.8	4.2	109.5	P147 D148	P147-R156 CarbonylContact C-O 3.59Å; D148-R156 PolarHBondContact N-O 2.83Å; D148-R156 PolarHBondContact O-N 2.82Å; D148-R156 VanDerWaalsContact O-O 3.1Å
157	F	94.5	Very high	94.4	Very high	69 Å²	69	77.2 Å²	77.2	30%	0.303	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.7	173.4	-70.8	-93.3	0	0	0	109.2	V145 H146 P147 I186 V190	V145-F157 HydrophobicContact CB-CB 4.41Å; V145-F157 HydrophobicContact CB-CD1 4.29Å; V145-F157 HydrophobicContact CG2-CD1 4Å; H146-F157 WeakPolarHBondContact O-CA 3.42Å; P147-F157 HydrophobicContact CB-CD1 4.2Å; P147-F157 HydrophobicContact CB-CE1 3.86Å; P147-F157 HydrophobicContact CB-CZ 4.37Å; F157-I186 HydrophobicContact CE2-CG2 4.33Å; F157-I186 HydrophobicContact CZ-CG2 3.75Å; F157-V190 HydrophobicContact CB-CG1 4.3Å; F157-V190 HydrophobicContact CD1-CG1 4.27Å; F157-V190 HydrophobicContact CD1-CG2 4.3Å; F157-V190 HydrophobicContact CD2-CG1 4.42Å; F157-V190 HydrophobicContact CD2-CG2 3.38Å; F157-V190 HydrophobicContact CE1-CG2 4.31Å; F157-V190 HydrophobicContact CE2-CG2 3.4Å; F157-V190 HydrophobicContact CG-CG1 4.07Å; F157-V190 HydrophobicContact CG-CG2 3.86Å; F157-V190 HydrophobicContact CZ-CG2 3.89Å
158	K	94.8	Very high	94.4	Very high	68 Å²	68	81.1 Å²	81.1	30%	0.296	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	134.4	168.4	-69.2	-177	-179.6	172.1	0	109.1	V145 H146 D148 W254	V145-K158 CarbonylContact C-O 3.54Å; V145-K158 WeakPolarHBondContact CA-O 3.39Å; V145-K158 WeakPolarHBondContact CB-O 3.27Å; H146-K158 PolarHBondContact N-O 3.46Å; H146-K158 PolarHBondContact O-N 3.35Å; D148-K158 HydrophobicContact CB-CD 4.33Å; D148-K158 HydrophobicContact CB-CG 4.23Å; D148-K158 WeakPolarHBondContact OD2-CE 3.25Å; D148-K158 IonicContact OD2-NZ 3.63Å; K158-W254 HydrophobicContact CB-CH2 4.16Å
159	K	94.9	Very high	94.4	Very high	92 Å²	92	83.4 Å²	83.4	40%	0.4	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	133.1	173.5	-167.1	177.2	-172.1	167.1	0	109.8	L163 D164	K159-L163 HydrophobicContact CD-CB 4.42Å; K159-L163 HydrophobicContact CD-CD2 4.24Å; K159-L163 HydrophobicContact CG-CB 3.98Å; K159-L163 HydrophobicContact CG-CD2 3.56Å; K159-L163 HydrophobicContact CG-CG 4.34Å; K159-D164 WeakPolarHBondContact CE-OD1 3.43Å; K159-D164 WeakPolarHBondContact CE-OD2 3.46Å; K159-D164 IonicContact NZ-OD1 2.84Å; K159-D164 PolarHBondContact NZ-OD1 3.45Å; K159-D164 IonicContact NZ-OD2 2.74Å; K159-D164 PolarHBondContact NZ-OD2 3.11Å
160	R	96.4	Very high	94.5	Very high	3 Å²	3	76.9 Å²	76.9	1%	0.011	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-67.1	142.8	173.7	-166.4	165.1	-177.1	178	13.6	110.6	V143 L144 L163 W254 D260 E262 L263	V143-R160 WeakPolarHBondContact O-CD 3.5Å; V143-R160 PolarHBondContact O-NH1 3Å; L144-R160 WeakPolarHBondContact O-CB 3.47Å; L144-R160 PolarHBondContact O-N 3.38Å; R160-L163 VanDerWaalsContact O-CB 3.29Å; R160-L163 WeakPolarHBondContact O-CB 3.43Å; R160-L163 PolarHBondContact O-N 3.44Å; R160-W254 HydrophobicContact CB-CD2 4.12Å; R160-W254 HydrophobicContact CB-CE3 3.82Å; R160-W254 HydrophobicContact CB-CH2 3.73Å; R160-W254 HydrophobicContact CB-CZ2 3.99Å; R160-W254 HydrophobicContact CB-CZ3 3.6Å; R160-W254 HydrophobicContact CG-CD2 3.77Å; R160-W254 HydrophobicContact CG-CE3 3.99Å; R160-W254 HydrophobicContact CG-CG 4.29Å; R160-W254 HydrophobicContact CG-CH2 4.21Å; R160-W254 HydrophobicContact CG-CZ2 3.96Å; R160-W254 HydrophobicContact CG-CZ3 4.19Å; R160-D260 IonicContact CZ-OD1 3.65Å; R160-D260 IonicContact CZ-OD2 2.74Å; R160-D260 IonicContact NE-OD1 3.3Å; R160-D260 IonicContact NE-OD2 2.88Å; R160-D260 PolarHBondContact NE-OD2 2.78Å; R160-D260 IonicContact NH2-OD1 3.74Å; R160-D260 PolarHBondContact NH2-OD1 3.44Å; R160-D260 IonicContact NH2-OD2 3.24Å; R160-D260 PolarHBondContact NH2-OD2 3.48Å; R160-D260 VanDerWaalsContact NH2-OD2 3.08Å; R160-E262 IonicContact CZ-OE2 3.33Å; R160-E262 IonicContact NH2-OE2 3.11Å; R160-E262 PolarHBondContact NH2-OE2 3.41Å; R160-L263 HydrophobicContact CB-CD1 3.7Å; R160-L263 HydrophobicContact CB-CG 4.5Å; R160-L263 HydrophobicContact CG-CD1 3.62Å; R160-L263 HydrophobicContact CG-CG 3.89Å
161	A	95.6	Very high	94.5	Very high	39 Å²	39	72.3 Å²	72.3	32%	0.322	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	142.4	179.6	0	0	0	0	0	110.8	L163	A161-L163 PolarHBondContact O-N 2.95Å
162	A	94.8	Very high	94.5	Very high	31 Å²	31	67.2 Å²	67.2	26%	0.256	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	13.1	-177.8	0	0	0	0	0	116.9	D164 L165 F166 I264	A162-D164 VanDerWaalsContact C-N 3.32Å; A162-D164 PolarHBondContact O-N 2.9Å; A162-L165 PolarHBondContact O-N 2.9Å; A162-L165 VanDerWaalsContact O-N 3.17Å; A162-F166 WeakPolarHBondContact O-CB 3.39Å; A162-F166 PolarHBondContact O-N 3.47Å; A162-I264 HydrophobicContact CB-CD1 4.03Å; A162-I264 HydrophobicContact CB-CG1 3.64Å
163	L	95.4	Very high	94.5	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-39.1	179.5	177.6	60.2	0	0	0	114.1	L144 K159 R160 A161 F166 L167 M194 L263	L144-L163 HydrophobicContact CB-CD1 4.01Å; L144-L163 HydrophobicContact CB-CD2 4.19Å; L144-L163 HydrophobicContact CD2-CD1 3.61Å; L144-L163 HydrophobicContact CG-CD1 4.24Å; K159-L163 HydrophobicContact CD-CB 4.42Å; K159-L163 HydrophobicContact CD-CD2 4.24Å; K159-L163 HydrophobicContact CG-CB 3.98Å; K159-L163 HydrophobicContact CG-CD2 3.56Å; K159-L163 HydrophobicContact CG-CG 4.34Å; R160-L163 VanDerWaalsContact O-CB 3.29Å; R160-L163 WeakPolarHBondContact O-CB 3.43Å; R160-L163 PolarHBondContact O-N 3.44Å; A161-L163 PolarHBondContact O-N 2.95Å; L163-F166 HydrophobicContact CD1-CD1 4.22Å; L163-F166 WeakPolarHBondContact O-CB 3.22Å; L163-F166 PolarHBondContact O-N 3.43Å; L163-L167 HydrophobicContact CD1-CD1 4.29Å; L163-L167 HydrophobicContact CD1-CG 4.17Å; L163-L167 HydrophobicContact CG-CD1 4.43Å; L163-L167 WeakPolarHBondContact O-CG 3.21Å; L163-L167 PolarHBondContact O-N 2.92Å; L163-M194 HydrophobicContact CD2-CE 3.87Å; L163-M194 HydrophobicContact CD2-CG 3.9Å; L163-M194 HydrophobicContact CD2-SD 3.67Å; L163-M194 HydrophobicContact CG-SD 4.44Å; L163-L263 HydrophobicContact CB-CD1 4.16Å; L163-L263 HydrophobicContact CD1-CD1 4.14Å
164	D	94.3	Very high	94.8	Very high	83 Å²	83	56.9 Å²	56.9	44%	0.444	28%	0.28	S	S	.	.	H	α-helix	trans	-64.1	-45.2	177.6	-67.8	-48.9	0	0	0	112	K159 A162 F166 L167 Q168	K159-D164 WeakPolarHBondContact CE-OD1 3.43Å; K159-D164 WeakPolarHBondContact CE-OD2 3.46Å; K159-D164 IonicContact NZ-OD1 2.84Å; K159-D164 PolarHBondContact NZ-OD1 3.45Å; K159-D164 IonicContact NZ-OD2 2.74Å; K159-D164 PolarHBondContact NZ-OD2 3.11Å; A162-D164 VanDerWaalsContact C-N 3.32Å; A162-D164 PolarHBondContact O-N 2.9Å; D164-F166 VanDerWaalsContact C-N 3.32Å; D164-L167 PolarHBondContact O-N 3.06Å; D164-Q168 VanDerWaalsContact O-CB 3.29Å; D164-Q168 WeakPolarHBondContact O-CB 3.21Å; D164-Q168 PolarHBondContact O-N 2.87Å
165	L	94.9	Very high	94.9	Very high	97 Å²	97	55.8 Å²	55.8	51%	0.508	27%	0.268	S	S	.	.	H	α-helix	trans	-65	-39.9	177.6	-66.6	174.5	0	0	0	110.8	A162 Q168 Q169	A162-L165 PolarHBondContact O-N 2.9Å; A162-L165 VanDerWaalsContact O-N 3.17Å; L165-Q168 PolarHBondContact O-N 3.4Å; L165-Q169 WeakPolarHBondContact O-CB 3.46Å; L165-Q169 WeakPolarHBondContact O-CG 3.38Å; L165-Q169 PolarHBondContact O-N 3.21Å
166	F	96.3	Very high	95.2	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.009	24%	0.235	C	C	.	.	H	α-helix	trans	-57	-52.1	175.1	171.5	-90.8	0	0	0	111.3	L136 L138 L144 A162 L163 D164 Q169 L170 L263 L266 A267 L270	L136-F166 HydrophobicContact CD2-CZ 4.39Å; L138-F166 HydrophobicContact CD1-CE1 3.73Å; L138-F166 HydrophobicContact CD1-CZ 4.14Å; L138-F166 HydrophobicContact CD2-CE1 4.31Å; L138-F166 HydrophobicContact CD2-CZ 3.97Å; L144-F166 HydrophobicContact CD2-CE1 4.17Å; A162-F166 WeakPolarHBondContact O-CB 3.39Å; A162-F166 PolarHBondContact O-N 3.47Å; L163-F166 HydrophobicContact CD1-CD1 4.22Å; L163-F166 WeakPolarHBondContact O-CB 3.22Å; L163-F166 PolarHBondContact O-N 3.43Å; D164-F166 VanDerWaalsContact C-N 3.32Å; F166-Q169 PolarHBondContact O-N 2.96Å; F166-L170 HydrophobicContact CD1-CD1 4.15Å; F166-L170 HydrophobicContact CD2-CD1 3.75Å; F166-L170 HydrophobicContact CE1-CD1 3.75Å; F166-L170 HydrophobicContact CE2-CD1 3.29Å; F166-L170 HydrophobicContact CG-CD1 4.14Å; F166-L170 HydrophobicContact CZ-CD1 3.29Å; F166-L170 VanDerWaalsContact O-CG 3.32Å; F166-L170 WeakPolarHBondContact O-CG 3.26Å; F166-L170 PolarHBondContact O-N 2.98Å; F166-L263 HydrophobicContact CD2-CB 4.33Å; F166-L263 HydrophobicContact CD2-CD2 4.34Å; F166-L263 WeakPolarHBondContact CD2-O 3.49Å; F166-L263 HydrophobicContact CE2-CD2 4.39Å; F166-L266 HydrophobicContact CE2-CB 4.26Å; F166-L266 HydrophobicContact CE2-CD2 3.68Å; F166-L266 HydrophobicContact CE2-CG 3.85Å; F166-L266 HydrophobicContact CZ-CD2 3.99Å; F166-L266 HydrophobicContact CZ-CG 4.49Å; F166-A267 HydrophobicContact CD2-CB 3.85Å; F166-A267 HydrophobicContact CE2-CB 4.46Å; F166-L270 HydrophobicContact CE2-CD1 4.22Å; F166-L270 HydrophobicContact CZ-CD1 4.26Å
167	L	96.1	Very high	95.4	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-43.1	179.6	-71	178.8	0	0	0	112	L163 D164 Q169 L170 S171 V176 M194 F200 I201	L163-L167 HydrophobicContact CD1-CD1 4.29Å; L163-L167 HydrophobicContact CD1-CG 4.17Å; L163-L167 HydrophobicContact CG-CD1 4.43Å; L163-L167 WeakPolarHBondContact O-CG 3.21Å; L163-L167 PolarHBondContact O-N 2.92Å; D164-L167 PolarHBondContact O-N 3.06Å; L167-Q169 VanDerWaalsContact C-N 3.33Å; L167-Q169 PolarHBondContact O-N 3.36Å; L167-L170 PolarHBondContact O-N 3.42Å; L167-S171 VanDerWaalsContact O-CB 3.29Å; L167-S171 WeakPolarHBondContact O-CB 3.39Å; L167-S171 PolarHBondContact O-N 3.37Å; L167-V176 HydrophobicContact CD2-CG1 4.34Å; L167-M194 HydrophobicContact CD1-CG 4.31Å; L167-M194 HydrophobicContact CD1-SD 4.33Å; L167-F200 HydrophobicContact CB-CB 3.86Å; L167-F200 HydrophobicContact CB-CD1 4.48Å; L167-F200 HydrophobicContact CB-CD2 4.12Å; L167-F200 HydrophobicContact CB-CG 3.9Å; L167-F200 HydrophobicContact CD1-CB 4.42Å; L167-F200 HydrophobicContact CD1-CD2 4.49Å; L167-I201 HydrophobicContact CD2-CG1 4.46Å
168	Q	94.9	Very high	95.5	Very high	116 Å²	116	36.5 Å²	36.5	54%	0.542	19%	0.193	S	C	.	.	H	α-helix	trans	-62.2	-38.7	178.8	-173	-178.3	18.6	0	0	112.6	D164 L165 P172 F200	D164-Q168 VanDerWaalsContact O-CB 3.29Å; D164-Q168 WeakPolarHBondContact O-CB 3.21Å; D164-Q168 PolarHBondContact O-N 2.87Å; L165-Q168 PolarHBondContact O-N 3.4Å; Q168-P172 WeakPolarHBondContact O-CD 3.41Å; Q168-F200 HydrophobicContact CB-CE1 4.07Å; Q168-F200 HydrophobicContact CB-CZ 4.36Å; Q168-F200 HydrophobicContact CG-CE1 4.3Å
169	Q	94.7	Very high	95.6	Very high	84 Å²	84	33.2 Å²	33.2	39%	0.393	18%	0.179	S	C	.	.	H	α-helix	trans	-74.4	-29.5	-179.2	-75.6	-180	-6.6	0	0	113.4	L165 F166 L167	L165-Q169 WeakPolarHBondContact O-CB 3.46Å; L165-Q169 WeakPolarHBondContact O-CG 3.38Å; L165-Q169 PolarHBondContact O-N 3.21Å; F166-Q169 PolarHBondContact O-N 2.96Å; L167-Q169 VanDerWaalsContact C-N 3.33Å; L167-Q169 PolarHBondContact O-N 3.36Å
170	L	95.1	Very high	95.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-96.8	-30.8	-173	-64.4	175.2	0	0	0	113.6	L136 F166 L167 P172 H173 Y174 L270 R271	L136-L170 HydrophobicContact CD2-CD1 3.79Å; F166-L170 HydrophobicContact CD1-CD1 4.15Å; F166-L170 HydrophobicContact CD2-CD1 3.75Å; F166-L170 HydrophobicContact CE1-CD1 3.75Å; F166-L170 HydrophobicContact CE2-CD1 3.29Å; F166-L170 HydrophobicContact CG-CD1 4.14Å; F166-L170 HydrophobicContact CZ-CD1 3.29Å; F166-L170 VanDerWaalsContact O-CG 3.32Å; F166-L170 WeakPolarHBondContact O-CG 3.26Å; F166-L170 PolarHBondContact O-N 2.98Å; L167-L170 PolarHBondContact O-N 3.42Å; L170-P172 VanDerWaalsContact C-N 3.29Å; L170-P172 VanDerWaalsContact O-N 3.16Å; L170-H173 PolarHBondContact O-N 3.21Å; L170-Y174 HydrophobicContact CB-CD2 4.35Å; L170-Y174 HydrophobicContact CD2-CD2 4.08Å; L170-Y174 HydrophobicContact CD2-CE2 4.14Å; L170-Y174 PolarHBondContact O-N 2.93Å; L170-L270 HydrophobicContact CD1-CB 4.46Å; L170-L270 HydrophobicContact CD1-CD1 3.62Å; L170-L270 HydrophobicContact CD2-CB 3.61Å; L170-L270 HydrophobicContact CD2-CD1 4.3Å; L170-R271 HydrophobicContact CD2-CG 4.19Å
171	S	92.7	Very high	95.6	Very high	20 Å²	20	30.2 Å²	30.2	14%	0.14	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-35.5	-178.8	173.4	0	0	0	0	115.1	L167 H173	L167-S171 VanDerWaalsContact O-CB 3.29Å; L167-S171 WeakPolarHBondContact O-CB 3.39Å; L167-S171 PolarHBondContact O-N 3.37Å; S171-H173 VanDerWaalsContact C-N 3.3Å; S171-H173 PolarHBondContact O-N 3.22Å
172	P	93.2	Very high	95.6	Very high	69 Å²	69	30.4 Å²	30.4	45%	0.448	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.2	176.3	-21.8	34.8	0	0	0	114.5	Y130 Q168 L170	Y130-P172 PolarHBondContact OH-O 3.39Å; Y130-P172 VanDerWaalsContact OH-O 3.11Å; Q168-P172 WeakPolarHBondContact O-CD 3.41Å; L170-P172 VanDerWaalsContact C-N 3.29Å; L170-P172 VanDerWaalsContact O-N 3.16Å
173	H	95.2	Very high	95.5	Very high	57 Å²	57	30 Å²	30	26%	0.264	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-24.6	-172.8	-63.2	-60.6	0	0	0	113.2	P133 L170 S171 A274	P133-H173 WeakPolarHBondContact CD-O 3.49Å; L170-H173 PolarHBondContact O-N 3.21Å; S171-H173 VanDerWaalsContact C-N 3.3Å; S171-H173 PolarHBondContact O-N 3.22Å; H173-A274 HydrophobicContact CB-CB 3.79Å
174	Y	97.2	Very high	95.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.1	-174.7	-70	-88.8	0	0	0	111.6	P132 Y134 L136 L170 V176 L270 A274	P132-Y174 VanDerWaalsContact CB-C 3.42Å; Y134-Y174 HydrophobicContact CD2-CE1 4.45Å; Y134-Y174 HydrophobicContact CG-CD1 4.41Å; Y134-Y174 AromaticContact CG-CE1 3.98Å; Y134-Y174 HydrophobicContact CG-CE1 3.98Å; Y134-Y174 CarbonylContact O-C 3.5Å; Y134-Y174 VanDerWaalsContact O-CA 3.31Å; Y134-Y174 WeakPolarHBondContact O-CA 3.11Å; L136-Y174 HydrophobicContact CB-CD1 3.62Å; L136-Y174 HydrophobicContact CB-CE1 4.47Å; L136-Y174 HydrophobicContact CB-CG 3.82Å; L170-Y174 HydrophobicContact CB-CD2 4.35Å; L170-Y174 HydrophobicContact CD2-CD2 4.08Å; L170-Y174 HydrophobicContact CD2-CE2 4.14Å; L170-Y174 PolarHBondContact O-N 2.93Å; Y174-V176 PolarHBondContact O-N 2.78Å; Y174-L270 HydrophobicContact CE2-CB 4Å; Y174-L270 PolarHBondContact OH-O 3.48Å; Y174-A274 HydrophobicContact CE2-CB 3.78Å
175	E	97	Very high	95.6	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	103.2	160	177.5	-172.8	-125.2	0	0	107.3	Q131 P132 Y134 T135 L136 V177 H202 F203 R226	Q131-E175 PolarHBondContact NE2-OE1 2.63Å; P132-E175 HydrophobicContact CB-CB 4.37Å; P132-E175 VanDerWaalsContact CB-N 3.33Å; P132-E175 HydrophobicContact CG-CB 4.25Å; Y134-E175 PolarHBondContact O-N 3.39Å; T135-E175 WeakPolarHBondContact CA-O 3.44Å; T135-E175 PolarHBondContact OG1-OE2 3.35Å; L136-E175 PolarHBondContact N-O 3.1Å; E175-V177 HydrophobicContact CG-CG2 4.34Å; E175-V177 PolarHBondContact O-N 2.78Å; E175-H202 HydrophobicContact CG-CB 4.1Å; E175-F203 HydrophobicContact CG-CD2 4.4Å; E175-F203 HydrophobicContact CG-CE2 4.45Å; E175-F203 WeakPolarHBondContact OE1-CE2 3.4Å; E175-R226 IonicContact OE1-CZ 3.69Å; E175-R226 IonicContact OE1-NE 3.51Å; E175-R226 PolarHBondContact OE1-NE 2.69Å; E175-R226 IonicContact OE1-NH2 2.76Å; E175-R226 PolarHBondContact OE1-NH2 3.14Å; E175-R226 IonicContact OE2-CZ 3.88Å; E175-R226 IonicContact OE2-NE 2.72Å; E175-R226 PolarHBondContact OE2-NE 3.2Å; E175-R226 IonicContact OE2-NH2 2.72Å
176	V	97.5	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.7	-175.6	-175.7	0	0	0	0	110	L138 L167 Y174 F200 I201 H202 F203	L138-V176 HydrophobicContact CD1-CG1 3.82Å; L167-V176 HydrophobicContact CD2-CG1 4.34Å; Y174-V176 PolarHBondContact O-N 2.78Å; V176-F200 WeakPolarHBondContact CB-O 3.48Å; V176-I201 HydrophobicContact CG1-CG1 4.46Å; V176-H202 PolarHBondContact N-ND1 3.04Å; V176-H202 PolarHBondContact O-N 2.73Å; V176-F203 PolarHBondContact O-N 3.21Å
177	V	97.5	Very high	95.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.4	177.4	-178	0	0	0	0	108.3	L121 T135 L136 V137 L138 E175 Y179 F203 L205	L121-V177 HydrophobicContact CD1-CG2 3.95Å; L121-V177 HydrophobicContact CD2-CG1 4.41Å; T135-V177 HydrophobicContact CG2-CG2 3.82Å; L136-V177 PolarHBondContact O-N 2.82Å; V137-V177 CarbonylContact C-O 3.55Å; V137-V177 VanDerWaalsContact CA-O 3.26Å; V137-V177 WeakPolarHBondContact CA-O 3.41Å; V137-V177 HydrophobicContact CG2-CB 4.42Å; L138-V177 PolarHBondContact N-O 2.74Å; E175-V177 HydrophobicContact CG-CG2 4.34Å; E175-V177 PolarHBondContact O-N 2.78Å; V177-Y179 PolarHBondContact O-N 3.42Å; V177-F203 WeakPolarHBondContact CA-O 3.46Å; V177-F203 HydrophobicContact CG1-CB 4.15Å; V177-F203 HydrophobicContact CG2-CB 4.21Å; V177-F203 HydrophobicContact CG2-CD2 4.27Å; V177-L205 HydrophobicContact CG1-CD1 3.8Å; V177-L205 HydrophobicContact CG1-CG 4.1Å
178	V	97.7	Very high	95.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	119.9	170.1	175.8	0	0	0	0	108.1	L138 M140 L144 L191 I201 F203 R204 L205	L138-V178 CarbonylContact O-C 3.15Å; L138-V178 WeakPolarHBondContact O-CA 3.4Å; M140-V178 HydrophobicContact CB-CG1 3.89Å; L144-V178 HydrophobicContact CD1-CG2 4.36Å; V178-L191 HydrophobicContact CB-CD1 4.15Å; V178-L191 HydrophobicContact CB-CD2 4.3Å; V178-L191 HydrophobicContact CG1-CD1 3.79Å; V178-L191 HydrophobicContact CG1-CD2 3.85Å; V178-L191 HydrophobicContact CG1-CG 4.47Å; V178-L191 HydrophobicContact CG2-CD2 4.13Å; V178-I201 HydrophobicContact CB-CG2 4.34Å; V178-I201 HydrophobicContact CG2-CD1 3.91Å; V178-I201 HydrophobicContact CG2-CG1 4.15Å; V178-I201 HydrophobicContact CG2-CG2 3.81Å; V178-F203 PolarHBondContact N-O 2.94Å; V178-R204 CarbonylContact O-C 3.52Å; V178-L205 PolarHBondContact O-N 3.49Å
179	Y	97	Very high	95.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	97.8	177.6	-165.1	171.6	0	0	0	109.4	L120 V137 L138 V177 L205 A209 T210 K219	L120-Y179 HydrophobicContact CD1-CE1 4.26Å; V137-Y179 HydrophobicContact CG1-CD1 4.07Å; V137-Y179 HydrophobicContact CG1-CG 4.32Å; L138-Y179 PolarHBondContact O-N 3.08Å; V177-Y179 PolarHBondContact O-N 3.42Å; Y179-L205 WeakPolarHBondContact CA-O 3.43Å; Y179-L205 HydrophobicContact CD1-CD1 3.93Å; Y179-L205 HydrophobicContact CD2-CB 3.57Å; Y179-L205 HydrophobicContact CD2-CD1 4.42Å; Y179-L205 HydrophobicContact CE1-CD1 4.22Å; Y179-L205 HydrophobicContact CE2-CB 4.06Å; Y179-L205 HydrophobicContact CG-CB 3.85Å; Y179-L205 HydrophobicContact CG-CD1 4.04Å; Y179-A209 HydrophobicContact CE2-CB 3.93Å; Y179-A209 PolarHBondContact OH-O 2.74Å; Y179-T210 HydrophobicContact CE2-CG2 3.59Å; Y179-T210 WeakPolarHBondContact OH-CA 3.4Å; Y179-T210 PolarHBondContact OH-N 2.85Å; Y179-K219 HydrophobicContact CD1-CB 3.99Å; Y179-K219 HydrophobicContact CD1-CD 4.2Å; Y179-K219 HydrophobicContact CD1-CG 4.15Å; Y179-K219 HydrophobicContact CD2-CD 4.09Å; Y179-K219 HydrophobicContact CD2-CG 4.05Å; Y179-K219 HydrophobicContact CE1-CB 3.62Å; Y179-K219 HydrophobicContact CE1-CG 3.97Å; Y179-K219 HydrophobicContact CE2-CB 4.4Å; Y179-K219 HydrophobicContact CE2-CD 4.4Å; Y179-K219 HydrophobicContact CE2-CG 3.85Å; Y179-K219 HydrophobicContact CG-CD 3.97Å; Y179-K219 HydrophobicContact CG-CG 4.2Å; Y179-K219 VanDerWaalsContact O-CE 3.23Å; Y179-K219 WeakPolarHBondContact O-CE 3.28Å; Y179-K219 PolarHBondContact O-NZ 3.45Å
180	T	96.4	Very high	95.5	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.			trans	-108.5	147.8	-173.3	-174.5	0	0	0	0	113.1	E139 M140 E182 L205 F206 R207	E139-T180 WeakPolarHBondContact OE1-CA 3.45Å; E139-T180 WeakPolarHBondContact OE1-CB 3.35Å; E139-T180 PolarHBondContact OE1-OG1 2.91Å; E139-T180 WeakPolarHBondContact OE2-CA 3.39Å; M140-T180 HydrophobicContact CE-CG2 4.43Å; T180-E182 HydrophobicContact CG2-CB 4Å; T180-E182 PolarHBondContact O-N 3.5Å; T180-E182 PolarHBondContact OG1-N 2.88Å; T180-E182 VanDerWaalsContact OG1-N 3.08Å; T180-L205 PolarHBondContact N-O 2.64Å; T180-F206 HydrophobicContact CG2-CD1 3.79Å; T180-F206 HydrophobicContact CG2-CE1 4.39Å; T180-F206 CarbonylContact O-C 3.58Å; T180-F206 WeakPolarHBondContact O-CA 3.48Å; T180-R207 PolarHBondContact O-N 3.18Å
181	N	93.8	Very high	95.5	Very high	32 Å²	32	30.9 Å²	30.9	17%	0.171	18%	0.175	C	C	.	.	S	Bend	trans	-75.6	-2.1	166.9	-71.7	-20.8	0	0	0	113.1	E139 R207 K219	E139-N181 PolarHBondContact OE2-N 2.89Å; E139-N181 VanDerWaalsContact OE2-N 3.1Å; N181-R207 VanDerWaalsContact O-CZ 3.27Å; N181-R207 PolarHBondContact O-NE 2.8Å; N181-R207 PolarHBondContact O-NH2 2.99Å; N181-K219 WeakPolarHBondContact OD1-CE 3.44Å
182	E	95.2	Very high	95.6	Very high	42 Å²	42	32 Å²	32	20%	0.196	19%	0.185	C	C	.	.	S	Bend	trans	-76.1	146.8	173.2	-67.8	-57.3	155.4	0	0	112.3	M140 T141 T180 F206 R207	M140-E182 HydrophobicContact CE-CB 3.89Å; M140-E182 HydrophobicContact CE-CG 3.6Å; T141-E182 WeakPolarHBondContact OG1-CG 3.45Å; T180-E182 HydrophobicContact CG2-CB 4Å; T180-E182 PolarHBondContact O-N 3.5Å; T180-E182 PolarHBondContact OG1-N 2.88Å; T180-E182 VanDerWaalsContact OG1-N 3.08Å; E182-F206 WeakPolarHBondContact O-CB 3.36Å; E182-R207 PolarHBondContact O-N 2.82Å
183	S	94.4	Very high	95.7	Very high	24 Å²	24	36.1 Å²	36.1	17%	0.168	20%	0.199	C	C	.	.			trans	-66.8	153.8	171.9	68.3	0	0	0	0	110.8	M185 I186 G187	S183-M185 PolarHBondContact O-N 3.05Å; S183-I186 PolarHBondContact O-N 3.31Å; S183-G187 PolarHBondContact O-N 3.21Å
184	V	94.9	Very high	95.6	Very high	66 Å²	66	34.1 Å²	34.1	40%	0.4	19%	0.19	S	C	.	.	H	α-helix	trans	-53.2	-31.1	175.3	66	0	0	0	0	113	I186 G188 F206	V184-I186 VanDerWaalsContact C-N 3.34Å; V184-I186 PolarHBondContact O-N 3.37Å; V184-G188 VanDerWaalsContact O-CA 3.32Å; V184-G188 WeakPolarHBondContact O-CA 3.47Å; V184-G188 PolarHBondContact O-N 3.36Å; V184-F206 HydrophobicContact CB-CB 4.39Å; V184-F206 HydrophobicContact CB-CD1 4.36Å; V184-F206 HydrophobicContact CB-CD2 3.89Å; V184-F206 HydrophobicContact CB-CE2 4.26Å; V184-F206 HydrophobicContact CB-CG 3.95Å; V184-F206 HydrophobicContact CG2-CD2 3.89Å; V184-F206 HydrophobicContact CG2-CE2 3.77Å; V184-F206 HydrophobicContact CG2-CG 4.37Å; V184-F206 HydrophobicContact CG2-CZ 4.14Å
185	M	95.1	Very high	95.4	Very high	155 Å²	155	34.2 Å²	34.2	76%	0.764	19%	0.19	S	C	*	.	H	α-helix	trans	-67.5	-31.8	179.7	-63.6	-58.5	-66	0	0	113.5	S183	S183-M185 PolarHBondContact O-N 3.05Å
186	I	94.3	Very high	95.3	Very high	80 Å²	80	39.2 Å²	39.2	41%	0.41	22%	0.223	S	C	.	.	H	α-helix	trans	-95.3	-52.3	-179.9	-62.6	176	0	0	0	109.7	F157 S183 V184 V190	F157-I186 HydrophobicContact CE2-CG2 4.33Å; F157-I186 HydrophobicContact CZ-CG2 3.75Å; S183-I186 PolarHBondContact O-N 3.31Å; V184-I186 VanDerWaalsContact C-N 3.34Å; V184-I186 PolarHBondContact O-N 3.37Å; I186-V190 WeakPolarHBondContact O-CG2 3.22Å
187	G	94.4	Very high	95	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-74.8	-32.4	-174.4	0	0	0	0	0	113.9	S183 V190 L191	S183-G187 PolarHBondContact O-N 3.21Å; G187-V190 PolarHBondContact O-N 2.75Å; G187-L191 WeakPolarHBondContact O-CG 3.31Å; G187-L191 PolarHBondContact O-N 3.37Å
188	G	95.5	Very high	94.8	Very high	15 Å²	15	48.2 Å²	48.2	16%	0.155	28%	0.276	C	S	.	.	H	α-helix	trans	-56.6	-54.9	-177.1	0	0	0	0	0	113.1	V184 V190 L191 A192	V184-G188 VanDerWaalsContact O-CA 3.32Å; V184-G188 WeakPolarHBondContact O-CA 3.47Å; V184-G188 PolarHBondContact O-N 3.36Å; G188-V190 VanDerWaalsContact C-N 3.29Å; G188-V190 PolarHBondContact O-N 2.95Å; G188-L191 PolarHBondContact O-N 3.2Å; G188-A192 WeakPolarHBondContact O-CB 3.23Å; G188-A192 PolarHBondContact O-N 2.95Å
189	P	95.6	Very high	94.6	Very high	70 Å²	70	53.4 Å²	53.4	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-32	176.6	-25.5	35.3	0	0	0	114.2	Q193	P189-Q193 WeakPolarHBondContact O-CG 3.23Å; P189-Q193 PolarHBondContact O-N 3.06Å; P189-Q193 VanDerWaalsContact O-N 3.14Å; P189-Q193 PolarHBondContact O-NE2 3.32Å
190	V	95.3	Very high	94.5	Very high	17 Å²	17	55.5 Å²	55.5	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-70.7	-46.9	179.5	178	0	0	0	0	110.6	M140 V145 F157 I186 G187 G188 A192 Q193 M194	M140-V190 HydrophobicContact SD-CB 4.2Å; M140-V190 HydrophobicContact SD-CG1 4.03Å; V145-V190 HydrophobicContact CG1-CG1 4.45Å; V145-V190 HydrophobicContact CG2-CG1 4.1Å; F157-V190 HydrophobicContact CB-CG1 4.3Å; F157-V190 HydrophobicContact CD1-CG1 4.27Å; F157-V190 HydrophobicContact CD1-CG2 4.3Å; F157-V190 HydrophobicContact CD2-CG1 4.42Å; F157-V190 HydrophobicContact CD2-CG2 3.38Å; F157-V190 HydrophobicContact CE1-CG2 4.31Å; F157-V190 HydrophobicContact CE2-CG2 3.4Å; F157-V190 HydrophobicContact CG-CG1 4.07Å; F157-V190 HydrophobicContact CG-CG2 3.86Å; F157-V190 HydrophobicContact CZ-CG2 3.89Å; I186-V190 WeakPolarHBondContact O-CG2 3.22Å; G187-V190 PolarHBondContact O-N 2.75Å; G188-V190 VanDerWaalsContact C-N 3.29Å; G188-V190 PolarHBondContact O-N 2.95Å; V190-A192 VanDerWaalsContact C-N 3.33Å; V190-A192 PolarHBondContact O-N 3.46Å; V190-Q193 PolarHBondContact O-N 2.8Å; V190-M194 WeakPolarHBondContact O-CB 3.37Å; V190-M194 PolarHBondContact O-N 3.39Å
191	L	95.9	Very high	94.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66	-35.5	176.7	-65.7	175.8	0	0	0	112.3	M140 V178 G187 G188 Q193 M194 D195 I201 R204 F206	M140-L191 HydrophobicContact CG-CD2 3.97Å; M140-L191 HydrophobicContact SD-CD1 4.32Å; M140-L191 HydrophobicContact SD-CD2 3.71Å; M140-L191 HydrophobicContact SD-CG 3.73Å; V178-L191 HydrophobicContact CB-CD1 4.15Å; V178-L191 HydrophobicContact CB-CD2 4.3Å; V178-L191 HydrophobicContact CG1-CD1 3.79Å; V178-L191 HydrophobicContact CG1-CD2 3.85Å; V178-L191 HydrophobicContact CG1-CG 4.47Å; V178-L191 HydrophobicContact CG2-CD2 4.13Å; G187-L191 WeakPolarHBondContact O-CG 3.31Å; G187-L191 PolarHBondContact O-N 3.37Å; G188-L191 PolarHBondContact O-N 3.2Å; L191-Q193 VanDerWaalsContact C-N 3.3Å; L191-Q193 PolarHBondContact O-N 2.81Å; L191-M194 HydrophobicContact CD2-CE 4.15Å; L191-M194 HydrophobicContact CD2-SD 4.3Å; L191-M194 PolarHBondContact O-N 3.38Å; L191-D195 PolarHBondContact O-N 2.88Å; L191-I201 HydrophobicContact CD2-CD1 4.28Å; L191-R204 HydrophobicContact CD1-CB 4.13Å; L191-R204 HydrophobicContact CD1-CG 4.02Å; L191-F206 HydrophobicContact CD1-CE1 3.97Å; L191-F206 HydrophobicContact CD1-CZ 4.26Å
192	A	95.2	Very high	94.5	Very high	42 Å²	42	58.1 Å²	58.1	35%	0.347	32%	0.321	S	S	.	.	H	α-helix	trans	-65.2	-31.8	173.5	0	0	0	0	0	112.9	G188 V190 P196	G188-A192 WeakPolarHBondContact O-CB 3.23Å; G188-A192 PolarHBondContact O-N 2.95Å; V190-A192 VanDerWaalsContact C-N 3.33Å; V190-A192 PolarHBondContact O-N 3.46Å; A192-P196 WeakPolarHBondContact O-CA 3.42Å
193	Q	93.5	Very high	94.5	Very high	156 Å²	156	59.1 Å²	59.1	73%	0.729	32%	0.324	S	S	*	.	H	α-helix	trans	-79	-29.5	173.6	-74.1	174.1	57.3	0	0	112.8	P189 V190 L191	P189-Q193 WeakPolarHBondContact O-CG 3.23Å; P189-Q193 PolarHBondContact O-N 3.06Å; P189-Q193 VanDerWaalsContact O-N 3.14Å; P189-Q193 PolarHBondContact O-NE2 3.32Å; V190-Q193 PolarHBondContact O-N 2.8Å; L191-Q193 VanDerWaalsContact C-N 3.3Å; L191-Q193 PolarHBondContact O-N 2.81Å
194	M	93.1	Very high	94.6	Very high	15 Å²	15	62.1 Å²	62.1	7%	0.074	33%	0.332	C	S	.	.	H	α-helix	trans	-71.3	-43.1	179	-175.6	-176.1	-57	0	0	112.3	L144 V145 L163 L167 V190 L191 I201	L144-M194 HydrophobicContact CB-CE 4.19Å; L144-M194 HydrophobicContact CD1-SD 4.25Å; V145-M194 HydrophobicContact CG1-CE 3.39Å; V145-M194 HydrophobicContact CG2-CE 4.37Å; L163-M194 HydrophobicContact CD2-CE 3.87Å; L163-M194 HydrophobicContact CD2-CG 3.9Å; L163-M194 HydrophobicContact CD2-SD 3.67Å; L163-M194 HydrophobicContact CG-SD 4.44Å; L167-M194 HydrophobicContact CD1-CG 4.31Å; L167-M194 HydrophobicContact CD1-SD 4.33Å; V190-M194 WeakPolarHBondContact O-CB 3.37Å; V190-M194 PolarHBondContact O-N 3.39Å; L191-M194 HydrophobicContact CD2-CE 4.15Å; L191-M194 HydrophobicContact CD2-SD 4.3Å; L191-M194 PolarHBondContact O-N 3.38Å; M194-I201 HydrophobicContact SD-CD1 4.13Å
195	D	94.8	Very high	94.6	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.016	32%	0.317	C	S	.	.	S	Bend	trans	-129.1	78.8	175.9	-176.5	8.8	0	0	0	109.8	L191 Q197 G198 Q199 F200 I201 R204	L191-D195 PolarHBondContact O-N 2.88Å; D195-Q197 PolarHBondContact O-N 3.11Å; D195-G198 VanDerWaalsContact CG-CA 3.5Å; D195-G198 PolarHBondContact O-N 2.91Å; D195-G198 WeakPolarHBondContact OD1-CA 3.37Å; D195-G198 PolarHBondContact OD1-N 3.18Å; D195-G198 VanDerWaalsContact OD2-C 3.25Å; D195-G198 VanDerWaalsContact OD2-CA 3.29Å; D195-G198 WeakPolarHBondContact OD2-CA 3.32Å; D195-Q199 PolarHBondContact OD1-N 3.39Å; D195-Q199 PolarHBondContact OD2-N 2.67Å; D195-Q199 VanDerWaalsContact OD2-N 3.08Å; D195-F200 PolarHBondContact OD2-N 2.99Å; D195-I201 HydrophobicContact CB-CD1 4.02Å; D195-I201 HydrophobicContact CB-CG1 4.37Å; D195-I201 PolarHBondContact OD2-N 2.75Å; D195-R204 PolarHBondContact O-NH2 3.18Å
196	P	93.5	Very high	94.7	Very high	106 Å²	106	53.9 Å²	53.9	69%	0.688	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.8	-175.9	-23.2	34.6	0	0	0	113.9	A192	A192-P196 WeakPolarHBondContact O-CA 3.42Å
197	Q	92.7	Very high	94.6	Very high	147 Å²	147	54.8 Å²	54.8	69%	0.687	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.7	-179.4	-64.2	-177	-29.3	0	0	112.3	D195 Q199	D195-Q197 PolarHBondContact O-N 3.11Å; Q197-Q199 HydrophobicContact CB-CG 3.75Å; Q197-Q199 PolarHBondContact O-N 3.04Å
198	G	92.1	Very high	94.4	Very high	42 Å²	42	59.9 Å²	59.9	43%	0.433	31%	0.31	S	S	.	.			trans	62.6	31.3	-176.3	0	0	0	0	0	112.6	D195	D195-G198 VanDerWaalsContact CG-CA 3.5Å; D195-G198 PolarHBondContact O-N 2.91Å; D195-G198 WeakPolarHBondContact OD1-CA 3.37Å; D195-G198 PolarHBondContact OD1-N 3.18Å; D195-G198 VanDerWaalsContact OD2-C 3.25Å; D195-G198 VanDerWaalsContact OD2-CA 3.29Å; D195-G198 WeakPolarHBondContact OD2-CA 3.32Å
199	Q	92.9	Very high	94.3	Very high	109 Å²	109	59.8 Å²	59.8	51%	0.509	31%	0.307	S	S	.	.	S	Bend	trans	-83.9	-26.6	-173.7	-77.2	176.5	-2.8	0	0	113.2	D195 Q197	D195-Q199 PolarHBondContact OD1-N 3.39Å; D195-Q199 PolarHBondContact OD2-N 2.67Å; D195-Q199 VanDerWaalsContact OD2-N 3.08Å; Q197-Q199 HydrophobicContact CB-CG 3.75Å; Q197-Q199 PolarHBondContact O-N 3.04Å
200	F	95.1	Very high	94.1	Very high	45 Å²	45	56.6 Å²	56.6	20%	0.197	29%	0.286	C	S	.	.	S	Bend	trans	-110.2	-45	-172	-51	-62.1	0	0	0	111.7	L167 Q168 V176 D195 H202	L167-F200 HydrophobicContact CB-CB 3.86Å; L167-F200 HydrophobicContact CB-CD1 4.48Å; L167-F200 HydrophobicContact CB-CD2 4.12Å; L167-F200 HydrophobicContact CB-CG 3.9Å; L167-F200 HydrophobicContact CD1-CB 4.42Å; L167-F200 HydrophobicContact CD1-CD2 4.49Å; Q168-F200 HydrophobicContact CB-CE1 4.07Å; Q168-F200 HydrophobicContact CB-CZ 4.36Å; Q168-F200 HydrophobicContact CG-CE1 4.3Å; V176-F200 WeakPolarHBondContact CB-O 3.48Å; D195-F200 PolarHBondContact OD2-N 2.99Å; F200-H202 PolarHBondContact O-ND1 2.92Å
201	I	95.9	Very high	93.8	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.036	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	110.5	-176.8	-59.3	168.5	0	0	0	109.2	L167 V176 V178 L191 M194 D195 F203 R204	L167-I201 HydrophobicContact CD2-CG1 4.46Å; V176-I201 HydrophobicContact CG1-CG1 4.46Å; V178-I201 HydrophobicContact CB-CG2 4.34Å; V178-I201 HydrophobicContact CG2-CD1 3.91Å; V178-I201 HydrophobicContact CG2-CG1 4.15Å; V178-I201 HydrophobicContact CG2-CG2 3.81Å; L191-I201 HydrophobicContact CD2-CD1 4.28Å; M194-I201 HydrophobicContact SD-CD1 4.13Å; D195-I201 HydrophobicContact CB-CD1 4.02Å; D195-I201 HydrophobicContact CB-CG1 4.37Å; D195-I201 PolarHBondContact OD2-N 2.75Å; I201-F203 WeakPolarHBondContact CG2-O 3.4Å; I201-R204 HydrophobicContact CG2-CG 3.92Å
202	H	94.4	Very high	93.4	Very high	79 Å²	79	62.8 Å²	62.8	37%	0.366	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-44	-175.7	-64.3	65.6	0	0	0	111.7	E175 V176 F200	E175-H202 HydrophobicContact CG-CB 4.1Å; V176-H202 PolarHBondContact N-ND1 3.04Å; V176-H202 PolarHBondContact O-N 2.73Å; F200-H202 PolarHBondContact O-ND1 2.92Å
203	F	95.9	Very high	92.9	Very high	63 Å²	63	67.3 Å²	67.3	28%	0.276	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	149.4	-179.5	-61.4	-77.2	0	0	0	112	L121 P122 E175 V176 V177 V178 I201	L121-F203 HydrophobicContact CD1-CD2 4.45Å; L121-F203 HydrophobicContact CD2-CB 3.68Å; L121-F203 HydrophobicContact CD2-CD1 4.14Å; L121-F203 HydrophobicContact CD2-CD2 3.94Å; L121-F203 HydrophobicContact CD2-CG 3.65Å; P122-F203 HydrophobicContact CG-CE1 3.68Å; P122-F203 HydrophobicContact CG-CZ 3.53Å; E175-F203 HydrophobicContact CG-CD2 4.4Å; E175-F203 HydrophobicContact CG-CE2 4.45Å; E175-F203 WeakPolarHBondContact OE1-CE2 3.4Å; V176-F203 PolarHBondContact O-N 3.21Å; V177-F203 WeakPolarHBondContact CA-O 3.46Å; V177-F203 HydrophobicContact CG1-CB 4.15Å; V177-F203 HydrophobicContact CG2-CB 4.21Å; V177-F203 HydrophobicContact CG2-CD2 4.27Å; V178-F203 PolarHBondContact N-O 2.94Å; I201-F203 WeakPolarHBondContact CG2-O 3.4Å
204	R	96.3	Very high	92.4	Very high	88 Å²	88	63.8 Å²	63.8	33%	0.332	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	112.4	-178.5	-56.2	174	-172.8	176.3	-0.9	108.4	V178 L191 D195 I201 F206	V178-R204 CarbonylContact O-C 3.52Å; L191-R204 HydrophobicContact CD1-CB 4.13Å; L191-R204 HydrophobicContact CD1-CG 4.02Å; D195-R204 PolarHBondContact O-NH2 3.18Å; I201-R204 HydrophobicContact CG2-CG 3.92Å; R204-F206 HydrophobicContact CB-CE2 4.01Å; R204-F206 HydrophobicContact CB-CZ 3.9Å
205	L	96	Very high	91.9	Very high	17 Å²	17	65.4 Å²	65.4	9%	0.089	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.3	177.4	-59.9	175.9	0	0	0	108.6	L120 L121 V177 V178 Y179 T180 A209 L224	L120-L205 HydrophobicContact CB-CD1 4.2Å; L120-L205 HydrophobicContact CB-CD2 4.12Å; L120-L205 HydrophobicContact CD1-CD1 4.17Å; L121-L205 HydrophobicContact CD2-CD1 4.28Å; L121-L205 HydrophobicContact CD2-CD2 4.4Å; V177-L205 HydrophobicContact CG1-CD1 3.8Å; V177-L205 HydrophobicContact CG1-CG 4.1Å; V178-L205 PolarHBondContact O-N 3.49Å; Y179-L205 WeakPolarHBondContact CA-O 3.43Å; Y179-L205 HydrophobicContact CD1-CD1 3.93Å; Y179-L205 HydrophobicContact CD2-CB 3.57Å; Y179-L205 HydrophobicContact CD2-CD1 4.42Å; Y179-L205 HydrophobicContact CE1-CD1 4.22Å; Y179-L205 HydrophobicContact CE2-CB 4.06Å; Y179-L205 HydrophobicContact CG-CB 3.85Å; Y179-L205 HydrophobicContact CG-CD1 4.04Å; T180-L205 PolarHBondContact N-O 2.64Å; L205-A209 HydrophobicContact CB-CB 4.17Å; L205-A209 HydrophobicContact CD2-CB 4.31Å; L205-L224 HydrophobicContact CD1-CD2 3.47Å; L205-L224 VanDerWaalsContact CD1-CD2 3.47Å
206	F	95.5	Very high	91.6	Very high	30 Å²	30	71 Å²	71	13%	0.132	37%	0.371	C	S	.	.			trans	-114.7	-176.6	-174.8	-59.6	-76.2	0	0	0	110.4	T180 E182 V184 L191 R204 E208 A209	T180-F206 HydrophobicContact CG2-CD1 3.79Å; T180-F206 HydrophobicContact CG2-CE1 4.39Å; T180-F206 CarbonylContact O-C 3.58Å; T180-F206 WeakPolarHBondContact O-CA 3.48Å; E182-F206 WeakPolarHBondContact O-CB 3.36Å; V184-F206 HydrophobicContact CB-CB 4.39Å; V184-F206 HydrophobicContact CB-CD1 4.36Å; V184-F206 HydrophobicContact CB-CD2 3.89Å; V184-F206 HydrophobicContact CB-CE2 4.26Å; V184-F206 HydrophobicContact CB-CG 3.95Å; V184-F206 HydrophobicContact CG2-CD2 3.89Å; V184-F206 HydrophobicContact CG2-CE2 3.77Å; V184-F206 HydrophobicContact CG2-CG 4.37Å; V184-F206 HydrophobicContact CG2-CZ 4.14Å; L191-F206 HydrophobicContact CD1-CE1 3.97Å; L191-F206 HydrophobicContact CD1-CZ 4.26Å; R204-F206 HydrophobicContact CB-CE2 4.01Å; R204-F206 HydrophobicContact CB-CZ 3.9Å; F206-E208 WeakPolarHBondContact CB-OE2 3.37Å; F206-E208 PolarHBondContact O-N 3.48Å; F206-A209 WeakPolarHBondContact O-CB 3.45Å; F206-A209 PolarHBondContact O-N 2.93Å
207	R	93.4	Very high	91.5	Very high	100 Å²	100	68.6 Å²	68.6	38%	0.377	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-48.5	-37.1	178.1	-172.9	178	-64.2	-179.6	3.1	113.2	T180 N181 E182 A209 T210 H217	T180-R207 PolarHBondContact O-N 3.18Å; N181-R207 VanDerWaalsContact O-CZ 3.27Å; N181-R207 PolarHBondContact O-NE 2.8Å; N181-R207 PolarHBondContact O-NH2 2.99Å; E182-R207 PolarHBondContact O-N 2.82Å; R207-A209 PolarHBondContact O-N 3.37Å; R207-T210 WeakPolarHBondContact O-CB 3.47Å; R207-T210 PolarHBondContact O-N 2.81Å; R207-T210 PolarHBondContact O-OG1 3.39Å; R207-H217 VanDerWaalsContact CG-CE1 3.43Å; R207-H217 WeakPolarHBondContact CG-CE1 3.41Å
208	E	90.5	Very high	91.5	Very high	107 Å²	107	61.7 Å²	61.7	50%	0.5	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-64.3	-17.8	-178.9	-60.1	81.3	-179.8	0	0	113.4	F206	F206-E208 WeakPolarHBondContact CB-OE2 3.37Å; F206-E208 PolarHBondContact O-N 3.48Å
209	A	92.6	Very high	91.7	Very high	12 Å²	12	59.7 Å²	59.7	10%	0.099	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-88.5	-12.1	174.2	0	0	0	0	0	113.5	P115 L120 Y179 L205 F206 R207	P115-A209 WeakPolarHBondContact CB-O 3.39Å; L120-A209 HydrophobicContact CD1-CB 4.21Å; L120-A209 HydrophobicContact CD2-CB 3.87Å; Y179-A209 HydrophobicContact CE2-CB 3.93Å; Y179-A209 PolarHBondContact OH-O 2.74Å; L205-A209 HydrophobicContact CB-CB 4.17Å; L205-A209 HydrophobicContact CD2-CB 4.31Å; F206-A209 WeakPolarHBondContact O-CB 3.45Å; F206-A209 PolarHBondContact O-N 2.93Å; R207-A209 PolarHBondContact O-N 3.37Å
210	T	91.8	Very high	91.7	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.018	28%	0.276	C	S	.	.	S	Bend	trans	-80.8	153.3	-177.9	68.5	0	0	0	0	112.2	Y179 R207 H217 K219	Y179-T210 HydrophobicContact CE2-CG2 3.59Å; Y179-T210 WeakPolarHBondContact OH-CA 3.4Å; Y179-T210 PolarHBondContact OH-N 2.85Å; R207-T210 WeakPolarHBondContact O-CB 3.47Å; R207-T210 PolarHBondContact O-N 2.81Å; R207-T210 PolarHBondContact O-OG1 3.39Å; T210-H217 HydrophobicContact CG2-CB 4.39Å; T210-H217 PolarHBondContact OG1-ND1 2.64Å; T210-K219 HydrophobicContact CG2-CG 4.07Å
211	R	89.5	Confident	91.7	Very high	71 Å²	71	53 Å²	53	27%	0.268	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.2	168.1	-66.8	-173.6	-177.8	-77.8	-2.1	109.8	D114 P115 I218 D220 C223	D114-R211 IonicContact OD1-NH1 2.8Å; D114-R211 IonicContact OD2-NH1 3.68Å; P115-R211 HydrophobicContact CG-CG 4.2Å; R211-I218 PolarHBondContact N-O 3.19Å; R211-I218 PolarHBondContact O-N 3.01Å; R211-D220 HydrophobicContact CG-CB 4.33Å; R211-D220 IonicContact CZ-OD2 3.58Å; R211-D220 IonicContact NE-OD2 2.73Å; R211-D220 PolarHBondContact NE-OD2 3.11Å; R211-D220 IonicContact NH2-OD2 3.5Å; R211-D220 PolarHBondContact NH2-OD2 3.06Å; R211-C223 PolarHBondContact NH2-SG 3.29Å; R211-C223 VanDerWaalsContact NH2-SG 3.41Å
212	Y	87.4	Confident	91.6	Very high	77 Å²	77	56 Å²	56	30%	0.302	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	109.1	175.4	-172	-98.8	0	0	0	111.1	Q110 K113 G215 K216 H217	Q110-Y212 PolarHBondContact NE2-O 3.36Å; K113-Y212 HydrophobicContact CD-CD1 3.77Å; K113-Y212 HydrophobicContact CD-CE1 4.44Å; K113-Y212 HydrophobicContact CG-CD1 4.25Å; Y212-G215 WeakPolarHBondContact OH-CA 3.22Å; Y212-K216 WeakPolarHBondContact CA-O 3.4Å; Y212-H217 AromaticContact CD2-CD2 4Å; Y212-H217 AromaticContact CD2-CE1 3.66Å; Y212-H217 AromaticContact CD2-ND1 3.95Å; Y212-H217 AromaticContact CD2-NE2 3.69Å; Y212-H217 AromaticContact CE2-NE2 3.94Å
213	K	84.2	Confident	91.5	Very high	136 Å²	136	52.4 Å²	52.4	59%	0.591	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.6	-178.9	-172.2	178.6	-179.4	178.3	0	110.4	G215 K216 I218	K213-G215 PolarHBondContact O-N 3.01Å; K213-K216 PolarHBondContact N-O 3.16Å; K213-K216 PolarHBondContact O-N 3.19Å; K213-K216 VanDerWaalsContact O-N 3.09Å; K213-I218 HydrophobicContact CB-CD1 3.79Å; K213-I218 HydrophobicContact CD-CD1 4.38Å
214	G	82.1	Confident	91.4	Very high	82 Å²	82	49.4 Å²	49.4	85%	0.845	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	29.4	175.8	0	0	0	0	0	114.7	K216	G214-K216 VanDerWaalsContact C-N 3.32Å
215	G	84.1	Confident	91.4	Very high	49 Å²	49	47.3 Å²	47.3	51%	0.505	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	4.1	-178.8	0	0	0	0	0	115	Y212 K213	Y212-G215 WeakPolarHBondContact OH-CA 3.22Å; K213-G215 PolarHBondContact O-N 3.01Å
216	K	88.5	Confident	91.3	Very high	122 Å²	122	48 Å²	48	53%	0.53	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148.9	-178.6	-59.7	-170.7	-178.5	-174.3	0	111.1	Y212 K213 G214 A239	Y212-K216 WeakPolarHBondContact CA-O 3.4Å; K213-K216 PolarHBondContact N-O 3.16Å; K213-K216 PolarHBondContact O-N 3.19Å; K213-K216 VanDerWaalsContact O-N 3.09Å; G214-K216 VanDerWaalsContact C-N 3.32Å; K216-A239 HydrophobicContact CD-CB 3.85Å
217	H	91.1	Very high	91.3	Very high	54 Å²	54	51.4 Å²	51.4	25%	0.25	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.3	170.3	-72.1	-81.9	0	0	0	109	R207 T210 Y212	R207-H217 VanDerWaalsContact CG-CE1 3.43Å; R207-H217 WeakPolarHBondContact CG-CE1 3.41Å; T210-H217 HydrophobicContact CG2-CB 4.39Å; T210-H217 PolarHBondContact OG1-ND1 2.64Å; Y212-H217 AromaticContact CD2-CD2 4Å; Y212-H217 AromaticContact CD2-CE1 3.66Å; Y212-H217 AromaticContact CD2-ND1 3.95Å; Y212-H217 AromaticContact CD2-NE2 3.69Å; Y212-H217 AromaticContact CE2-NE2 3.94Å
218	I	92.8	Very high	91.5	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.8	-178.6	-51.5	177.7	0	0	0	108.1	R211 K213 D220 Q242 L243	R211-I218 PolarHBondContact N-O 3.19Å; R211-I218 PolarHBondContact O-N 3.01Å; K213-I218 HydrophobicContact CB-CD1 3.79Å; K213-I218 HydrophobicContact CD-CD1 4.38Å; I218-D220 PolarHBondContact O-N 2.97Å; I218-Q242 HydrophobicContact CG2-CB 4.27Å; I218-L243 HydrophobicContact CG2-CB 4.41Å; I218-L243 HydrophobicContact CG2-CD1 3.79Å; I218-L243 HydrophobicContact CG2-CG 3.77Å
219	K	95	Very high	91.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.249	C	C	.	.			trans	-94.3	100.8	-179.7	-65.2	173.8	-168.7	171.9	0	108.6	E139 Y179 N181 T210 L221 F233 D235 A240	E139-K219 WeakPolarHBondContact OE2-CE 3.34Å; E139-K219 IonicContact OE2-NZ 3.64Å; E139-K219 PolarHBondContact OE2-NZ 3.46Å; Y179-K219 HydrophobicContact CD1-CB 3.99Å; Y179-K219 HydrophobicContact CD1-CD 4.2Å; Y179-K219 HydrophobicContact CD1-CG 4.15Å; Y179-K219 HydrophobicContact CD2-CD 4.09Å; Y179-K219 HydrophobicContact CD2-CG 4.05Å; Y179-K219 HydrophobicContact CE1-CB 3.62Å; Y179-K219 HydrophobicContact CE1-CG 3.97Å; Y179-K219 HydrophobicContact CE2-CB 4.4Å; Y179-K219 HydrophobicContact CE2-CD 4.4Å; Y179-K219 HydrophobicContact CE2-CG 3.85Å; Y179-K219 HydrophobicContact CG-CD 3.97Å; Y179-K219 HydrophobicContact CG-CG 4.2Å; Y179-K219 VanDerWaalsContact O-CE 3.23Å; Y179-K219 WeakPolarHBondContact O-CE 3.28Å; Y179-K219 PolarHBondContact O-NZ 3.45Å; N181-K219 WeakPolarHBondContact OD1-CE 3.44Å; T210-K219 HydrophobicContact CG2-CG 4.07Å; K219-L221 PolarHBondContact O-N 2.85Å; K219-F233 HydrophobicContact CB-CZ 4.36Å; K219-F233 HydrophobicContact CD-CE1 4.46Å; K219-F233 HydrophobicContact CD-CE2 4.05Å; K219-F233 HydrophobicContact CD-CZ 3.58Å; K219-D235 IonicContact NZ-OD2 2.69Å; K219-D235 PolarHBondContact NZ-OD2 3.47Å; K219-A240 HydrophobicContact CD-CB 4.21Å; K219-A240 HydrophobicContact CG-CB 4.49Å; K219-A240 PolarHBondContact N-O 2.64Å
220	D	93.9	Very high	92	Very high	13 Å²	13	49 Å²	49	7%	0.07	26%	0.264	C	S	.	.			trans	-79.4	107.5	178.3	-169.8	-4.9	0	0	0	110.4	R211 I218 S222 C223 L243 Q244	R211-D220 HydrophobicContact CG-CB 4.33Å; R211-D220 IonicContact CZ-OD2 3.58Å; R211-D220 IonicContact NE-OD2 2.73Å; R211-D220 PolarHBondContact NE-OD2 3.11Å; R211-D220 IonicContact NH2-OD2 3.5Å; R211-D220 PolarHBondContact NH2-OD2 3.06Å; I218-D220 PolarHBondContact O-N 2.97Å; D220-S222 PolarHBondContact O-N 2.91Å; D220-S222 WeakPolarHBondContact OD1-CB 3.47Å; D220-S222 PolarHBondContact OD1-N 2.73Å; D220-S222 PolarHBondContact OD1-OG 2.91Å; D220-S222 PolarHBondContact OD2-OG 2.91Å; D220-C223 PolarHBondContact O-N 3.27Å; D220-L243 HydrophobicContact CB-CD1 3.67Å; D220-Q244 PolarHBondContact OD1-NE2 2.7Å
221	L	95.4	Very high	92.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-72.7	-20.4	-180	-55.4	-177.4	0	0	0	112.2	V137 K219 C223 L224 L228 V231 F233 Q244 N247	V137-L221 HydrophobicContact CG1-CD2 4.38Å; V137-L221 HydrophobicContact CG2-CD2 4.42Å; K219-L221 PolarHBondContact O-N 2.85Å; L221-C223 PolarHBondContact O-N 2.86Å; L221-L224 HydrophobicContact CB-CD1 4.18Å; L221-L224 HydrophobicContact CD2-CD1 3.8Å; L221-L224 WeakPolarHBondContact O-CB 3.43Å; L221-L224 WeakPolarHBondContact O-CG 3.47Å; L221-L224 PolarHBondContact O-N 3.22Å; L221-L224 VanDerWaalsContact O-N 3.09Å; L221-L228 HydrophobicContact CB-CD2 3.83Å; L221-V231 HydrophobicContact CD1-CG1 4.25Å; L221-F233 HydrophobicContact CD1-CB 3.68Å; L221-F233 HydrophobicContact CD1-CD1 4.07Å; L221-F233 HydrophobicContact CD1-CG 4.15Å; L221-F233 HydrophobicContact CD2-CB 4.19Å; L221-F233 HydrophobicContact CD2-CD1 4.14Å; L221-F233 HydrophobicContact CD2-CG 4.04Å; L221-F233 HydrophobicContact CG-CD1 4.45Å; L221-Q244 HydrophobicContact CB-CB 4.38Å; L221-Q244 HydrophobicContact CB-CG 4.23Å; L221-Q244 HydrophobicContact CD1-CB 3.95Å; L221-Q244 HydrophobicContact CG-CB 4.29Å; L221-N247 HydrophobicContact CD1-CB 3.64Å
222	S	93.2	Very high	92.7	Very high	69 Å²	69	45.5 Å²	45.5	48%	0.483	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-64.3	-25.8	178.3	71.8	0	0	0	0	112.4	D220 L224	D220-S222 PolarHBondContact O-N 2.91Å; D220-S222 WeakPolarHBondContact OD1-CB 3.47Å; D220-S222 PolarHBondContact OD1-N 2.73Å; D220-S222 PolarHBondContact OD1-OG 2.91Å; D220-S222 PolarHBondContact OD2-OG 2.91Å; S222-L224 VanDerWaalsContact C-N 3.25Å; S222-L224 PolarHBondContact O-N 2.83Å
223	C	92.4	Very high	93.2	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.034	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-78.2	-5.8	177.5	-59.7	0	0	0	0	113.1	E118 K119 L120 R211 D220 L221 N225	E118-C223 WeakPolarHBondContact O-CA 3.32Å; E118-C223 WeakPolarHBondContact O-CB 3.25Å; K119-C223 CarbonylContact C-O 3.53Å; K119-C223 WeakPolarHBondContact CA-O 3.39Å; L120-C223 WeakPolarHBondContact CB-O 3.34Å; L120-C223 HydrophobicContact CD1-CB 3.77Å; L120-C223 HydrophobicContact CG-CB 3.78Å; L120-C223 PolarHBondContact N-O 3.33Å; R211-C223 PolarHBondContact NH2-SG 3.29Å; R211-C223 VanDerWaalsContact NH2-SG 3.41Å; D220-C223 PolarHBondContact O-N 3.27Å; L221-C223 PolarHBondContact O-N 2.86Å; C223-N225 PolarHBondContact O-N 3.46Å
224	L	94.1	Very high	93.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-73.7	-8.2	-178.5	-65.6	175.5	0	0	0	113.8	L120 L121 V137 L205 L221 S222 R226 V231	L120-L224 HydrophobicContact CB-CD2 4.39Å; L120-L224 HydrophobicContact CD1-CD2 4.29Å; L121-L224 VanDerWaalsContact CB-O 3.28Å; L121-L224 WeakPolarHBondContact CB-O 3.21Å; L121-L224 HydrophobicContact CD1-CB 4.15Å; L121-L224 HydrophobicContact CD1-CD2 4.12Å; L121-L224 WeakPolarHBondContact CD1-O 3.41Å; L121-L224 HydrophobicContact CG-CB 4.48Å; L121-L224 HydrophobicContact CG-CD2 4.13Å; L121-L224 WeakPolarHBondContact CG-O 3.29Å; V137-L224 HydrophobicContact CG2-CD1 3.55Å; L205-L224 HydrophobicContact CD1-CD2 3.47Å; L205-L224 VanDerWaalsContact CD1-CD2 3.47Å; L221-L224 HydrophobicContact CB-CD1 4.18Å; L221-L224 HydrophobicContact CD2-CD1 3.8Å; L221-L224 WeakPolarHBondContact O-CB 3.43Å; L221-L224 WeakPolarHBondContact O-CG 3.47Å; L221-L224 PolarHBondContact O-N 3.22Å; L221-L224 VanDerWaalsContact O-N 3.09Å; S222-L224 VanDerWaalsContact C-N 3.25Å; S222-L224 PolarHBondContact O-N 2.83Å; L224-R226 HydrophobicContact CB-CG 4.44Å; L224-R226 PolarHBondContact O-N 3.09Å; L224-V231 HydrophobicContact CD1-CG1 4.38Å
225	N	95	Very high	94.5	Very high	43 Å²	43	31.5 Å²	31.5	23%	0.23	17%	0.168	C	C	.	.			trans	55.5	42.4	-176.7	-167.9	39.7	0	0	0	112	K119 L121 D123 C223	K119-N225 HydrophobicContact CB-CB 4.37Å; K119-N225 HydrophobicContact CD-CB 4.41Å; K119-N225 HydrophobicContact CG-CB 4.28Å; L121-N225 PolarHBondContact O-ND2 2.74Å; D123-N225 PolarHBondContact OD1-ND2 3.15Å; C223-N225 PolarHBondContact O-N 3.46Å
226	R	95.7	Very high	95	Very high	32 Å²	32	32.2 Å²	32.2	12%	0.121	16%	0.156	C	C	.	.	S	Bend	trans	-133.6	153.8	177.4	-64.3	-64.5	178.6	-90.5	2.9	109.1	L121 P122 T135 E175 L224 L228 V231	L121-R226 HydrophobicContact CD1-CG 4.25Å; P122-R226 PolarHBondContact O-NH1 3.45Å; P122-R226 PolarHBondContact O-NH2 3.42Å; T135-R226 HydrophobicContact CG2-CG 4.34Å; E175-R226 IonicContact OE1-CZ 3.69Å; E175-R226 IonicContact OE1-NE 3.51Å; E175-R226 PolarHBondContact OE1-NE 2.69Å; E175-R226 IonicContact OE1-NH2 2.76Å; E175-R226 PolarHBondContact OE1-NH2 3.14Å; E175-R226 IonicContact OE2-CZ 3.88Å; E175-R226 IonicContact OE2-NE 2.72Å; E175-R226 PolarHBondContact OE2-NE 3.2Å; E175-R226 IonicContact OE2-NH2 2.72Å; L224-R226 HydrophobicContact CB-CG 4.44Å; L224-R226 PolarHBondContact O-N 3.09Å; R226-L228 PolarHBondContact O-N 3.05Å; R226-V231 HydrophobicContact CB-CG2 3.75Å
227	D	95.6	Very high	95.4	Very high	101 Å²	101	28.3 Å²	28.3	54%	0.54	14%	0.141	S	C	.	.			trans	-70	118.3	173.8	-177.9	3.2	0	0	0	110	S229 R230 V231	D227-S229 PolarHBondContact O-N 3.18Å; D227-S229 VanDerWaalsContact O-N 3.12Å; D227-S229 PolarHBondContact OD1-N 2.74Å; D227-S229 PolarHBondContact OD1-OG 2.88Å; D227-S229 PolarHBondContact OD2-OG 2.8Å; D227-R230 PolarHBondContact O-N 2.99Å; D227-V231 WeakPolarHBondContact O-CG2 3.39Å; D227-V231 PolarHBondContact O-N 3.48Å
228	L	96.4	Very high	95.5	Very high	42 Å²	42	29.8 Å²	29.8	22%	0.22	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-61.6	-18.1	178.8	-64.1	179.1	0	0	0	112.8	L221 R226 R230 V231 Q244 N247	L221-L228 HydrophobicContact CB-CD2 3.83Å; R226-L228 PolarHBondContact O-N 3.05Å; L228-R230 PolarHBondContact O-N 2.84Å; L228-V231 HydrophobicContact CD2-CG2 4.5Å; L228-Q244 HydrophobicContact CD1-CG 4.33Å; L228-N247 PolarHBondContact O-ND2 2.66Å
229	S	97	Very high	95.5	Very high	15 Å²	15	30.4 Å²	30.4	11%	0.105	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-65.8	-18.1	171.2	77	0	0	0	0	112.9	D227 D280 V281	D227-S229 PolarHBondContact O-N 3.18Å; D227-S229 VanDerWaalsContact O-N 3.12Å; D227-S229 PolarHBondContact OD1-N 2.74Å; D227-S229 PolarHBondContact OD1-OG 2.88Å; D227-S229 PolarHBondContact OD2-OG 2.8Å; S229-D280 WeakPolarHBondContact O-CA 3.45Å; S229-V281 WeakPolarHBondContact O-CG2 3.3Å; S229-V281 PolarHBondContact O-N 2.81Å
230	R	96.7	Very high	95.5	Very high	113 Å²	113	30.4 Å²	30.4	43%	0.426	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-120.8	12.1	-176.5	-55.2	-167.6	-178.7	-178.1	-4.1	114.2	P133 Y134 T135 D227 L228	P133-R230 WeakPolarHBondContact O-CD 3.34Å; Y134-R230 WeakPolarHBondContact CA-O 3.37Å; Y134-R230 HydrophobicContact CD1-CB 3.86Å; Y134-R230 HydrophobicContact CD1-CG 4.32Å; Y134-R230 HydrophobicContact CE1-CB 4.4Å; Y134-R230 HydrophobicContact CE1-CG 4.39Å; T135-R230 PolarHBondContact N-O 3Å; D227-R230 PolarHBondContact O-N 2.99Å; L228-R230 PolarHBondContact O-N 2.84Å
231	V	97.6	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.5	178.3	176.3	0	0	0	0	109.8	T135 V137 L221 L224 R226 D227 L228 N247 V281	T135-V231 WeakPolarHBondContact O-CA 3.48Å; V137-V231 HydrophobicContact CG2-CG1 3.98Å; L221-V231 HydrophobicContact CD1-CG1 4.25Å; L224-V231 HydrophobicContact CD1-CG1 4.38Å; R226-V231 HydrophobicContact CB-CG2 3.75Å; D227-V231 WeakPolarHBondContact O-CG2 3.39Å; D227-V231 PolarHBondContact O-N 3.48Å; L228-V231 HydrophobicContact CD2-CG2 4.5Å; V231-N247 PolarHBondContact O-ND2 2.8Å; V231-V281 WeakPolarHBondContact O-CG2 3.44Å
232	V	97.8	Very high	95.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.1	169.6	-178	0	0	0	0	108.3	T135 L136 V137 V234 L270 V281 L285	T135-V232 PolarHBondContact O-N 3.32Å; L136-V232 WeakPolarHBondContact CA-O 3.37Å; L136-V232 HydrophobicContact CD1-CB 4.28Å; L136-V232 HydrophobicContact CD1-CG1 4.33Å; V137-V232 PolarHBondContact N-O 2.72Å; V232-V234 HydrophobicContact CG1-CG2 4.32Å; V232-L270 HydrophobicContact CB-CD2 4.39Å; V232-L270 HydrophobicContact CG1-CD2 3.82Å; V232-V281 HydrophobicContact CG2-CB 3.95Å; V232-V281 HydrophobicContact CG2-CG1 4.09Å; V232-V281 HydrophobicContact CG2-CG2 3.85Å; V232-L285 HydrophobicContact CG1-CD1 4.28Å; V232-L285 HydrophobicContact CG1-CD2 4.31Å; V232-L285 HydrophobicContact CG2-CD1 4.45Å
233	F	97.9	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.1	178.4	174.5	-141.8	0	0	0	110.2	V137 K219 L221 D235 A241 N247 S248 L249	V137-F233 HydrophobicContact CB-CB 4.24Å; V137-F233 HydrophobicContact CB-CD2 3.76Å; V137-F233 HydrophobicContact CB-CG 4.36Å; V137-F233 HydrophobicContact CG1-CD2 3.57Å; V137-F233 HydrophobicContact CG1-CE2 4.03Å; V137-F233 HydrophobicContact CG1-CG 4.43Å; V137-F233 CarbonylContact O-C 3.34Å; V137-F233 WeakPolarHBondContact O-CA 3.41Å; K219-F233 HydrophobicContact CB-CZ 4.36Å; K219-F233 HydrophobicContact CD-CE1 4.46Å; K219-F233 HydrophobicContact CD-CE2 4.05Å; K219-F233 HydrophobicContact CD-CZ 3.58Å; L221-F233 HydrophobicContact CD1-CB 3.68Å; L221-F233 HydrophobicContact CD1-CD1 4.07Å; L221-F233 HydrophobicContact CD1-CG 4.15Å; L221-F233 HydrophobicContact CD2-CB 4.19Å; L221-F233 HydrophobicContact CD2-CD1 4.14Å; L221-F233 HydrophobicContact CD2-CG 4.04Å; L221-F233 HydrophobicContact CG-CD1 4.45Å; F233-D235 HydrophobicContact CE1-CB 4.19Å; F233-D235 HydrophobicContact CE2-CB 3.9Å; F233-D235 HydrophobicContact CZ-CB 3.57Å; F233-D235 WeakPolarHBondContact CZ-OD2 3.37Å; F233-A241 HydrophobicContact CD1-CB 4.03Å; F233-A241 HydrophobicContact CE1-CB 3.69Å; F233-N247 PolarHBondContact N-O 3.33Å; F233-S248 CarbonylContact O-C 3.58Å; F233-S248 WeakPolarHBondContact O-CA 3.22Å; F233-L249 PolarHBondContact O-N 2.84Å
234	V	97.5	Very high	95.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	121.6	178.8	-176.7	0	0	0	0	109.2	L136 V137 L138 E139 V143 V232 L249 I251 L266	L136-V234 HydrophobicContact CD1-CG2 4.04Å; V137-V234 PolarHBondContact O-N 3.11Å; L138-V234 HydrophobicContact CD2-CB 3.88Å; L138-V234 HydrophobicContact CD2-CG1 4.44Å; L138-V234 HydrophobicContact CD2-CG2 4.22Å; E139-V234 PolarHBondContact N-O 2.69Å; V143-V234 HydrophobicContact CG1-CG1 4.47Å; V232-V234 HydrophobicContact CG1-CG2 4.32Å; V234-L249 HydrophobicContact CG2-CB 4.39Å; V234-L249 HydrophobicContact CG2-CD2 4.47Å; V234-I251 HydrophobicContact CG1-CD1 3.97Å; V234-I251 HydrophobicContact CG1-CG1 4.13Å; V234-I251 HydrophobicContact CG1-CG2 3.91Å; V234-L266 HydrophobicContact CG1-CD1 4.45Å; V234-L266 HydrophobicContact CG1-CD2 3.97Å; V234-L266 HydrophobicContact CG2-CD1 4.27Å
235	D	96.9	Very high	95.5	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	163	177.6	-151.2	-45.1	0	0	0	109.2	E139 K219 F233 D237 A240 L249 I250 I251	E139-D235 HydrophobicContact CB-CB 4.41Å; K219-D235 IonicContact NZ-OD2 2.69Å; K219-D235 PolarHBondContact NZ-OD2 3.47Å; F233-D235 HydrophobicContact CE1-CB 4.19Å; F233-D235 HydrophobicContact CE2-CB 3.9Å; F233-D235 HydrophobicContact CZ-CB 3.57Å; F233-D235 WeakPolarHBondContact CZ-OD2 3.37Å; D235-D237 PolarHBondContact OD1-N 3.47Å; D235-A240 WeakPolarHBondContact OD2-CB 3.4Å; D235-L249 PolarHBondContact N-O 3.46Å; D235-I250 HydrophobicContact CB-CD1 4.42Å; D235-I250 VanDerWaalsContact O-CA 3.27Å; D235-I250 WeakPolarHBondContact O-CA 3.48Å; D235-I251 PolarHBondContact O-N 2.76Å
236	W	95.4	Very high	95.6	Very high	64 Å²	64	43.5 Å²	43.5	24%	0.242	22%	0.215	C	C	.	.	S	Bend	trans	-95.9	-21.3	167.4	64.5	-95.4	0	0	0	111.8	T141 D142 P238 I251 R253	T141-W236 VanDerWaalsContact O-CD1 3.23Å; T141-W236 PolarHBondContact O-NE1 2.78Å; D142-W236 HydrophobicContact CB-CG 4.44Å; W236-P238 WeakPolarHBondContact O-CD 3.33Å; W236-I251 WeakPolarHBondContact CA-O 3.41Å; W236-R253 HydrophobicContact CB-CB 4.04Å; W236-R253 HydrophobicContact CB-CG 4.41Å; W236-R253 HydrophobicContact CD2-CB 4.25Å; W236-R253 HydrophobicContact CD2-CG 3.88Å; W236-R253 HydrophobicContact CE3-CB 4.17Å; W236-R253 HydrophobicContact CE3-CG 4.01Å; W236-R253 HydrophobicContact CG-CB 4.19Å; W236-R253 HydrophobicContact CG-CG 4.04Å
237	D	95.1	Very high	95.6	Very high	40 Å²	40	42.2 Å²	42.2	21%	0.214	21%	0.211	C	C	.	.			trans	-95.4	111.3	-179.1	-175.2	8.7	0	0	0	111.7	D235 A239 A240	D235-D237 PolarHBondContact OD1-N 3.47Å; D237-A239 PolarHBondContact O-N 3.09Å; D237-A239 VanDerWaalsContact OD1-CB 3.31Å; D237-A239 WeakPolarHBondContact OD1-CB 3.44Å; D237-A239 PolarHBondContact OD1-N 3.43Å; D237-A240 HydrophobicContact CB-CB 4.38Å; D237-A240 PolarHBondContact O-N 2.69Å
238	P	93.9	Very high	95.6	Very high	85 Å²	85	37.7 Å²	37.7	55%	0.552	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.3	176	26.5	-34.9	0	0	0	113.1	W236 A240 A241 I250	W236-P238 WeakPolarHBondContact O-CD 3.33Å; P238-A240 VanDerWaalsContact C-N 3.33Å; P238-A241 PolarHBondContact O-N 3.06Å; P238-I250 HydrophobicContact CB-CG1 4.42Å
239	A	93.7	Very high	95.6	Very high	15 Å²	15	35.9 Å²	35.9	12%	0.124	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.5	178	0	0	0	0	0	112.6	K216 D237 A241 Q242	K216-A239 HydrophobicContact CD-CB 3.85Å; D237-A239 PolarHBondContact O-N 3.09Å; D237-A239 VanDerWaalsContact OD1-CB 3.31Å; D237-A239 WeakPolarHBondContact OD1-CB 3.44Å; D237-A239 PolarHBondContact OD1-N 3.43Å; A239-A241 VanDerWaalsContact C-N 3.26Å; A239-A241 PolarHBondContact O-N 3.25Å; A239-Q242 WeakPolarHBondContact O-CB 3.33Å; A239-Q242 PolarHBondContact O-N 3.12Å
240	A	93.7	Very high	95.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-30.7	176.9	0	0	0	0	0	111.9	K219 D235 D237 P238	K219-A240 HydrophobicContact CD-CB 4.21Å; K219-A240 HydrophobicContact CG-CB 4.49Å; K219-A240 PolarHBondContact N-O 2.64Å; D235-A240 WeakPolarHBondContact OD2-CB 3.4Å; D237-A240 HydrophobicContact CB-CB 4.38Å; D237-A240 PolarHBondContact O-N 2.69Å; P238-A240 VanDerWaalsContact C-N 3.33Å
241	A	93.2	Very high	95.5	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.025	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	8.5	-178.3	0	0	0	0	0	115.1	F233 P238 A239 L243 Q244 P245 S248 I250	F233-A241 HydrophobicContact CD1-CB 4.03Å; F233-A241 HydrophobicContact CE1-CB 3.69Å; P238-A241 PolarHBondContact O-N 3.06Å; A239-A241 VanDerWaalsContact C-N 3.26Å; A239-A241 PolarHBondContact O-N 3.25Å; A241-L243 PolarHBondContact O-N 3.25Å; A241-Q244 CarbonylContact O-C 3.54Å; A241-Q244 PolarHBondContact O-N 2.96Å; A241-Q244 VanDerWaalsContact O-N 3.14Å; A241-P245 VanDerWaalsContact O-N 3.16Å; A241-S248 VanDerWaalsContact CB-CB 3.5Å; A241-I250 HydrophobicContact CB-CD1 4.25Å
242	Q	93.1	Very high	95.3	Very high	126 Å²	126	39 Å²	39	59%	0.589	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-31.7	-167.9	-172.5	178.4	25.9	0	0	114.9	I218 A239	I218-Q242 HydrophobicContact CG2-CB 4.27Å; A239-Q242 WeakPolarHBondContact O-CB 3.33Å; A239-Q242 PolarHBondContact O-N 3.12Å
243	L	92.9	Very high	95.2	Very high	75 Å²	75	44.7 Å²	44.7	39%	0.393	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-30.7	-177.7	-71.5	171.6	0	0	0	113.5	I218 D220 A241	I218-L243 HydrophobicContact CG2-CB 4.41Å; I218-L243 HydrophobicContact CG2-CD1 3.79Å; I218-L243 HydrophobicContact CG2-CG 3.77Å; D220-L243 HydrophobicContact CB-CD1 3.67Å; A241-L243 PolarHBondContact O-N 3.25Å
244	Q	95.5	Very high	95.1	Very high	26 Å²	26	45.1 Å²	45.1	12%	0.121	22%	0.217	C	C	.	.			trans	-135.4	62.5	-180	-65.2	85	11.9	0	0	110.8	D220 L221 L228 A241 R246 N247	D220-Q244 PolarHBondContact OD1-NE2 2.7Å; L221-Q244 HydrophobicContact CB-CB 4.38Å; L221-Q244 HydrophobicContact CB-CG 4.23Å; L221-Q244 HydrophobicContact CD1-CB 3.95Å; L221-Q244 HydrophobicContact CG-CB 4.29Å; L228-Q244 HydrophobicContact CD1-CG 4.33Å; A241-Q244 CarbonylContact O-C 3.54Å; A241-Q244 PolarHBondContact O-N 2.96Å; A241-Q244 VanDerWaalsContact O-N 3.14Å; Q244-R246 PolarHBondContact O-N 3.38Å; Q244-N247 HydrophobicContact CB-CB 4.36Å; Q244-N247 PolarHBondContact O-N 3.28Å; Q244-N247 VanDerWaalsContact O-N 3.11Å
245	P	95.1	Very high	94.9	Very high	64 Å²	64	50.6 Å²	50.6	42%	0.416	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-60.3	-33.7	-176.7	24.2	-34.1	0	0	0	111.5	A241 N247 S248 R289	A241-P245 VanDerWaalsContact O-N 3.16Å; P245-N247 PolarHBondContact O-N 2.74Å; P245-S248 WeakPolarHBondContact O-CB 3.3Å; P245-S248 PolarHBondContact O-N 3.26Å; P245-S248 PolarHBondContact O-OG 2.81Å; P245-R289 PolarHBondContact O-NH2 2.74Å
246	R	96.3	Very high	94.8	Very high	112 Å²	112	50.9 Å²	50.9	42%	0.423	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-58.8	-28.9	178.9	-65.7	-170.9	70	-163.5	-0.4	114.5	Q244 R282 D286 R289	Q244-R246 PolarHBondContact O-N 3.38Å; R246-R282 HydrophobicContact CB-CG 4.43Å; R246-D286 IonicContact CZ-OD2 3.92Å; R246-D286 VanDerWaalsContact CZ-OD2 3.24Å; R246-D286 IonicContact NE-OD1 2.78Å; R246-D286 IonicContact NE-OD2 3.84Å; R246-D286 PolarHBondContact NE-OD2 2.78Å; R246-D286 IonicContact NH2-OD2 3.57Å; R246-D286 PolarHBondContact NH2-OD2 3.41Å; R246-R289 VanDerWaalsContact C-NH2 3.29Å; R246-R289 VanDerWaalsContact CA-NH2 3.3Å; R246-R289 PolarHBondContact O-NH2 2.89Å
247	N	97	Very high	94.7	Very high	5 Å²	5	52 Å²	52	3%	0.027	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-88.4	-8.6	177	-72.5	92.8	0	0	0	113.1	L221 L228 V231 F233 Q244 P245 L285	L221-N247 HydrophobicContact CD1-CB 3.64Å; L228-N247 PolarHBondContact O-ND2 2.66Å; V231-N247 PolarHBondContact O-ND2 2.8Å; F233-N247 PolarHBondContact N-O 3.33Å; Q244-N247 HydrophobicContact CB-CB 4.36Å; Q244-N247 PolarHBondContact O-N 3.28Å; Q244-N247 VanDerWaalsContact O-N 3.11Å; P245-N247 PolarHBondContact O-N 2.74Å; N247-L285 WeakPolarHBondContact O-CD1 3.39Å
248	S	95.7	Very high	94.5	Very high	5 Å²	5	58 Å²	58	4%	0.035	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	136.6	-176.2	71.7	0	0	0	0	112.9	F233 A241 P245 R289	F233-S248 CarbonylContact O-C 3.58Å; F233-S248 WeakPolarHBondContact O-CA 3.22Å; A241-S248 VanDerWaalsContact CB-CB 3.5Å; P245-S248 WeakPolarHBondContact O-CB 3.3Å; P245-S248 PolarHBondContact O-N 3.26Å; P245-S248 PolarHBondContact O-OG 2.81Å; S248-R289 PolarHBondContact O-NH2 3.09Å
249	L	96.1	Very high	94.5	Very high	4 Å²	4	58 Å²	58	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	104.1	163.6	-178.3	68.8	0	0	0	107.1	F233 V234 D235 I251 L266 F269 L285 P294 L295	F233-L249 PolarHBondContact O-N 2.84Å; V234-L249 HydrophobicContact CG2-CB 4.39Å; V234-L249 HydrophobicContact CG2-CD2 4.47Å; D235-L249 PolarHBondContact N-O 3.46Å; L249-I251 HydrophobicContact CD2-CG2 4.34Å; L249-I251 HydrophobicContact CG-CG2 4.22Å; L249-I251 PolarHBondContact O-N 3.26Å; L249-L266 HydrophobicContact CD2-CD1 3.58Å; L249-F269 HydrophobicContact CD2-CD1 3.9Å; L249-F269 HydrophobicContact CD2-CE1 3.75Å; L249-L285 HydrophobicContact CB-CD2 4.11Å; L249-L285 HydrophobicContact CD1-CD2 4.44Å; L249-P294 HydrophobicContact CD1-CB 3.71Å; L249-P294 HydrophobicContact CD1-CG 4.17Å; L249-L295 HydrophobicContact CD2-CD2 4.35Å
250	I	95.5	Very high	94.4	Very high	51 Å²	51	58.4 Å²	58.4	26%	0.262	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.5	178.1	-55.2	-56.3	0	0	0	108.6	D235 P238 A241	D235-I250 HydrophobicContact CB-CD1 4.42Å; D235-I250 VanDerWaalsContact O-CA 3.27Å; D235-I250 WeakPolarHBondContact O-CA 3.48Å; P238-I250 HydrophobicContact CB-CG1 4.42Å; A241-I250 HydrophobicContact CB-CD1 4.25Å
251	I	94.6	Very high	94.4	Very high	10 Å²	10	67.4 Å²	67.4	5%	0.051	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-103.1	165.5	178.4	65.8	167.4	0	0	0	110.6	V143 V234 D235 W236 L249 R253 L295	V143-I251 HydrophobicContact CB-CD1 4.46Å; V143-I251 HydrophobicContact CG1-CD1 3.94Å; V143-I251 HydrophobicContact CG2-CD1 4.19Å; V234-I251 HydrophobicContact CG1-CD1 3.97Å; V234-I251 HydrophobicContact CG1-CG1 4.13Å; V234-I251 HydrophobicContact CG1-CG2 3.91Å; D235-I251 PolarHBondContact O-N 2.76Å; W236-I251 WeakPolarHBondContact CA-O 3.41Å; L249-I251 HydrophobicContact CD2-CG2 4.34Å; L249-I251 HydrophobicContact CG-CG2 4.22Å; L249-I251 PolarHBondContact O-N 3.26Å; I251-R253 PolarHBondContact O-N 3.33Å; I251-L295 HydrophobicContact CB-CD1 4.35Å; I251-L295 HydrophobicContact CG2-CD1 3.71Å; I251-L295 HydrophobicContact CG2-CG 4.28Å
252	K	93.9	Very high	94.4	Very high	133 Å²	133	68.6 Å²	68.6	58%	0.578	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-62.5	137.1	174	-171.1	-179	177.5	-176.9	0	110.5	W254	K252-W254 PolarHBondContact O-N 2.81Å
253	R	95.6	Very high	94.5	Very high	120 Å²	120	62.6 Å²	62.6	45%	0.453	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-62.9	123.3	173.7	-171.8	179.8	-177.1	178.1	0.8	110.2	D142 W236 I251	D142-R253 HydrophobicContact CB-CG 3.68Å; D142-R253 IonicContact OD2-CZ 3.86Å; D142-R253 IonicContact OD2-NE 3.87Å; D142-R253 PolarHBondContact OD2-NE 3.4Å; D142-R253 IonicContact OD2-NH2 2.94Å; D142-R253 PolarHBondContact OD2-NH2 3.47Å; W236-R253 HydrophobicContact CB-CB 4.04Å; W236-R253 HydrophobicContact CB-CG 4.41Å; W236-R253 HydrophobicContact CD2-CB 4.25Å; W236-R253 HydrophobicContact CD2-CG 3.88Å; W236-R253 HydrophobicContact CE3-CB 4.17Å; W236-R253 HydrophobicContact CE3-CG 4.01Å; W236-R253 HydrophobicContact CG-CB 4.19Å; W236-R253 HydrophobicContact CG-CG 4.04Å; I251-R253 PolarHBondContact O-N 3.33Å
254	W	96.1	Very high	94.6	Very high	9 Å²	9	63.3 Å²	63.3	3%	0.034	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-83.7	126.1	177.8	-177.9	60.9	0	0	0	111.2	D142 H146 K158 R160 K252 G256 D257	D142-W254 WeakPolarHBondContact CB-O 3.39Å; D142-W254 VanDerWaalsContact O-CB 3.26Å; D142-W254 WeakPolarHBondContact O-CB 3.31Å; D142-W254 PolarHBondContact O-N 3.46Å; H146-W254 HydrophobicContact CB-CE3 3.7Å; H146-W254 HydrophobicContact CB-CH2 4.15Å; H146-W254 HydrophobicContact CB-CZ3 3.48Å; H146-W254 VanDerWaalsContact CB-CZ3 3.48Å; H146-W254 PolarHBondContact ND1-O 3.32Å; K158-W254 HydrophobicContact CB-CH2 4.16Å; R160-W254 HydrophobicContact CB-CD2 4.12Å; R160-W254 HydrophobicContact CB-CE3 3.82Å; R160-W254 HydrophobicContact CB-CH2 3.73Å; R160-W254 HydrophobicContact CB-CZ2 3.99Å; R160-W254 HydrophobicContact CB-CZ3 3.6Å; R160-W254 HydrophobicContact CG-CD2 3.77Å; R160-W254 HydrophobicContact CG-CE3 3.99Å; R160-W254 HydrophobicContact CG-CG 4.29Å; R160-W254 HydrophobicContact CG-CH2 4.21Å; R160-W254 HydrophobicContact CG-CZ2 3.96Å; R160-W254 HydrophobicContact CG-CZ3 4.19Å; K252-W254 PolarHBondContact O-N 2.81Å; W254-G256 VanDerWaalsContact CE2-CA 3.48Å; W254-G256 VanDerWaalsContact CZ2-CA 3.43Å; W254-D257 PolarHBondContact NE1-O 3.34Å
255	N	94	Very high	94.6	Very high	114 Å²	114	63.3 Å²	63.3	61%	0.61	30%	0.304	S	S	*	.			trans	-97.9	16	-175.9	-62.1	-35	0	0	0	113.4
256	G	93.7	Very high	94.6	Very high	7 Å²	7	60.2 Å²	60.2	7%	0.072	29%	0.285	C	S	.	.	S	Bend	trans	82	19.6	-177.3	0	0	0	0	0	115.2	W254	W254-G256 VanDerWaalsContact CE2-CA 3.48Å; W254-G256 VanDerWaalsContact CZ2-CA 3.43Å
257	D	94.3	Very high	94.6	Very high	89 Å²	89	55 Å²	55	48%	0.476	27%	0.265	S	S	.	.			trans	-70.1	130.3	173.8	-176.3	4.9	0	0	0	110.7	W254 S259 D260	W254-D257 PolarHBondContact NE1-O 3.34Å; D257-S259 PolarHBondContact OD1-N 3.5Å; D257-S259 PolarHBondContact OD1-OG 3.01Å; D257-S259 VanDerWaalsContact OD1-OG 3.08Å; D257-S259 PolarHBondContact OD2-OG 2.83Å; D257-D260 WeakPolarHBondContact O-CB 3.47Å
258	E	91.1	Very high	94.6	Very high	165 Å²	165	56.2 Å²	56.2	77%	0.771	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-18.9	-178.9	-65.3	178.1	-173.1	0	0	112.7	D260	E258-D260 VanDerWaalsContact C-N 3.29Å
259	S	93.3	Very high	94.6	Very high	86 Å²	86	56 Å²	56	60%	0.601	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-4.9	177.7	76.7	0	0	0	0	114	D257	D257-S259 PolarHBondContact OD1-N 3.5Å; D257-S259 PolarHBondContact OD1-OG 3.01Å; D257-S259 VanDerWaalsContact OD1-OG 3.08Å; D257-S259 PolarHBondContact OD2-OG 2.83Å
260	D	92.7	Very high	94.6	Very high	22 Å²	22	55.9 Å²	55.9	12%	0.118	27%	0.274	C	S	.	.			trans	-59.9	138.3	179.6	-179.1	90.3	0	0	0	112.3	R160 D257 E258 E262	R160-D260 IonicContact CZ-OD1 3.65Å; R160-D260 IonicContact CZ-OD2 2.74Å; R160-D260 IonicContact NE-OD1 3.3Å; R160-D260 IonicContact NE-OD2 2.88Å; R160-D260 PolarHBondContact NE-OD2 2.78Å; R160-D260 IonicContact NH2-OD1 3.74Å; R160-D260 PolarHBondContact NH2-OD1 3.44Å; R160-D260 IonicContact NH2-OD2 3.24Å; R160-D260 PolarHBondContact NH2-OD2 3.48Å; R160-D260 VanDerWaalsContact NH2-OD2 3.08Å; D257-D260 WeakPolarHBondContact O-CB 3.47Å; E258-D260 VanDerWaalsContact C-N 3.29Å; D260-E262 PolarHBondContact OD2-N 2.62Å
261	R	92.3	Very high	94.6	Very high	189 Å²	189	57.7 Å²	57.7	71%	0.713	28%	0.277	S	S	*	.			trans	-129.3	6	177.7	-62.8	-176.2	-177.6	170.5	0.6	113.3	L263 I264	R261-L263 PolarHBondContact O-N 3.23Å; R261-I264 HydrophobicContact CB-CD1 4.42Å; R261-I264 WeakPolarHBondContact O-CB 3.38Å; R261-I264 PolarHBondContact O-N 2.83Å
262	E	93.8	Very high	94.6	Very high	28 Å²	28	60.6 Å²	60.6	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-27.6	-171.5	-61	177.6	179.4	0	0	112.6	R160 D260 I264 D265 L266 L295	R160-E262 IonicContact CZ-OE2 3.33Å; R160-E262 IonicContact NH2-OE2 3.11Å; R160-E262 PolarHBondContact NH2-OE2 3.41Å; D260-E262 PolarHBondContact OD2-N 2.62Å; E262-I264 PolarHBondContact O-N 3.11Å; E262-D265 PolarHBondContact O-N 3.34Å; E262-L266 WeakPolarHBondContact O-CB 3.3Å; E262-L266 PolarHBondContact O-N 3.3Å; E262-L295 HydrophobicContact CB-CD1 4.44Å
263	L	95	Very high	94.7	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-30.1	173.8	-74.7	-170.8	0	0	0	113	R160 L163 F166 R261 L266 A267	R160-L263 HydrophobicContact CB-CD1 3.7Å; R160-L263 HydrophobicContact CB-CG 4.5Å; R160-L263 HydrophobicContact CG-CD1 3.62Å; R160-L263 HydrophobicContact CG-CG 3.89Å; L163-L263 HydrophobicContact CB-CD1 4.16Å; L163-L263 HydrophobicContact CD1-CD1 4.14Å; F166-L263 HydrophobicContact CD2-CB 4.33Å; F166-L263 HydrophobicContact CD2-CD2 4.34Å; F166-L263 WeakPolarHBondContact CD2-O 3.49Å; F166-L263 HydrophobicContact CE2-CD2 4.39Å; R261-L263 PolarHBondContact O-N 3.23Å; L263-L266 HydrophobicContact CD2-CD2 4.12Å; L263-A267 WeakPolarHBondContact O-CB 3.45Å; L263-A267 PolarHBondContact O-N 3.3Å
264	I	95	Very high	94.7	Very high	89 Å²	89	49.1 Å²	49.1	46%	0.456	25%	0.247	S	C	.	.	H	α-helix	trans	-69.3	-45.1	176.7	-58	174.5	0	0	0	109.2	A162 R261 E262 L266 A267 A268	A162-I264 HydrophobicContact CB-CD1 4.03Å; A162-I264 HydrophobicContact CB-CG1 3.64Å; R261-I264 HydrophobicContact CB-CD1 4.42Å; R261-I264 WeakPolarHBondContact O-CB 3.38Å; R261-I264 PolarHBondContact O-N 2.83Å; E262-I264 PolarHBondContact O-N 3.11Å; I264-L266 VanDerWaalsContact C-N 3.34Å; I264-L266 PolarHBondContact O-N 3.33Å; I264-A267 PolarHBondContact O-N 2.99Å; I264-A268 PolarHBondContact O-N 3.22Å
265	D	94.6	Very high	94.6	Very high	26 Å²	26	53.8 Å²	53.8	14%	0.139	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-41.9	176.8	-62	-28.1	0	0	0	110.8	E262 A268 F269 R299	E262-D265 PolarHBondContact O-N 3.34Å; D265-A268 PolarHBondContact O-N 2.99Å; D265-F269 WeakPolarHBondContact O-CB 3.46Å; D265-F269 PolarHBondContact O-N 3.5Å; D265-R299 IonicContact OD2-CZ 3.79Å; D265-R299 IonicContact OD2-NH1 2.66Å; D265-R299 PolarHBondContact OD2-NH1 3.42Å
266	L	96.6	Very high	94.5	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-42.3	175.2	-177.7	64.5	0	0	0	112.2	F166 V234 L249 E262 L263 I264 A268 F269 L270 L295	F166-L266 HydrophobicContact CE2-CB 4.26Å; F166-L266 HydrophobicContact CE2-CD2 3.68Å; F166-L266 HydrophobicContact CE2-CG 3.85Å; F166-L266 HydrophobicContact CZ-CD2 3.99Å; F166-L266 HydrophobicContact CZ-CG 4.49Å; V234-L266 HydrophobicContact CG1-CD1 4.45Å; V234-L266 HydrophobicContact CG1-CD2 3.97Å; V234-L266 HydrophobicContact CG2-CD1 4.27Å; L249-L266 HydrophobicContact CD2-CD1 3.58Å; E262-L266 WeakPolarHBondContact O-CB 3.3Å; E262-L266 PolarHBondContact O-N 3.3Å; L263-L266 HydrophobicContact CD2-CD2 4.12Å; I264-L266 VanDerWaalsContact C-N 3.34Å; I264-L266 PolarHBondContact O-N 3.33Å; L266-A268 VanDerWaalsContact C-N 3.32Å; L266-A268 PolarHBondContact O-N 3.47Å; L266-F269 PolarHBondContact O-N 3.18Å; L266-L270 HydrophobicContact CD1-CD1 4.12Å; L266-L270 HydrophobicContact CD1-CG 4.22Å; L266-L270 HydrophobicContact CG-CD1 3.96Å; L266-L270 HydrophobicContact CG-CG 4.45Å; L266-L270 WeakPolarHBondContact O-CB 3.34Å; L266-L270 WeakPolarHBondContact O-CG 3.39Å; L266-L270 PolarHBondContact O-N 2.9Å; L266-L295 HydrophobicContact CB-CD1 4.08Å; L266-L295 HydrophobicContact CB-CD2 4.3Å; L266-L295 HydrophobicContact CD1-CD1 4.39Å; L266-L295 HydrophobicContact CD1-CD2 4.02Å
267	A	96.4	Very high	94.5	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-42.8	175.1	0	0	0	0	0	111.5	F166 L263 I264 R271	F166-A267 HydrophobicContact CD2-CB 3.85Å; F166-A267 HydrophobicContact CE2-CB 4.46Å; L263-A267 WeakPolarHBondContact O-CB 3.45Å; L263-A267 PolarHBondContact O-N 3.3Å; I264-A267 PolarHBondContact O-N 2.99Å; A267-R271 VanDerWaalsContact O-CB 3.3Å; A267-R271 WeakPolarHBondContact O-CB 3.48Å; A267-R271 VanDerWaalsContact O-CG 3.31Å; A267-R271 WeakPolarHBondContact O-CG 3.45Å; A267-R271 PolarHBondContact O-N 2.93Å
268	A	95.4	Very high	94.4	Very high	31 Å²	31	52.2 Å²	52.2	26%	0.256	28%	0.281	S	S	.	.	H	α-helix	trans	-63.7	-42.3	176.7	0	0	0	0	0	111.9	I264 D265 L266 R271 M272 F298	I264-A268 PolarHBondContact O-N 3.22Å; D265-A268 PolarHBondContact O-N 2.99Å; L266-A268 VanDerWaalsContact C-N 3.32Å; L266-A268 PolarHBondContact O-N 3.47Å; A268-R271 PolarHBondContact O-N 3.32Å; A268-M272 PolarHBondContact O-N 2.73Å; A268-F298 HydrophobicContact CB-CE1 3.92Å; A268-F298 HydrophobicContact CB-CZ 4.34Å
269	F	95.9	Very high	94.6	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-51.2	175.8	177.8	-101.1	0	0	0	112.4	L249 D265 L266 R271 M272 I273 V284 L285 Y288 L295 F298	L249-F269 HydrophobicContact CD2-CD1 3.9Å; L249-F269 HydrophobicContact CD2-CE1 3.75Å; D265-F269 WeakPolarHBondContact O-CB 3.46Å; D265-F269 PolarHBondContact O-N 3.5Å; L266-F269 PolarHBondContact O-N 3.18Å; F269-R271 PolarHBondContact O-N 3.48Å; F269-M272 HydrophobicContact CD2-CE 4.17Å; F269-M272 HydrophobicContact CE2-CE 4.13Å; F269-M272 WeakPolarHBondContact O-CB 3.45Å; F269-M272 PolarHBondContact O-N 3.49Å; F269-M272 VanDerWaalsContact O-N 3.16Å; F269-I273 HydrophobicContact CD1-CD1 4.11Å; F269-I273 HydrophobicContact CE1-CD1 3.49Å; F269-I273 VanDerWaalsContact CE1-CD1 3.49Å; F269-I273 HydrophobicContact CZ-CD1 3.78Å; F269-I273 PolarHBondContact O-N 3.1Å; F269-V284 HydrophobicContact CZ-CG1 4.35Å; F269-L285 HydrophobicContact CE1-CD2 4.05Å; F269-L285 HydrophobicContact CZ-CD2 4.15Å; F269-Y288 HydrophobicContact CE2-CD1 4.26Å; F269-Y288 AromaticContact CE2-CD2 3.54Å; F269-Y288 HydrophobicContact CE2-CD2 3.54Å; F269-Y288 HydrophobicContact CE2-CE1 4.28Å; F269-Y288 AromaticContact CE2-CE2 3.58Å; F269-Y288 HydrophobicContact CE2-CE2 3.58Å; F269-Y288 AromaticContact CE2-CG 3.92Å; F269-Y288 HydrophobicContact CE2-CG 3.92Å; F269-Y288 AromaticContact CE2-CZ 3.96Å; F269-Y288 AromaticContact CZ-CD2 3.92Å; F269-Y288 HydrophobicContact CZ-CD2 3.92Å; F269-Y288 HydrophobicContact CZ-CE2 4.32Å; F269-Y288 HydrophobicContact CZ-CG 4.33Å; F269-L295 HydrophobicContact CB-CD2 4.27Å; F269-L295 HydrophobicContact CG-CD2 4.47Å; F269-F298 HydrophobicContact CB-CD1 3.88Å; F269-F298 HydrophobicContact CB-CE1 3.8Å; F269-F298 HydrophobicContact CB-CE2 4.45Å; F269-F298 HydrophobicContact CB-CG 4.25Å; F269-F298 HydrophobicContact CB-CZ 4.1Å; F269-F298 HydrophobicContact CD2-CB 4.23Å; F269-F298 HydrophobicContact CD2-CD1 4.25Å; F269-F298 AromaticContact CD2-CD2 3.62Å; F269-F298 HydrophobicContact CD2-CD2 3.62Å; F269-F298 AromaticContact CD2-CE2 3.99Å; F269-F298 HydrophobicContact CD2-CE2 3.99Å; F269-F298 AromaticContact CD2-CG 3.75Å; F269-F298 HydrophobicContact CD2-CG 3.75Å; F269-F298 HydrophobicContact CD2-CZ 4.46Å; F269-F298 HydrophobicContact CE2-CD2 4.38Å; F269-F298 HydrophobicContact CG-CG 4.47Å
270	L	97	Very high	94.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-40.4	-179.9	-67.9	171.1	0	0	0	111.3	L136 F166 L170 Y174 V232 L266 M272 I273 A274	L136-L270 HydrophobicContact CD1-CD1 3.77Å; L136-L270 HydrophobicContact CD1-CD2 3.96Å; L136-L270 HydrophobicContact CD2-CD1 3.76Å; L136-L270 HydrophobicContact CG-CD1 4.43Å; F166-L270 HydrophobicContact CE2-CD1 4.22Å; F166-L270 HydrophobicContact CZ-CD1 4.26Å; L170-L270 HydrophobicContact CD1-CB 4.46Å; L170-L270 HydrophobicContact CD1-CD1 3.62Å; L170-L270 HydrophobicContact CD2-CB 3.61Å; L170-L270 HydrophobicContact CD2-CD1 4.3Å; Y174-L270 HydrophobicContact CE2-CB 4Å; Y174-L270 PolarHBondContact OH-O 3.48Å; V232-L270 HydrophobicContact CB-CD2 4.39Å; V232-L270 HydrophobicContact CG1-CD2 3.82Å; L266-L270 HydrophobicContact CD1-CD1 4.12Å; L266-L270 HydrophobicContact CD1-CG 4.22Å; L266-L270 HydrophobicContact CG-CD1 3.96Å; L266-L270 HydrophobicContact CG-CG 4.45Å; L266-L270 WeakPolarHBondContact O-CB 3.34Å; L266-L270 WeakPolarHBondContact O-CG 3.39Å; L266-L270 PolarHBondContact O-N 2.9Å; L270-M272 VanDerWaalsContact C-N 3.3Å; L270-M272 PolarHBondContact O-N 2.96Å; L270-I273 PolarHBondContact O-N 3.28Å; L270-A274 PolarHBondContact O-N 3.32Å
271	R	95.7	Very high	94.9	Very high	89 Å²	89	47.2 Å²	47.2	34%	0.336	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-39.5	172.5	-82.1	169.4	31.2	88.5	11.3	112.6	L170 A267 A268 F269 I273 A274 M275	L170-R271 HydrophobicContact CD2-CG 4.19Å; A267-R271 VanDerWaalsContact O-CB 3.3Å; A267-R271 WeakPolarHBondContact O-CB 3.48Å; A267-R271 VanDerWaalsContact O-CG 3.31Å; A267-R271 WeakPolarHBondContact O-CG 3.45Å; A267-R271 PolarHBondContact O-N 2.93Å; A268-R271 PolarHBondContact O-N 3.32Å; F269-R271 PolarHBondContact O-N 3.48Å; R271-I273 VanDerWaalsContact C-N 3.32Å; R271-I273 PolarHBondContact O-N 3.38Å; R271-A274 PolarHBondContact O-N 2.81Å; R271-M275 VanDerWaalsContact O-CB 3.26Å; R271-M275 WeakPolarHBondContact O-CB 3.32Å; R271-M275 VanDerWaalsContact O-CG 3.25Å; R271-M275 WeakPolarHBondContact O-CG 3.45Å; R271-M275 PolarHBondContact O-N 2.86Å
272	M	94.6	Very high	95.1	Very high	72 Å²	72	41.3 Å²	41.3	36%	0.355	23%	0.231	S	C	.	.	H	α-helix	trans	-59.1	-44.4	176.1	179	-157.4	64.8	0	0	110.9	A268 F269 L270 G276 V284 Y288 F298	A268-M272 PolarHBondContact O-N 2.73Å; F269-M272 HydrophobicContact CD2-CE 4.17Å; F269-M272 HydrophobicContact CE2-CE 4.13Å; F269-M272 WeakPolarHBondContact O-CB 3.45Å; F269-M272 PolarHBondContact O-N 3.49Å; F269-M272 VanDerWaalsContact O-N 3.16Å; L270-M272 VanDerWaalsContact C-N 3.3Å; L270-M272 PolarHBondContact O-N 2.96Å; M272-G276 PolarHBondContact O-N 2.91Å; M272-V284 HydrophobicContact CE-CG1 4.3Å; M272-Y288 HydrophobicContact CE-CE2 4.4Å; M272-F298 HydrophobicContact CE-CE2 4.16Å; M272-F298 HydrophobicContact SD-CD2 4.49Å; M272-F298 HydrophobicContact SD-CE2 3.69Å
273	I	95.7	Very high	95.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-49.9	177	-65.5	173.7	0	0	0	110.6	F269 L270 R271 G276 S277 V278 V281 V284	F269-I273 HydrophobicContact CD1-CD1 4.11Å; F269-I273 HydrophobicContact CE1-CD1 3.49Å; F269-I273 VanDerWaalsContact CE1-CD1 3.49Å; F269-I273 HydrophobicContact CZ-CD1 3.78Å; F269-I273 PolarHBondContact O-N 3.1Å; L270-I273 PolarHBondContact O-N 3.28Å; R271-I273 VanDerWaalsContact C-N 3.32Å; R271-I273 PolarHBondContact O-N 3.38Å; I273-G276 PolarHBondContact O-N 3.47Å; I273-S277 PolarHBondContact O-N 2.97Å; I273-V278 HydrophobicContact CG2-CB 4.38Å; I273-V278 HydrophobicContact CG2-CG2 4.37Å; I273-V281 HydrophobicContact CG2-CB 4.48Å; I273-V281 HydrophobicContact CG2-CG1 3.78Å; I273-V284 HydrophobicContact CD1-CG1 4.3Å; I273-V284 HydrophobicContact CG1-CG1 4.21Å
274	A	95.1	Very high	95.2	Very high	10 Å²	10	46.8 Å²	46.8	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-44.6	-178.3	0	0	0	0	0	113.1	Y134 H173 Y174 L270 R271 G276 S277	Y134-A274 HydrophobicContact CD2-CB 4.27Å; Y134-A274 HydrophobicContact CE2-CB 4.32Å; H173-A274 HydrophobicContact CB-CB 3.79Å; Y174-A274 HydrophobicContact CE2-CB 3.78Å; L270-A274 PolarHBondContact O-N 3.32Å; R271-A274 PolarHBondContact O-N 2.81Å; A274-G276 VanDerWaalsContact C-N 3.33Å; A274-S277 PolarHBondContact O-N 3.15Å
275	M	93.9	Very high	95.3	Very high	108 Å²	108	42.6 Å²	42.6	53%	0.532	24%	0.24	S	C	.	.	H	α-helix	trans	-70.8	-29.7	179.7	-69.2	-177.6	169.9	0	0	112.5	R271 S277	R271-M275 VanDerWaalsContact O-CB 3.26Å; R271-M275 WeakPolarHBondContact O-CB 3.32Å; R271-M275 VanDerWaalsContact O-CG 3.25Å; R271-M275 WeakPolarHBondContact O-CG 3.45Å; R271-M275 PolarHBondContact O-N 2.86Å; M275-S277 PolarHBondContact O-N 3.25Å
276	G	93.4	Very high	95.3	Very high	55 Å²	55	43.2 Å²	43.2	57%	0.567	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.8	173.3	0	0	0	0	0	114	M272 I273 A274 V278	M272-G276 PolarHBondContact O-N 2.91Å; I273-G276 PolarHBondContact O-N 3.47Å; A274-G276 VanDerWaalsContact C-N 3.33Å; G276-V278 PolarHBondContact O-N 3.15Å
277	S	92.5	Very high	95.2	Very high	86 Å²	86	48.7 Å²	48.7	60%	0.601	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	47.5	-176.3	-61.7	0	0	0	0	112.1	Y134 I273 A274 M275 D279	Y134-S277 VanDerWaalsContact OH-C 3.29Å; Y134-S277 WeakPolarHBondContact OH-CA 3.43Å; I273-S277 PolarHBondContact O-N 2.97Å; A274-S277 PolarHBondContact O-N 3.15Å; M275-S277 PolarHBondContact O-N 3.25Å; S277-D279 PolarHBondContact O-N 3.29Å
278	V	93.4	Very high	95	Very high	36 Å²	36	49.8 Å²	49.8	22%	0.218	27%	0.269	C	S	.	.			trans	-64.1	124.5	179.8	-179.2	0	0	0	0	109.7	Y134 I273 G276 D280 V284	Y134-V278 WeakPolarHBondContact CE1-O 3.33Å; Y134-V278 PolarHBondContact OH-N 3.41Å; Y134-V278 PolarHBondContact OH-O 2.95Å; I273-V278 HydrophobicContact CG2-CB 4.38Å; I273-V278 HydrophobicContact CG2-CG2 4.37Å; G276-V278 PolarHBondContact O-N 3.15Å; V278-D280 WeakPolarHBondContact CG1-O 3.47Å; V278-V284 HydrophobicContact CG1-CG2 3.86Å; V278-V284 HydrophobicContact CG2-CG2 4.15Å
279	D	94	Very high	94.8	Very high	135 Å²	135	52.6 Å²	52.6	72%	0.722	27%	0.273	S	S	*	.	S	Bend	trans	-65.3	-44.1	179.9	-69.4	-43.1	0	0	0	112.6	S277	S277-D279 PolarHBondContact O-N 3.29Å
280	D	96.5	Very high	94.5	Very high	33 Å²	33	60 Å²	60	18%	0.176	31%	0.307	C	S	.	.			trans	-127.1	107.1	177.1	-171.3	-9.4	0	0	0	111.1	S229 V278 R282 L283	S229-D280 WeakPolarHBondContact O-CA 3.45Å; V278-D280 WeakPolarHBondContact CG1-O 3.47Å; D280-R282 PolarHBondContact O-N 2.93Å; D280-R282 VanDerWaalsContact OD1-CB 3.25Å; D280-R282 WeakPolarHBondContact OD1-CB 3.28Å; D280-R282 WeakPolarHBondContact OD1-CG 3.44Å; D280-R282 IonicContact OD1-CZ 3.15Å; D280-R282 PolarHBondContact OD1-N 3.15Å; D280-R282 IonicContact OD1-NE 2.63Å; D280-R282 PolarHBondContact OD1-NE 2.8Å; D280-R282 IonicContact OD1-NH2 3.48Å; D280-R282 IonicContact OD2-CZ 2.74Å; D280-R282 VanDerWaalsContact OD2-CZ 3.3Å; D280-R282 IonicContact OD2-NE 2.69Å; D280-R282 PolarHBondContact OD2-NE 3.27Å; D280-R282 VanDerWaalsContact OD2-NE 3.11Å; D280-R282 IonicContact OD2-NH2 3.74Å; D280-R282 PolarHBondContact OD2-NH2 3.38Å; D280-L283 HydrophobicContact CB-CD1 4.38Å; D280-L283 HydrophobicContact CB-CG 4.39Å; D280-L283 PolarHBondContact O-N 3.49Å
281	V	96.8	Very high	94.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63	-24.1	-178.2	-56.4	0	0	0	0	112.6	Y134 S229 V231 V232 I273 L283 V284 L285	Y134-V281 HydrophobicContact CD1-CG1 3.82Å; Y134-V281 HydrophobicContact CE1-CG1 3.72Å; S229-V281 WeakPolarHBondContact O-CG2 3.3Å; S229-V281 PolarHBondContact O-N 2.81Å; V231-V281 WeakPolarHBondContact O-CG2 3.44Å; V232-V281 HydrophobicContact CG2-CB 3.95Å; V232-V281 HydrophobicContact CG2-CG1 4.09Å; V232-V281 HydrophobicContact CG2-CG2 3.85Å; I273-V281 HydrophobicContact CG2-CB 4.48Å; I273-V281 HydrophobicContact CG2-CG1 3.78Å; V281-L283 VanDerWaalsContact C-N 3.25Å; V281-L283 PolarHBondContact O-N 2.89Å; V281-V284 PolarHBondContact O-N 2.82Å; V281-V284 VanDerWaalsContact O-N 3.16Å; V281-L285 HydrophobicContact CG2-CD1 4.29Å; V281-L285 WeakPolarHBondContact O-CG 3.17Å; V281-L285 PolarHBondContact O-N 3.41Å
282	R	96.4	Very high	93.9	Very high	65 Å²	65	67.4 Å²	67.4	25%	0.245	35%	0.35	C	S	.	.	H	α-helix	trans	-63.5	-32.4	-177	-61.5	172.7	-66	-170.5	0.2	111.9	R246 D280 V284 L285 D286	R246-R282 HydrophobicContact CB-CG 4.43Å; D280-R282 PolarHBondContact O-N 2.93Å; D280-R282 VanDerWaalsContact OD1-CB 3.25Å; D280-R282 WeakPolarHBondContact OD1-CB 3.28Å; D280-R282 WeakPolarHBondContact OD1-CG 3.44Å; D280-R282 IonicContact OD1-CZ 3.15Å; D280-R282 PolarHBondContact OD1-N 3.15Å; D280-R282 IonicContact OD1-NE 2.63Å; D280-R282 PolarHBondContact OD1-NE 2.8Å; D280-R282 IonicContact OD1-NH2 3.48Å; D280-R282 IonicContact OD2-CZ 2.74Å; D280-R282 VanDerWaalsContact OD2-CZ 3.3Å; D280-R282 IonicContact OD2-NE 2.69Å; D280-R282 PolarHBondContact OD2-NE 3.27Å; D280-R282 VanDerWaalsContact OD2-NE 3.11Å; D280-R282 IonicContact OD2-NH2 3.74Å; D280-R282 PolarHBondContact OD2-NH2 3.38Å; R282-V284 VanDerWaalsContact C-N 3.33Å; R282-V284 PolarHBondContact O-N 3.05Å; R282-L285 PolarHBondContact O-N 2.77Å; R282-D286 VanDerWaalsContact O-CB 3.23Å; R282-D286 WeakPolarHBondContact O-CB 3.49Å; R282-D286 PolarHBondContact O-N 3.45Å
283	L	95.7	Very high	93.8	Very high	114 Å²	114	67 Å²	67	60%	0.597	35%	0.35	S	S	*	.	H	α-helix	trans	-64.1	-40.5	177.6	-62.6	176.9	0	0	0	111.7	D280 V281 Y287	D280-L283 HydrophobicContact CB-CD1 4.38Å; D280-L283 HydrophobicContact CB-CG 4.39Å; D280-L283 PolarHBondContact O-N 3.49Å; V281-L283 VanDerWaalsContact C-N 3.25Å; V281-L283 PolarHBondContact O-N 2.89Å; L283-Y287 PolarHBondContact O-N 2.88Å
284	V	95.2	Very high	93.7	Very high	30 Å²	30	67.6 Å²	67.6	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-70	-47.9	176.6	-178.2	0	0	0	0	109.5	F269 M272 I273 V278 V281 R282 D286 Y287 Y288	F269-V284 HydrophobicContact CZ-CG1 4.35Å; M272-V284 HydrophobicContact CE-CG1 4.3Å; I273-V284 HydrophobicContact CD1-CG1 4.3Å; I273-V284 HydrophobicContact CG1-CG1 4.21Å; V278-V284 HydrophobicContact CG1-CG2 3.86Å; V278-V284 HydrophobicContact CG2-CG2 4.15Å; V281-V284 PolarHBondContact O-N 2.82Å; V281-V284 VanDerWaalsContact O-N 3.16Å; R282-V284 VanDerWaalsContact C-N 3.33Å; R282-V284 PolarHBondContact O-N 3.05Å; V284-D286 VanDerWaalsContact C-N 3.33Å; V284-D286 PolarHBondContact O-N 2.87Å; V284-Y287 WeakPolarHBondContact O-CB 3.3Å; V284-Y287 PolarHBondContact O-N 3.3Å; V284-Y288 HydrophobicContact CG1-CD2 3.87Å; V284-Y288 HydrophobicContact CG1-CE2 3.73Å; V284-Y288 VanDerWaalsContact O-CD2 3.25Å; V284-Y288 WeakPolarHBondContact O-CD2 3.34Å; V284-Y288 PolarHBondContact O-N 3.43Å
285	L	95.7	Very high	93.6	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-61.7	-39.1	-180	-66.1	177.4	0	0	0	112.9	V232 N247 L249 F269 V281 R282 Y287 Y288 R289	V232-L285 HydrophobicContact CG1-CD1 4.28Å; V232-L285 HydrophobicContact CG1-CD2 4.31Å; V232-L285 HydrophobicContact CG2-CD1 4.45Å; N247-L285 WeakPolarHBondContact O-CD1 3.39Å; L249-L285 HydrophobicContact CB-CD2 4.11Å; L249-L285 HydrophobicContact CD1-CD2 4.44Å; F269-L285 HydrophobicContact CE1-CD2 4.05Å; F269-L285 HydrophobicContact CZ-CD2 4.15Å; V281-L285 HydrophobicContact CG2-CD1 4.29Å; V281-L285 WeakPolarHBondContact O-CG 3.17Å; V281-L285 PolarHBondContact O-N 3.41Å; R282-L285 PolarHBondContact O-N 2.77Å; L285-Y287 VanDerWaalsContact C-N 3.33Å; L285-Y287 PolarHBondContact O-N 3.26Å; L285-Y288 PolarHBondContact O-N 3.5Å; L285-R289 WeakPolarHBondContact O-CB 3.43Å; L285-R289 PolarHBondContact O-N 3.22Å
286	D	95	Very high	93.5	Very high	38 Å²	38	63.3 Å²	63.3	20%	0.203	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-39.8	177.6	-72.7	-21.8	0	0	0	111.1	R246 R282 V284 R289	R246-D286 IonicContact CZ-OD2 3.92Å; R246-D286 VanDerWaalsContact CZ-OD2 3.24Å; R246-D286 IonicContact NE-OD1 2.78Å; R246-D286 IonicContact NE-OD2 3.84Å; R246-D286 PolarHBondContact NE-OD2 2.78Å; R246-D286 IonicContact NH2-OD2 3.57Å; R246-D286 PolarHBondContact NH2-OD2 3.41Å; R282-D286 VanDerWaalsContact O-CB 3.23Å; R282-D286 WeakPolarHBondContact O-CB 3.49Å; R282-D286 PolarHBondContact O-N 3.45Å; V284-D286 VanDerWaalsContact C-N 3.33Å; V284-D286 PolarHBondContact O-N 2.87Å; D286-R289 PolarHBondContact O-N 2.98Å; D286-R289 IonicContact OD1-CZ 2.58Å; D286-R289 IonicContact OD1-NH1 2.69Å; D286-R289 PolarHBondContact OD1-NH1 3.47Å; D286-R289 IonicContact OD1-NH2 3.56Å
287	Y	94.3	Very high	93.6	Very high	116 Å²	116	62.2 Å²	62.2	46%	0.455	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-47.2	174.7	174.6	-104.1	0	0	0	112.6	L283 V284 L285 R289 F291 F297	L283-Y287 PolarHBondContact O-N 2.88Å; V284-Y287 WeakPolarHBondContact O-CB 3.3Å; V284-Y287 PolarHBondContact O-N 3.3Å; L285-Y287 VanDerWaalsContact C-N 3.33Å; L285-Y287 PolarHBondContact O-N 3.26Å; Y287-R289 VanDerWaalsContact C-N 3.33Å; Y287-R289 PolarHBondContact O-N 3.3Å; Y287-F291 HydrophobicContact CE1-CE2 4.38Å; Y287-F291 WeakPolarHBondContact O-CE2 3.15Å; Y287-F297 AromaticContact CE1-CE1 3.95Å; Y287-F297 HydrophobicContact CE1-CE1 3.95Å
288	Y	93.2	Very high	93.6	Very high	24 Å²	24	58.4 Å²	58.4	9%	0.094	29%	0.287	C	S	.	.	H	α-helix	trans	-74.8	-21.5	-178.7	-74.6	-82.6	0	0	0	113.3	F269 M272 V284 L285 E290 F291 F297 F298	F269-Y288 HydrophobicContact CE2-CD1 4.26Å; F269-Y288 AromaticContact CE2-CD2 3.54Å; F269-Y288 HydrophobicContact CE2-CD2 3.54Å; F269-Y288 HydrophobicContact CE2-CE1 4.28Å; F269-Y288 AromaticContact CE2-CE2 3.58Å; F269-Y288 HydrophobicContact CE2-CE2 3.58Å; F269-Y288 AromaticContact CE2-CG 3.92Å; F269-Y288 HydrophobicContact CE2-CG 3.92Å; F269-Y288 AromaticContact CE2-CZ 3.96Å; F269-Y288 AromaticContact CZ-CD2 3.92Å; F269-Y288 HydrophobicContact CZ-CD2 3.92Å; F269-Y288 HydrophobicContact CZ-CE2 4.32Å; F269-Y288 HydrophobicContact CZ-CG 4.33Å; M272-Y288 HydrophobicContact CE-CE2 4.4Å; V284-Y288 HydrophobicContact CG1-CD2 3.87Å; V284-Y288 HydrophobicContact CG1-CE2 3.73Å; V284-Y288 VanDerWaalsContact O-CD2 3.25Å; V284-Y288 WeakPolarHBondContact O-CD2 3.34Å; V284-Y288 PolarHBondContact O-N 3.43Å; L285-Y288 PolarHBondContact O-N 3.5Å; Y288-E290 PolarHBondContact O-N 3.05Å; Y288-F291 PolarHBondContact O-N 3.35Å; Y288-F297 AromaticContact CD1-CD1 3.87Å; Y288-F297 HydrophobicContact CD1-CD1 3.87Å; Y288-F297 HydrophobicContact CD1-CE1 4.43Å; Y288-F297 AromaticContact CE1-CD1 3.84Å; Y288-F297 HydrophobicContact CE1-CD1 3.84Å; Y288-F297 HydrophobicContact CE1-CE1 4.18Å; Y288-F298 HydrophobicContact CD1-CB 4.38Å; Y288-F298 HydrophobicContact CE1-CB 3.89Å; Y288-F298 HydrophobicContact CE1-CD2 4.16Å
289	R	90	Very high	93.6	Very high	90 Å²	90	61.1 Å²	61.1	34%	0.34	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-20.6	177.2	-171.2	-179.2	-60.6	117.6	20.5	113.1	P245 R246 S248 L285 D286 Y287 F291	P245-R289 PolarHBondContact O-NH2 2.74Å; R246-R289 VanDerWaalsContact C-NH2 3.29Å; R246-R289 VanDerWaalsContact CA-NH2 3.3Å; R246-R289 PolarHBondContact O-NH2 2.89Å; S248-R289 PolarHBondContact O-NH2 3.09Å; L285-R289 WeakPolarHBondContact O-CB 3.43Å; L285-R289 PolarHBondContact O-N 3.22Å; D286-R289 PolarHBondContact O-N 2.98Å; D286-R289 IonicContact OD1-CZ 2.58Å; D286-R289 IonicContact OD1-NH1 2.69Å; D286-R289 PolarHBondContact OD1-NH1 3.47Å; D286-R289 IonicContact OD1-NH2 3.56Å; Y287-R289 VanDerWaalsContact C-N 3.33Å; Y287-R289 PolarHBondContact O-N 3.3Å; R289-F291 PolarHBondContact O-N 2.86Å
290	E	90.4	Very high	93.6	Very high	158 Å²	158	60.3 Å²	60.3	74%	0.738	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.2	178.5	-63.3	-174.6	169	0	0	113	Y288	Y288-E290 PolarHBondContact O-N 3.05Å
291	F	91.7	Very high	93.5	Very high	66 Å²	66	62 Å²	62	29%	0.289	29%	0.291	S	S	.	.	S	Bend	trans	-101.2	146.2	-178.9	-54.9	-82.7	0	0	0	111.8	Y287 Y288 R289 D293 F297	Y287-F291 HydrophobicContact CE1-CE2 4.38Å; Y287-F291 WeakPolarHBondContact O-CE2 3.15Å; Y288-F291 PolarHBondContact O-N 3.35Å; R289-F291 PolarHBondContact O-N 2.86Å; F291-D293 VanDerWaalsContact C-N 3.32Å; F291-D293 PolarHBondContact O-N 3.38Å; F291-F297 HydrophobicContact CB-CB 4.31Å; F291-F297 HydrophobicContact CD1-CD1 4.43Å; F291-F297 AromaticContact CD1-CD2 3.79Å; F291-F297 HydrophobicContact CD1-CD2 3.79Å; F291-F297 HydrophobicContact CD1-CE2 4.05Å; F291-F297 AromaticContact CD1-CG 3.99Å; F291-F297 HydrophobicContact CD1-CG 3.99Å; F291-F297 HydrophobicContact CD1-CZ 4.47Å; F291-F297 AromaticContact CD2-CD1 3.72Å; F291-F297 HydrophobicContact CD2-CD1 3.72Å; F291-F297 HydrophobicContact CD2-CE1 4Å; F291-F297 AromaticContact CD2-CG 4Å; F291-F297 HydrophobicContact CD2-CG 4Å; F291-F297 HydrophobicContact CE1-CD1 4.39Å; F291-F297 AromaticContact CE1-CD2 3.76Å; F291-F297 HydrophobicContact CE1-CD2 3.76Å; F291-F297 HydrophobicContact CE1-CE1 4.17Å; F291-F297 AromaticContact CE1-CE2 3.5Å; F291-F297 HydrophobicContact CE1-CE2 3.5Å; F291-F297 VanDerWaalsContact CE1-CE2 3.5Å; F291-F297 HydrophobicContact CE1-CG 4.19Å; F291-F297 AromaticContact CE1-CZ 3.72Å; F291-F297 HydrophobicContact CE1-CZ 3.72Å; F291-F297 AromaticContact CE2-CD1 3.67Å; F291-F297 HydrophobicContact CE2-CD1 3.67Å; F291-F297 HydrophobicContact CE2-CD2 4.5Å; F291-F297 AromaticContact CE2-CE1 3.44Å; F291-F297 HydrophobicContact CE2-CE1 3.44Å; F291-F297 VanDerWaalsContact CE2-CE1 3.44Å; F291-F297 HydrophobicContact CE2-CE2 4.3Å; F291-F297 HydrophobicContact CE2-CG 4.2Å; F291-F297 AromaticContact CE2-CZ 3.78Å; F291-F297 HydrophobicContact CE2-CZ 3.78Å; F291-F297 HydrophobicContact CG-CB 4.2Å; F291-F297 HydrophobicContact CG-CD1 4.12Å; F291-F297 HydrophobicContact CG-CD2 4.19Å; F291-F297 AromaticContact CG-CG 3.89Å; F291-F297 HydrophobicContact CG-CG 3.89Å; F291-F297 HydrophobicContact CZ-CD1 4.03Å; F291-F297 HydrophobicContact CZ-CD2 4.13Å; F291-F297 AromaticContact CZ-CE1 3.54Å; F291-F297 HydrophobicContact CZ-CE1 3.54Å; F291-F297 AromaticContact CZ-CE2 3.65Å; F291-F297 HydrophobicContact CZ-CE2 3.65Å; F291-F297 HydrophobicContact CZ-CG 4.3Å; F291-F297 AromaticContact CZ-CZ 3.32Å; F291-F297 HydrophobicContact CZ-CZ 3.32Å
292	D	89.5	Confident	93.2	Very high	178 Å²	178	66.1 Å²	66.1	95%	0.952	31%	0.31	S	S	*	.	S	Bend	trans	-61.9	-38.1	-179.7	-67.5	-35	0	0	0	113
293	D	91.8	Very high	93.1	Very high	64 Å²	64	68.2 Å²	68.2	34%	0.342	32%	0.323	S	S	.	.	S	Bend	trans	-125.3	93.8	173.3	-174.1	-15.7	0	0	0	109.6	F291 L295 A296 F297	F291-D293 VanDerWaalsContact C-N 3.32Å; F291-D293 PolarHBondContact O-N 3.38Å; D293-L295 PolarHBondContact O-N 2.9Å; D293-L295 PolarHBondContact OD1-N 3.46Å; D293-L295 VanDerWaalsContact OD1-N 3.13Å; D293-A296 HydrophobicContact CB-CB 3.88Å; D293-A296 PolarHBondContact O-N 3.45Å; D293-A296 PolarHBondContact OD1-N 2.9Å; D293-A296 VanDerWaalsContact OD2-CB 3.3Å; D293-A296 WeakPolarHBondContact OD2-CB 3.45Å; D293-F297 PolarHBondContact O-N 3.5Å; D293-F297 VanDerWaalsContact O-N 3.1Å
294	P	92.7	Very high	93	Very high	12 Å²	12	67 Å²	67	8%	0.078	31%	0.314	C	S	.	.	H	α-helix	trans	-56.2	-36.1	-179.3	-29.1	36.7	0	0	0	113.8	L249 F298	L249-P294 HydrophobicContact CD1-CB 3.71Å; L249-P294 HydrophobicContact CD1-CG 4.17Å; P294-F298 WeakPolarHBondContact O-CB 3.34Å; P294-F298 PolarHBondContact O-N 3.49Å
295	L	93.6	Very high	92.9	Very high	4 Å²	4	70.2 Å²	70.2	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-80.4	-38.4	-175.7	-69.8	-178.5	0	0	0	111.8	L249 I251 E262 L266 F269 D293 F297 F298 R299	L249-L295 HydrophobicContact CD2-CD2 4.35Å; I251-L295 HydrophobicContact CB-CD1 4.35Å; I251-L295 HydrophobicContact CG2-CD1 3.71Å; I251-L295 HydrophobicContact CG2-CG 4.28Å; E262-L295 HydrophobicContact CB-CD1 4.44Å; L266-L295 HydrophobicContact CB-CD1 4.08Å; L266-L295 HydrophobicContact CB-CD2 4.3Å; L266-L295 HydrophobicContact CD1-CD1 4.39Å; L266-L295 HydrophobicContact CD1-CD2 4.02Å; F269-L295 HydrophobicContact CB-CD2 4.27Å; F269-L295 HydrophobicContact CG-CD2 4.47Å; D293-L295 PolarHBondContact O-N 2.9Å; D293-L295 PolarHBondContact OD1-N 3.46Å; D293-L295 VanDerWaalsContact OD1-N 3.13Å; L295-F297 VanDerWaalsContact C-N 3.34Å; L295-F298 PolarHBondContact O-N 2.94Å; L295-R299 WeakPolarHBondContact O-CB 3.31Å; L295-R299 PolarHBondContact O-N 3.26Å
296	A	92.9	Very high	92.8	Very high	25 Å²	25	75 Å²	75	21%	0.207	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-43.4	172.8	0	0	0	0	0	111.5	D293 R299 E300	D293-A296 HydrophobicContact CB-CB 3.88Å; D293-A296 PolarHBondContact O-N 3.45Å; D293-A296 PolarHBondContact OD1-N 2.9Å; D293-A296 VanDerWaalsContact OD2-CB 3.3Å; D293-A296 WeakPolarHBondContact OD2-CB 3.45Å; A296-R299 PolarHBondContact O-N 2.9Å; A296-E300 PolarHBondContact O-N 3.23Å
297	F	93.7	Very high	92.8	Very high	31 Å²	31	78.7 Å²	78.7	14%	0.136	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-43.5	175.1	-179.6	-100.7	0	0	0	111.9	Y287 Y288 F291 D293 L295 R299 E300 K301	Y287-F297 AromaticContact CE1-CE1 3.95Å; Y287-F297 HydrophobicContact CE1-CE1 3.95Å; Y288-F297 AromaticContact CD1-CD1 3.87Å; Y288-F297 HydrophobicContact CD1-CD1 3.87Å; Y288-F297 HydrophobicContact CD1-CE1 4.43Å; Y288-F297 AromaticContact CE1-CD1 3.84Å; Y288-F297 HydrophobicContact CE1-CD1 3.84Å; Y288-F297 HydrophobicContact CE1-CE1 4.18Å; F291-F297 HydrophobicContact CB-CB 4.31Å; F291-F297 HydrophobicContact CD1-CD1 4.43Å; F291-F297 AromaticContact CD1-CD2 3.79Å; F291-F297 HydrophobicContact CD1-CD2 3.79Å; F291-F297 HydrophobicContact CD1-CE2 4.05Å; F291-F297 AromaticContact CD1-CG 3.99Å; F291-F297 HydrophobicContact CD1-CG 3.99Å; F291-F297 HydrophobicContact CD1-CZ 4.47Å; F291-F297 AromaticContact CD2-CD1 3.72Å; F291-F297 HydrophobicContact CD2-CD1 3.72Å; F291-F297 HydrophobicContact CD2-CE1 4Å; F291-F297 AromaticContact CD2-CG 4Å; F291-F297 HydrophobicContact CD2-CG 4Å; F291-F297 HydrophobicContact CE1-CD1 4.39Å; F291-F297 AromaticContact CE1-CD2 3.76Å; F291-F297 HydrophobicContact CE1-CD2 3.76Å; F291-F297 HydrophobicContact CE1-CE1 4.17Å; F291-F297 AromaticContact CE1-CE2 3.5Å; F291-F297 HydrophobicContact CE1-CE2 3.5Å; F291-F297 VanDerWaalsContact CE1-CE2 3.5Å; F291-F297 HydrophobicContact CE1-CG 4.19Å; F291-F297 AromaticContact CE1-CZ 3.72Å; F291-F297 HydrophobicContact CE1-CZ 3.72Å; F291-F297 AromaticContact CE2-CD1 3.67Å; F291-F297 HydrophobicContact CE2-CD1 3.67Å; F291-F297 HydrophobicContact CE2-CD2 4.5Å; F291-F297 AromaticContact CE2-CE1 3.44Å; F291-F297 HydrophobicContact CE2-CE1 3.44Å; F291-F297 VanDerWaalsContact CE2-CE1 3.44Å; F291-F297 HydrophobicContact CE2-CE2 4.3Å; F291-F297 HydrophobicContact CE2-CG 4.2Å; F291-F297 AromaticContact CE2-CZ 3.78Å; F291-F297 HydrophobicContact CE2-CZ 3.78Å; F291-F297 HydrophobicContact CG-CB 4.2Å; F291-F297 HydrophobicContact CG-CD1 4.12Å; F291-F297 HydrophobicContact CG-CD2 4.19Å; F291-F297 AromaticContact CG-CG 3.89Å; F291-F297 HydrophobicContact CG-CG 3.89Å; F291-F297 HydrophobicContact CZ-CD1 4.03Å; F291-F297 HydrophobicContact CZ-CD2 4.13Å; F291-F297 AromaticContact CZ-CE1 3.54Å; F291-F297 HydrophobicContact CZ-CE1 3.54Å; F291-F297 AromaticContact CZ-CE2 3.65Å; F291-F297 HydrophobicContact CZ-CE2 3.65Å; F291-F297 HydrophobicContact CZ-CG 4.3Å; F291-F297 AromaticContact CZ-CZ 3.32Å; F291-F297 HydrophobicContact CZ-CZ 3.32Å; D293-F297 PolarHBondContact O-N 3.5Å; D293-F297 VanDerWaalsContact O-N 3.1Å; L295-F297 VanDerWaalsContact C-N 3.34Å; F297-R299 VanDerWaalsContact C-N 3.34Å; F297-R299 PolarHBondContact O-N 2.86Å; F297-E300 PolarHBondContact O-N 3.4Å; F297-K301 HydrophobicContact CD1-CG 4.3Å; F297-K301 HydrophobicContact CE1-CG 3.81Å; F297-K301 HydrophobicContact CE2-CG 4.13Å; F297-K301 HydrophobicContact CZ-CD 4.18Å; F297-K301 HydrophobicContact CZ-CG 3.72Å; F297-K301 WeakPolarHBondContact O-CG 3.41Å; F297-K301 PolarHBondContact O-N 3.39Å
298	F	94.4	Very high	92.8	Very high	6 Å²	6	76.1 Å²	76.1	3%	0.026	36%	0.363	C	S	.	.	H	α-helix	trans	-58.5	-44.8	174.2	171.1	-104.3	0	0	0	112.1	A268 F269 M272 Y288 P294 L295 K301 H302	A268-F298 HydrophobicContact CB-CE1 3.92Å; A268-F298 HydrophobicContact CB-CZ 4.34Å; F269-F298 HydrophobicContact CB-CD1 3.88Å; F269-F298 HydrophobicContact CB-CE1 3.8Å; F269-F298 HydrophobicContact CB-CE2 4.45Å; F269-F298 HydrophobicContact CB-CG 4.25Å; F269-F298 HydrophobicContact CB-CZ 4.1Å; F269-F298 HydrophobicContact CD2-CB 4.23Å; F269-F298 HydrophobicContact CD2-CD1 4.25Å; F269-F298 AromaticContact CD2-CD2 3.62Å; F269-F298 HydrophobicContact CD2-CD2 3.62Å; F269-F298 AromaticContact CD2-CE2 3.99Å; F269-F298 HydrophobicContact CD2-CE2 3.99Å; F269-F298 AromaticContact CD2-CG 3.75Å; F269-F298 HydrophobicContact CD2-CG 3.75Å; F269-F298 HydrophobicContact CD2-CZ 4.46Å; F269-F298 HydrophobicContact CE2-CD2 4.38Å; F269-F298 HydrophobicContact CG-CG 4.47Å; M272-F298 HydrophobicContact CE-CE2 4.16Å; M272-F298 HydrophobicContact SD-CD2 4.49Å; M272-F298 HydrophobicContact SD-CE2 3.69Å; Y288-F298 HydrophobicContact CD1-CB 4.38Å; Y288-F298 HydrophobicContact CE1-CB 3.89Å; Y288-F298 HydrophobicContact CE1-CD2 4.16Å; P294-F298 WeakPolarHBondContact O-CB 3.34Å; P294-F298 PolarHBondContact O-N 3.49Å; L295-F298 PolarHBondContact O-N 2.94Å; F298-K301 PolarHBondContact O-N 2.73Å; F298-H302 HydrophobicContact CE1-CB 4.5Å; F298-H302 HydrophobicContact CZ-CB 4.35Å; F298-H302 VanDerWaalsContact O-CB 3.25Å; F298-H302 WeakPolarHBondContact O-CB 3.36Å; F298-H302 PolarHBondContact O-N 3.48Å
299	R	93.2	Very high	92.9	Very high	93 Å²	93	80.6 Å²	80.6	35%	0.351	39%	0.385	S	S	.	.	H	α-helix	trans	-59.8	-48.9	178.5	179.4	176.4	60.6	-126.1	-5.4	111.5	D265 L295 A296 F297 K301 H302 E303	D265-R299 IonicContact OD2-CZ 3.79Å; D265-R299 IonicContact OD2-NH1 2.66Å; D265-R299 PolarHBondContact OD2-NH1 3.42Å; L295-R299 WeakPolarHBondContact O-CB 3.31Å; L295-R299 PolarHBondContact O-N 3.26Å; A296-R299 PolarHBondContact O-N 2.9Å; F297-R299 VanDerWaalsContact C-N 3.34Å; F297-R299 PolarHBondContact O-N 2.86Å; R299-K301 VanDerWaalsContact C-N 3.35Å; R299-K301 PolarHBondContact O-N 3.43Å; R299-H302 PolarHBondContact O-N 2.89Å; R299-E303 WeakPolarHBondContact CG-OE1 3.4Å; R299-E303 WeakPolarHBondContact O-CG 3.34Å; R299-E303 PolarHBondContact O-N 3.4Å
300	E	93.8	Very high	93.1	Very high	118 Å²	118	78.6 Å²	78.6	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-58.3	-46.5	177.4	-175.9	-176.4	170.4	0	0	111.4	A296 F297 H302 E303 E304	A296-E300 PolarHBondContact O-N 3.23Å; F297-E300 PolarHBondContact O-N 3.4Å; E300-H302 PolarHBondContact O-N 2.88Å; E300-E303 PolarHBondContact O-N 3.08Å; E300-E304 WeakPolarHBondContact O-CB 3.41Å; E300-E304 PolarHBondContact O-N 3.24Å
301	K	92.9	Very high	93.4	Very high	69 Å²	69	76.7 Å²	76.7	30%	0.3	38%	0.376	S	S	.	.	H	α-helix	trans	-65.8	-38.2	177.7	-73.1	-70.3	160.1	-154.4	0	112.6	F297 F298 R299 E304 L305	F297-K301 HydrophobicContact CD1-CG 4.3Å; F297-K301 HydrophobicContact CE1-CG 3.81Å; F297-K301 HydrophobicContact CE2-CG 4.13Å; F297-K301 HydrophobicContact CZ-CD 4.18Å; F297-K301 HydrophobicContact CZ-CG 3.72Å; F297-K301 WeakPolarHBondContact O-CG 3.41Å; F297-K301 PolarHBondContact O-N 3.39Å; F298-K301 PolarHBondContact O-N 2.73Å; R299-K301 VanDerWaalsContact C-N 3.35Å; R299-K301 PolarHBondContact O-N 3.43Å; K301-E304 IonicContact NZ-OE2 2.74Å; K301-E304 PolarHBondContact NZ-OE2 3.34Å; K301-E304 PolarHBondContact O-N 2.98Å; K301-L305 WeakPolarHBondContact O-CB 3.42Å; K301-L305 VanDerWaalsContact O-CG 3.23Å; K301-L305 WeakPolarHBondContact O-CG 3.31Å; K301-L305 PolarHBondContact O-N 2.92Å
302	H	91.7	Very high	93.6	Very high	86 Å²	86	81.3 Å²	81.3	40%	0.398	39%	0.392	S	S	.	.	H	α-helix	trans	-64.5	-43.9	176.9	-169.7	71.8	0	0	0	111.1	F298 R299 E300 L305 M306	F298-H302 HydrophobicContact CE1-CB 4.5Å; F298-H302 HydrophobicContact CZ-CB 4.35Å; F298-H302 VanDerWaalsContact O-CB 3.25Å; F298-H302 WeakPolarHBondContact O-CB 3.36Å; F298-H302 PolarHBondContact O-N 3.48Å; R299-H302 PolarHBondContact O-N 2.89Å; E300-H302 PolarHBondContact O-N 2.88Å; H302-L305 PolarHBondContact O-N 3.3Å; H302-M306 WeakPolarHBondContact O-CB 3.23Å; H302-M306 WeakPolarHBondContact O-CG 3.41Å; H302-M306 PolarHBondContact O-N 3.49Å
303	E	92.9	Very high	93.8	Very high	110 Å²	110	79.3 Å²	79.3	51%	0.514	38%	0.375	S	S	.	.	H	α-helix	trans	-61.2	-47.9	174.8	-72.2	172.3	-174.5	0	0	111.6	R299 E300 L305 M306 E307	R299-E303 WeakPolarHBondContact CG-OE1 3.4Å; R299-E303 WeakPolarHBondContact O-CG 3.34Å; R299-E303 PolarHBondContact O-N 3.4Å; E300-E303 PolarHBondContact O-N 3.08Å; E303-L305 VanDerWaalsContact C-N 3.35Å; E303-L305 PolarHBondContact O-N 3.46Å; E303-M306 PolarHBondContact O-N 2.82Å; E303-E307 PolarHBondContact O-N 2.92Å
304	E	94.3	Very high	94	Very high	87 Å²	87	81.2 Å²	81.2	41%	0.407	38%	0.382	S	S	.	.	H	α-helix	trans	-56.5	-46.8	176.6	-173.8	-175.1	178.9	0	0	111.7	E300 K301 M306 E307 I308	E300-E304 WeakPolarHBondContact O-CB 3.41Å; E300-E304 PolarHBondContact O-N 3.24Å; K301-E304 IonicContact NZ-OE2 2.74Å; K301-E304 PolarHBondContact NZ-OE2 3.34Å; K301-E304 PolarHBondContact O-N 2.98Å; E304-M306 PolarHBondContact O-N 3.03Å; E304-E307 PolarHBondContact O-N 2.87Å; E304-I308 HydrophobicContact CG-CD1 4.06Å; E304-I308 VanDerWaalsContact O-CG1 3.27Å; E304-I308 WeakPolarHBondContact O-CG1 3.33Å; E304-I308 PolarHBondContact O-N 3.37Å
305	L	93.4	Very high	94	Very high	98 Å²	98	86.8 Å²	86.8	51%	0.513	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-41.2	178.3	-71.6	173.3	0	0	0	112.2	K301 H302 E303 I308 Q309	K301-L305 WeakPolarHBondContact O-CB 3.42Å; K301-L305 VanDerWaalsContact O-CG 3.23Å; K301-L305 WeakPolarHBondContact O-CG 3.31Å; K301-L305 PolarHBondContact O-N 2.92Å; H302-L305 PolarHBondContact O-N 3.3Å; E303-L305 VanDerWaalsContact C-N 3.35Å; E303-L305 PolarHBondContact O-N 3.46Å; L305-I308 PolarHBondContact O-N 3.47Å; L305-Q309 WeakPolarHBondContact O-CB 3.24Å; L305-Q309 VanDerWaalsContact O-CG 3.29Å; L305-Q309 WeakPolarHBondContact O-CG 3.35Å; L305-Q309 PolarHBondContact O-N 3.2Å
306	M	92.6	Very high	94.1	Very high	103 Å²	103	91.1 Å²	91.1	51%	0.507	43%	0.434	S	S	.	.	H	α-helix	trans	-65.5	-40	178.2	-71.4	-67	-78.1	0	0	111.6	H302 E303 E304 Q309 A310	H302-M306 WeakPolarHBondContact O-CB 3.23Å; H302-M306 WeakPolarHBondContact O-CG 3.41Å; H302-M306 PolarHBondContact O-N 3.49Å; E303-M306 PolarHBondContact O-N 2.82Å; E304-M306 PolarHBondContact O-N 3.03Å; M306-Q309 PolarHBondContact O-N 3.36Å; M306-A310 WeakPolarHBondContact O-CB 3.2Å; M306-A310 PolarHBondContact O-N 3.43Å
307	E	95.2	Very high	94.1	Very high	115 Å²	115	95 Å²	95	54%	0.537	45%	0.447	S	S	.	.	H	α-helix	trans	-63.2	-43.7	173.6	-73.3	-168.3	-176.6	0	0	112.5	E303 E304 Q309 A310 K311	E303-E307 PolarHBondContact O-N 2.92Å; E304-E307 PolarHBondContact O-N 2.87Å; E307-Q309 VanDerWaalsContact C-N 3.32Å; E307-Q309 PolarHBondContact O-N 3.24Å; E307-A310 PolarHBondContact O-N 3.36Å; E307-K311 WeakPolarHBondContact O-CB 3.09Å; E307-K311 WeakPolarHBondContact O-CG 3.41Å; E307-K311 PolarHBondContact O-N 2.9Å; E307-K311 IonicContact OE2-NZ 3.46Å
308	I	95.6	Very high	94	Very high	61 Å²	61	99.7 Å²	99.7	31%	0.313	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-44.2	177.2	-69.7	166	0	0	0	110	E304 L305 K311 R312	E304-I308 HydrophobicContact CG-CD1 4.06Å; E304-I308 VanDerWaalsContact O-CG1 3.27Å; E304-I308 WeakPolarHBondContact O-CG1 3.33Å; E304-I308 PolarHBondContact O-N 3.37Å; L305-I308 PolarHBondContact O-N 3.47Å; I308-K311 PolarHBondContact O-N 3.26Å; I308-R312 WeakPolarHBondContact O-CB 3.37Å; I308-R312 WeakPolarHBondContact O-CG 3.35Å; I308-R312 PolarHBondContact O-N 3.35Å
309	Q	94.2	Very high	93.8	Very high	119 Å²	119	102 Å²	102	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-64	-41.9	176.9	-72.6	178.7	7.4	0	0	112.1	L305 M306 E307 R312 K313	L305-Q309 WeakPolarHBondContact O-CB 3.24Å; L305-Q309 VanDerWaalsContact O-CG 3.29Å; L305-Q309 WeakPolarHBondContact O-CG 3.35Å; L305-Q309 PolarHBondContact O-N 3.2Å; M306-Q309 PolarHBondContact O-N 3.36Å; E307-Q309 VanDerWaalsContact C-N 3.32Å; E307-Q309 PolarHBondContact O-N 3.24Å; Q309-R312 PolarHBondContact O-N 3.49Å; Q309-K313 WeakPolarHBondContact O-CB 3.47Å; Q309-K313 PolarHBondContact O-N 2.91Å
310	A	95.5	Very high	93.7	Very high	48 Å²	48	102.6 Å²	102.6	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-44.1	176.7	0	0	0	0	0	112	M306 E307 K313 Q314	M306-A310 WeakPolarHBondContact O-CB 3.2Å; M306-A310 PolarHBondContact O-N 3.43Å; E307-A310 PolarHBondContact O-N 3.36Å; A310-K313 PolarHBondContact O-N 3.04Å; A310-Q314 WeakPolarHBondContact O-CG 3.44Å; A310-Q314 PolarHBondContact O-N 2.92Å
311	K	96.1	Very high	93.4	Very high	117 Å²	117	100.3 Å²	100.3	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-60.7	-47.8	175.2	-73.2	169.8	-174.6	160.9	0	111.3	E307 I308 K313 Q314 E315	E307-K311 WeakPolarHBondContact O-CB 3.09Å; E307-K311 WeakPolarHBondContact O-CG 3.41Å; E307-K311 PolarHBondContact O-N 2.9Å; E307-K311 IonicContact OE2-NZ 3.46Å; I308-K311 PolarHBondContact O-N 3.26Å; K311-K313 VanDerWaalsContact C-N 3.33Å; K311-K313 PolarHBondContact O-N 3.46Å; K311-Q314 PolarHBondContact O-N 2.95Å; K311-E315 WeakPolarHBondContact O-CG 3.44Å; K311-E315 PolarHBondContact O-N 2.85Å
312	R	95	Very high	93	Very high	163 Å²	163	104.4 Å²	104.4	62%	0.615	51%	0.512	S	S	*	.	H	α-helix	trans	-59.4	-40.8	176.5	-75	179.2	-178.9	-178.2	2.9	112.7	I308 Q309 E315 T316	I308-R312 WeakPolarHBondContact O-CB 3.37Å; I308-R312 WeakPolarHBondContact O-CG 3.35Å; I308-R312 PolarHBondContact O-N 3.35Å; Q309-R312 PolarHBondContact O-N 3.49Å; R312-E315 PolarHBondContact O-N 2.65Å; R312-T316 WeakPolarHBondContact O-CB 3.46Å; R312-T316 PolarHBondContact O-N 3.04Å; R312-T316 PolarHBondContact O-OG1 2.88Å
313	K	95.1	Very high	92.2	Very high	136 Å²	136	111 Å²	111	59%	0.591	53%	0.534	S	S	*	.	H	α-helix	trans	-62.9	-47.4	176	-172.4	179.1	176.7	-175.6	0	111.4	Q309 A310 K311 E315 T316 E317	Q309-K313 WeakPolarHBondContact O-CB 3.47Å; Q309-K313 PolarHBondContact O-N 2.91Å; A310-K313 PolarHBondContact O-N 3.04Å; K311-K313 VanDerWaalsContact C-N 3.33Å; K311-K313 PolarHBondContact O-N 3.46Å; K313-E315 VanDerWaalsContact C-N 3.33Å; K313-E315 PolarHBondContact O-N 3.17Å; K313-T316 PolarHBondContact O-N 3.45Å; K313-E317 WeakPolarHBondContact CE-OE1 3.26Å; K313-E317 WeakPolarHBondContact O-CG 3.28Å; K313-E317 PolarHBondContact O-N 2.8Å
314	Q	95	Very high	90.9	Very high	104 Å²	104	111.6 Å²	111.6	49%	0.486	54%	0.539	S	S	.	.	H	α-helix	trans	-62.1	-38.9	176.8	-70.3	179.4	9.4	0	0	112.5	A310 K311 K318	A310-Q314 WeakPolarHBondContact O-CG 3.44Å; A310-Q314 PolarHBondContact O-N 2.92Å; K311-Q314 PolarHBondContact O-N 2.95Å; Q314-K318 WeakPolarHBondContact O-CB 3.44Å; Q314-K318 VanDerWaalsContact O-CG 3.25Å; Q314-K318 WeakPolarHBondContact O-CG 3.45Å; Q314-K318 PolarHBondContact O-N 2.9Å
315	E	93.9	Very high	89.1	Confident	129 Å²	129	116.9 Å²	116.9	60%	0.603	56%	0.555	S	S	*	*	H	α-helix	trans	-64.6	-41.7	175.2	-74.1	175.3	174.5	0	0	111.9	K311 R312 K313 K318 A319	K311-E315 WeakPolarHBondContact O-CG 3.44Å; K311-E315 PolarHBondContact O-N 2.85Å; R312-E315 PolarHBondContact O-N 2.65Å; K313-E315 VanDerWaalsContact C-N 3.33Å; K313-E315 PolarHBondContact O-N 3.17Å; E315-K318 PolarHBondContact O-N 3.37Å; E315-A319 WeakPolarHBondContact O-CB 3.4Å; E315-A319 PolarHBondContact O-N 3.17Å
316	T	93.8	Very high	87.2	Confident	96 Å²	96	117 Å²	117	59%	0.589	56%	0.562	S	S	*	*	H	α-helix	trans	-64.6	-43.2	177.3	-54.5	0	0	0	0	111.1	R312 K313 A319 L320	R312-T316 WeakPolarHBondContact O-CB 3.46Å; R312-T316 PolarHBondContact O-N 3.04Å; R312-T316 PolarHBondContact O-OG1 2.88Å; K313-T316 PolarHBondContact O-N 3.45Å; T316-A319 PolarHBondContact O-N 2.97Å; T316-L320 WeakPolarHBondContact O-CB 3.49Å; T316-L320 PolarHBondContact O-N 2.96Å
317	E	93.1	Very high	85.4	Confident	106 Å²	106	118.9 Å²	118.9	50%	0.495	58%	0.579	S	S	.	*	H	α-helix	trans	-64.4	-42.7	175.3	-72.4	171.3	-179	0	0	111.8	K313 A319 L320 S321	K313-E317 WeakPolarHBondContact CE-OE1 3.26Å; K313-E317 WeakPolarHBondContact O-CG 3.28Å; K313-E317 PolarHBondContact O-N 2.8Å; E317-A319 PolarHBondContact O-N 3.17Å; E317-L320 PolarHBondContact O-N 3.21Å; E317-S321 WeakPolarHBondContact O-CB 3.29Å; E317-S321 PolarHBondContact O-N 2.8Å; E317-S321 PolarHBondContact O-OG 3.01Å
318	K	92.4	Very high	83.5	Confident	129 Å²	129	122.1 Å²	122.1	56%	0.561	59%	0.592	S	S	*	*	H	α-helix	trans	-62	-41.6	173.6	-75.3	172.2	-175.7	174.2	0	111.4	Q314 E315 S321 K322	Q314-K318 WeakPolarHBondContact O-CB 3.44Å; Q314-K318 VanDerWaalsContact O-CG 3.25Å; Q314-K318 WeakPolarHBondContact O-CG 3.45Å; Q314-K318 PolarHBondContact O-N 2.9Å; E315-K318 PolarHBondContact O-N 3.37Å; K318-S321 PolarHBondContact O-N 2.92Å; K318-S321 PolarHBondContact O-OG 3.39Å; K318-K322 WeakPolarHBondContact O-CG 3.5Å; K318-K322 PolarHBondContact O-N 3.15Å; K318-K322 VanDerWaalsContact O-N 3.12Å
319	A	91.2	Very high	81.5	Confident	54 Å²	54	123.8 Å²	123.8	45%	0.446	61%	0.609	S	S	.	*	H	α-helix	trans	-66.2	-40.6	176.8	0	0	0	0	0	112.3	E315 T316 E317 K322 R323	E315-A319 WeakPolarHBondContact O-CB 3.4Å; E315-A319 PolarHBondContact O-N 3.17Å; T316-A319 PolarHBondContact O-N 2.97Å; E317-A319 PolarHBondContact O-N 3.17Å; A319-K322 PolarHBondContact O-N 3.39Å; A319-R323 PolarHBondContact O-N 3.27Å; A319-R323 VanDerWaalsContact O-N 3.16Å
320	L	90.3	Very high	79.7	Confident	106 Å²	106	127 Å²	127	56%	0.555	62%	0.622	S	S	*	*	H	α-helix	trans	-64.3	-44.1	176.2	-167.1	72.5	0	0	0	111.3	T316 E317 K322 R323 I324	T316-L320 WeakPolarHBondContact O-CB 3.49Å; T316-L320 PolarHBondContact O-N 2.96Å; E317-L320 PolarHBondContact O-N 3.21Å; L320-K322 VanDerWaalsContact C-N 3.31Å; L320-K322 PolarHBondContact O-N 3.38Å; L320-R323 PolarHBondContact O-N 2.71Å; L320-R323 VanDerWaalsContact O-N 3.15Å; L320-I324 HydrophobicContact CD2-CD1 4.45Å; L320-I324 HydrophobicContact CG-CD1 3.97Å; L320-I324 WeakPolarHBondContact O-CG1 3.44Å; L320-I324 PolarHBondContact O-N 3.13Å; L320-I324 VanDerWaalsContact O-N 3.09Å
321	S	86.9	Confident	77.7	Confident	70 Å²	70	131.3 Å²	131.3	49%	0.49	64%	0.643	S	S	.	*	H	α-helix	trans	-64	-33.2	177.4	73.3	0	0	0	0	113.3	E317 K318 I324	E317-S321 WeakPolarHBondContact O-CB 3.29Å; E317-S321 PolarHBondContact O-N 2.8Å; E317-S321 PolarHBondContact O-OG 3.01Å; K318-S321 PolarHBondContact O-N 2.92Å; K318-S321 PolarHBondContact O-OG 3.39Å; S321-I324 PolarHBondContact O-N 3Å
322	K	84	Confident	75.7	Confident	156 Å²	156	127.6 Å²	127.6	68%	0.678	64%	0.638	S	S	*	*	H	α-helix	trans	-68.8	-36.2	173.8	-75.4	-179.8	-178.6	-178.6	0	112	K318 A319 L320	K318-K322 WeakPolarHBondContact O-CG 3.5Å; K318-K322 PolarHBondContact O-N 3.15Å; K318-K322 VanDerWaalsContact O-N 3.12Å; A319-K322 PolarHBondContact O-N 3.39Å; L320-K322 VanDerWaalsContact C-N 3.31Å; L320-K322 PolarHBondContact O-N 3.38Å
323	R	76.1	Confident	73.7	Confident	224 Å²	224	129.2 Å²	129.2	85%	0.845	66%	0.655	S	S	*	*	H	α-helix	trans	-70.2	-30.4	175.9	-81.2	-174.6	174.6	178.5	-0.7	113.4	A319 L320 R325	A319-R323 PolarHBondContact O-N 3.27Å; A319-R323 VanDerWaalsContact O-N 3.16Å; L320-R323 PolarHBondContact O-N 2.71Å; L320-R323 VanDerWaalsContact O-N 3.15Å; R323-R325 VanDerWaalsContact C-N 3.29Å; R323-R325 PolarHBondContact O-N 2.85Å
324	I	65.8	Low	71.5	Confident	122 Å²	122	127.7 Å²	127.7	63%	0.626	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-4.3	-176.9	-66.5	168.5	0	0	0	112.7	L320 S321 P326	L320-I324 HydrophobicContact CD2-CD1 4.45Å; L320-I324 HydrophobicContact CG-CD1 3.97Å; L320-I324 WeakPolarHBondContact O-CG1 3.44Å; L320-I324 PolarHBondContact O-N 3.13Å; L320-I324 VanDerWaalsContact O-N 3.09Å; S321-I324 PolarHBondContact O-N 3Å; I324-P326 WeakPolarHBondContact O-CD 3.33Å
325	R	56	Low	69.3	Low	199 Å²	199	134.9 Å²	134.9	75%	0.751	69%	0.69	S	S	*	*			trans	-63.7	110	174	-68.1	-172.2	178.9	-160.8	-1.6	109.7	R323 T327	R323-R325 VanDerWaalsContact C-N 3.29Å; R323-R325 PolarHBondContact O-N 2.85Å; R325-T327 PolarHBondContact O-N 2.73Å
326	P	52.7	Low	67.5	Low	100 Å²	100	138 Å²	138	65%	0.649	73%	0.726	S	S	*	*			trans	-71.2	125	177.3	30.4	-29.7	0	0	0	107.3	I324 F328	I324-P326 WeakPolarHBondContact O-CD 3.33Å; P326-F328 HydrophobicContact CB-CD2 4.11Å; P326-F328 HydrophobicContact CG-CD2 4.33Å; P326-F328 PolarHBondContact O-N 2.88Å
327	T	55.5	Low	66.2	Low	142 Å²	142	140.1 Å²	140.1	87%	0.871	73%	0.733	S	S	*	*			trans	-66.9	77.9	163.2	44.7	0	0	0	0	108.3	R325 S329	R325-T327 PolarHBondContact O-N 2.73Å; T327-S329 PolarHBondContact O-N 2.95Å; T327-S329 VanDerWaalsContact O-N 3.13Å
328	F	55.6	Low	64.8	Low	184 Å²	184	141.9 Å²	141.9	81%	0.807	75%	0.746	S	S	*	*			trans	-77.8	84.1	160.3	-103.8	-85.5	0	0	0	107	P326 F330	P326-F328 HydrophobicContact CB-CD2 4.11Å; P326-F328 HydrophobicContact CG-CD2 4.33Å; P326-F328 PolarHBondContact O-N 2.88Å; F328-F330 PolarHBondContact O-N 3.11Å; F328-F330 VanDerWaalsContact O-N 3.13Å
329	S	53.9	Low	63.2	Low	95 Å²	95	142.6 Å²	142.6	66%	0.664	76%	0.756	S	S	*	*			trans	-68.9	102.9	161.5	58.7	0	0	0	0	107.4	T327 T331	T327-S329 PolarHBondContact O-N 2.95Å; T327-S329 VanDerWaalsContact O-N 3.13Å; S329-T331 PolarHBondContact O-N 2.96Å
330	F	55.7	Low	61.6	Low	188 Å²	188	147.8 Å²	147.8	83%	0.825	77%	0.774	S	S	*	*			trans	-73.3	79.4	172.2	-164.8	-90.6	0	0	0	108.8	F328 G332	F328-F330 PolarHBondContact O-N 3.11Å; F328-F330 VanDerWaalsContact O-N 3.13Å; F330-G332 VanDerWaalsContact C-N 3.32Å; F330-G332 PolarHBondContact O-N 3.45Å
331	T	54.3	Low	59.8	Low	137 Å²	137	150.4 Å²	150.4	84%	0.84	79%	0.788	S	S	*	*			trans	-93.6	74.7	167.2	-36.6	0	0	0	0	107	S329	S329-T331 PolarHBondContact O-N 2.96Å
332	G	52.8	Low	58	Low	39 Å²	39	155.8 Å²	155.8	40%	0.402	81%	0.808	S	S	.	*			trans	-127.5	106.9	-174.8	0	0	0	0	0	112.1	F330	F330-G332 VanDerWaalsContact C-N 3.32Å; F330-G332 PolarHBondContact O-N 3.45Å
333	M	52.8	Low	56.1	Low	197 Å²	197	155.8 Å²	155.8	97%	0.97	82%	0.817	S	S	*	*			trans	69.5	91.8	150.7	-65.5	179.7	180	0	0	119.2
334	A	50.6	Low	54.6	Low	105 Å²	105	150.5 Å²	150.5	87%	0.868	82%	0.815	S	S	*	*			trans	-116.8	97.4	142.1	0	0	0	0	0	108.3
335	R	47.8	Very low	53.7	Low	254 Å²	254	152.9 Å²	152.9	96%	0.958	83%	0.831	S	S	*	*			trans	-148.3	96.6	161.6	-88.1	-166.9	178.9	-174.8	-0.5	108.6
336	S	56.3	Low	53.5	Low	195 Å²	195	148.7 Å²	148.7	100%	1.364	84%	0.838	S	S	*	*			trans	-164.2	0	152.6	174.7	0	0	0	0	107.3

Retrieved 336 of 336 residues in 97.8 ms (Link to these results)

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