A0A096N7P6_PAPAN Loading...

Scm like with four mbt domains 1

AlphaFold DB (A0A096MQ21), UniProt , Accession A0A096N7P6, Species PAPAN (Papio anubis, Olive baboon), Gene SFMBT1, Length 866 aa.

						>A0A096N7P6_PAPAN|A0A096N7P6|SFMBT1
MNGEQQLDADAGSGMEEIELSWEDYLEETGSTAVPYGSFKHVDTRLQNGFAPGMKLEVAVRTDPETYWVATIITTCEQLLLLRYDGYGEDRRADFWCDIRKADLYPIGWCEQNKKTLEAPEGIRDKVSDWDEFLRQTLIGACSPPVPLLEGLRNGRNPLDLIAPGSRLECQAFQDSLSTWIVTVVENIGGRLKLRYEGLESSDNYEHWLYYLDPFLHHVGWAAQQGYELQPPSAIRHLKNEAEWQEILAKVKEEEEEPLPSYLFKDKQVIGIHTFSVNMKLEAVDPWSPFGISPATVVKVFDEKYFLVEMDDLRPENHVRRSFVCHADSPGIFPVQWSLKNGLHISPPPGYPSQDFDWADYLKQCGAEAAPQRCFPPLISEHEFKENMKLEAVNPLLPEEVCVATITAVRGSYLWLQLEGSKKPIPEYIVSVESMDIFPLGWCETNGHPLSTPRRARVHKQRKIAVVQPEKQVPSSRTVHEGLRNQELNSTESVTINGKYCCPKIYFNHRCFSGPYLNKGRIAELPQCVGPGNCVLVLREVLTLLINAAYKPSRVLRELQLDKDSVWHGCGEVLKAKYKGKSYRATVEIVKTADRVTEFCRQTCIKLECCPNLFGPRMVLDKCSENCSVLTKTKYTHYYGKKKNKRIGRPPGGHSNLACALKKASKRRKRRKNVFVHKKKRSSASVDNTPAGSPQGSGGEDEDDPDEGDDDSLSEGSTSEQQDELQEESEMSEKKSCSSSPTQSEISTSLPPDRQRRKRELRTFSFSDDENKPPSPKEIRIEVAERLHLDSNPLKWSVADVVRFIRSTDCAPLARIFLDQEIDGQALLLLTLPTVQECMDLKLGPAIKLCHHIERIKFAFYEQFAN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	34.4	Very low	28.4	Very low	233 Å²	233	154.9 Å²	154.9	100%	1.148	87%	0.867	S	S	*	*				0	153.2	0	-84.9	177.2	164.2	0	0	107.7
2	N	28.9	Very low	28.5	Very low	166 Å²	166	147.9 Å²	147.9	89%	0.888	86%	0.855	S	S	*	*			trans	60.5	114.5	-175.6	-58.4	9.2	0	0	0	113.6
3	G	26.3	Very low	28.5	Very low	75 Å²	75	144.1 Å²	144.1	77%	0.773	84%	0.842	S	S	*	*			trans	-121.6	145.8	161.1	0	0	0	0	0	107.7
4	E	29.6	Very low	28.5	Very low	204 Å²	204	139.4 Å²	139.4	95%	0.953	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-96	143.8	177.7	-65	-179.5	121.4	0	0	109.6
5	Q	28.1	Very low	28.4	Very low	186 Å²	186	141.3 Å²	141.3	87%	0.869	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-91.7	125.4	-176.5	-70.3	-178.4	-59.6	0	0	110.7
6	Q	25.7	Very low	28.6	Very low	178 Å²	178	142.7 Å²	142.7	83%	0.832	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-72.5	124.6	170.2	-170.2	166.3	-16.5	0	0	108.9
7	L	27.4	Very low	29.2	Very low	166 Å²	166	145.4 Å²	145.4	87%	0.869	84%	0.837	S	S	*	*			trans	-98.6	104.9	178	-79.9	169	0	0	0	109.8
8	D	25.9	Very low	30	Very low	147 Å²	147	144.8 Å²	144.8	79%	0.786	83%	0.829	S	S	*	*			trans	-67	135.1	166.6	-68.9	-47.8	0	0	0	110.3
9	A	27.9	Very low	31.2	Very low	99 Å²	99	143.8 Å²	143.8	82%	0.818	82%	0.816	S	S	*	*			trans	-119.3	59.7	-179.9	0	0	0	0	0	111	A11	A9-A11 PolarHBondContact O-N 2.85Å
10	D	29.3	Very low	32.9	Very low	161 Å²	161	138.7 Å²	138.7	86%	0.861	79%	0.786	S	S	*	*			trans	-73	111.3	166	-176.1	10.4	0	0	0	109.8	G12	D10-G12 PolarHBondContact OD1-N 2.83Å
11	A	28.9	Very low	34.9	Very low	89 Å²	89	134 Å²	134	74%	0.736	76%	0.762	S	S	*	*			trans	-148.4	57.3	177.1	0	0	0	0	0	109.8	A9 S13	A9-A11 PolarHBondContact O-N 2.85Å; A11-S13 PolarHBondContact O-N 2.85Å
12	G	29.3	Very low	36.8	Very low	71 Å²	71	124.8 Å²	124.8	73%	0.732	72%	0.715	S	S	*	*			trans	-53.8	97.8	-178.6	0	0	0	0	0	114.3	D10 G14	D10-G12 PolarHBondContact OD1-N 2.83Å; G12-G14 PolarHBondContact O-N 3.2Å
13	S	28.4	Very low	38.7	Very low	98 Å²	98	124 Å²	124	69%	0.685	71%	0.706	S	S	*	*			trans	-79.7	94.6	165.8	65.3	0	0	0	0	109.2	A11 M15	A11-S13 PolarHBondContact O-N 2.85Å; S13-M15 PolarHBondContact O-N 2.71Å
14	G	28.8	Very low	40.9	Very low	78 Å²	78	125 Å²	125	80%	0.804	69%	0.694	S	S	*	*			trans	-64.4	84.4	167.5	0	0	0	0	0	110.9	G12 E16	G12-G14 PolarHBondContact O-N 3.2Å; G14-E16 PolarHBondContact O-N 2.69Å
15	M	27.6	Very low	43.3	Very low	168 Å²	168	115.9 Å²	115.9	83%	0.828	65%	0.65	S	S	*	*			trans	-72.6	101.2	158.5	-72.3	-167	179.1	0	0	107.2	S13 E17	S13-M15 PolarHBondContact O-N 2.71Å; M15-E17 PolarHBondContact O-N 3.19Å; M15-E17 VanDerWaalsContact O-N 3.14Å
16	E	31.8	Very low	45.8	Very low	164 Å²	164	108.6 Å²	108.6	77%	0.766	62%	0.617	S	S	*	*			trans	-59.7	114.1	159.3	-65.5	-178.4	133.9	0	0	107.2	G14 I18	G14-E16 PolarHBondContact O-N 2.69Å; E16-I18 PolarHBondContact O-N 3.33Å; E16-I18 VanDerWaalsContact O-N 3.11Å
17	E	38.2	Very low	48.4	Very low	188 Å²	188	107.4 Å²	107.4	88%	0.879	61%	0.612	S	S	*	*			trans	-61.7	115.7	170.2	-72.1	-171.2	126.4	0	0	108.1	M15 E19	M15-E17 PolarHBondContact O-N 3.19Å; M15-E17 VanDerWaalsContact O-N 3.14Å; E17-E19 PolarHBondContact O-N 3.36Å
18	I	43.4	Very low	51	Low	136 Å²	136	105.1 Å²	105.1	70%	0.697	60%	0.597	S	S	*	*			trans	-73.8	96.5	-179	-57.7	176.7	0	0	0	107.4	E16 L20	E16-I18 PolarHBondContact O-N 3.33Å; E16-I18 VanDerWaalsContact O-N 3.11Å; I18-L20 PolarHBondContact O-N 3.05Å
19	E	52.6	Low	53.8	Low	126 Å²	126	100.7 Å²	100.7	59%	0.589	58%	0.575	S	S	*	*			trans	-37.4	125.7	174.5	-166	-178.6	-152.5	0	0	111	E17 S21 K591	E17-E19 PolarHBondContact O-N 3.36Å; E19-S21 PolarHBondContact O-N 3.23Å; E19-K591 IonicContact OE1-NZ 2.98Å; E19-K591 PolarHBondContact OE1-NZ 3.14Å; E19-K591 IonicContact OE2-NZ 2.99Å; E19-K591 PolarHBondContact OE2-NZ 3.12Å
20	L	65.8	Low	56.4	Low	40 Å²	40	98.7 Å²	98.7	21%	0.209	56%	0.564	C	S	.	*			trans	-71.8	102	-174.8	-175.5	76.1	0	0	0	110.1	I18 W22 Y25 L450 T452	I18-L20 PolarHBondContact O-N 3.05Å; L20-W22 HydrophobicContact CD2-CD2 4.08Å; L20-W22 HydrophobicContact CD2-CE3 3.99Å; L20-W22 HydrophobicContact CD2-CH2 3.83Å; L20-W22 HydrophobicContact CD2-CZ2 3.9Å; L20-W22 HydrophobicContact CD2-CZ3 3.87Å; L20-W22 PolarHBondContact O-N 3.23Å; L20-Y25 HydrophobicContact CD1-CG 4.36Å; L20-L450 HydrophobicContact CD2-CD2 4.29Å; L20-T452 HydrophobicContact CB-CG2 4.38Å; L20-T452 HydrophobicContact CD2-CG2 3.89Å
21	S	73.8	Confident	59.3	Low	41 Å²	41	91.5 Å²	91.5	29%	0.287	53%	0.526	S	S	.	.			trans	-72.5	109.5	164.2	175.4	0	0	0	0	109.7	E19 E23 D24 Y25	E19-S21 PolarHBondContact O-N 3.23Å; S21-E23 VanDerWaalsContact C-N 3.3Å; S21-E23 PolarHBondContact O-N 2.79Å; S21-D24 WeakPolarHBondContact CB-OD2 3.35Å; S21-D24 PolarHBondContact O-N 3.12Å; S21-D24 PolarHBondContact OG-N 3.03Å; S21-D24 PolarHBondContact OG-OD2 2.76Å; S21-Y25 WeakPolarHBondContact O-CB 3.2Å; S21-Y25 PolarHBondContact O-N 3.47Å
22	W	74.6	Confident	62.2	Low	39 Å²	39	91.1 Å²	91.1	15%	0.148	52%	0.515	C	S	.	.	H	α-helix	trans	-60.9	-37	174.9	-74.5	118.1	0	0	0	112.6	L20 Y25 L26 E391 V403 L440 L450	L20-W22 HydrophobicContact CD2-CD2 4.08Å; L20-W22 HydrophobicContact CD2-CE3 3.99Å; L20-W22 HydrophobicContact CD2-CH2 3.83Å; L20-W22 HydrophobicContact CD2-CZ2 3.9Å; L20-W22 HydrophobicContact CD2-CZ3 3.87Å; L20-W22 PolarHBondContact O-N 3.23Å; W22-Y25 AromaticContact CE3-CD1 3.84Å; W22-Y25 HydrophobicContact CE3-CD1 3.84Å; W22-Y25 HydrophobicContact CE3-CE1 4.33Å; W22-Y25 AromaticContact CZ3-CD1 3.87Å; W22-Y25 HydrophobicContact CZ3-CD1 3.87Å; W22-Y25 AromaticContact CZ3-CE1 3.9Å; W22-Y25 HydrophobicContact CZ3-CE1 3.9Å; W22-Y25 PolarHBondContact O-N 3.09Å; W22-L26 WeakPolarHBondContact O-CB 3.2Å; W22-L26 WeakPolarHBondContact O-CG 3.32Å; W22-L26 PolarHBondContact O-N 2.94Å; W22-E391 HydrophobicContact CH2-CG 4.39Å; W22-E391 HydrophobicContact CZ2-CG 4.35Å; W22-E391 VanDerWaalsContact CZ2-OE1 3.28Å; W22-E391 WeakPolarHBondContact CZ2-OE1 3.23Å; W22-V403 HydrophobicContact CH2-CG1 4.07Å; W22-V403 HydrophobicContact CH2-CG2 3.78Å; W22-V403 HydrophobicContact CZ3-CG1 3.98Å; W22-V403 HydrophobicContact CZ3-CG2 4.28Å; W22-L440 HydrophobicContact CD2-CB 4.27Å; W22-L440 HydrophobicContact CD2-CD1 4.35Å; W22-L440 HydrophobicContact CE3-CB 4.48Å; W22-L440 HydrophobicContact CE3-CD1 3.85Å; W22-L440 HydrophobicContact CE3-CD2 4.35Å; W22-L440 HydrophobicContact CE3-CG 4.46Å; W22-L440 HydrophobicContact CH2-CD2 3.68Å; W22-L440 HydrophobicContact CH2-CG 4.49Å; W22-L440 HydrophobicContact CZ2-CB 4.31Å; W22-L440 HydrophobicContact CZ2-CD2 4.23Å; W22-L440 HydrophobicContact CZ3-CD1 4.01Å; W22-L440 HydrophobicContact CZ3-CD2 3.76Å; W22-L440 HydrophobicContact CZ3-CG 4.35Å; W22-L450 HydrophobicContact CH2-CD2 3.81Å; W22-L450 HydrophobicContact CZ2-CD2 3.47Å; W22-L450 VanDerWaalsContact CZ2-CD2 3.47Å
23	E	68.5	Low	64.9	Low	150 Å²	150	89.8 Å²	89.8	70%	0.701	50%	0.497	S	S	*	.	H	α-helix	trans	-63.3	-51.1	178.2	-167.8	170.3	-154.7	0	0	110.6	S21 Y25 L26 E27	S21-E23 VanDerWaalsContact C-N 3.3Å; S21-E23 PolarHBondContact O-N 2.79Å; E23-Y25 VanDerWaalsContact C-N 3.32Å; E23-Y25 PolarHBondContact O-N 2.97Å; E23-L26 PolarHBondContact O-N 3.16Å; E23-E27 PolarHBondContact O-N 3.36Å
24	D	73.5	Confident	67.7	Low	97 Å²	97	85.4 Å²	85.4	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-61.6	-37.3	176.8	-69.1	-71.7	0	0	0	112.6	S21 E28	S21-D24 WeakPolarHBondContact CB-OD2 3.35Å; S21-D24 PolarHBondContact O-N 3.12Å; S21-D24 PolarHBondContact OG-N 3.03Å; S21-D24 PolarHBondContact OG-OD2 2.76Å; D24-E28 WeakPolarHBondContact O-CB 3.33Å; D24-E28 PolarHBondContact O-N 2.83Å
25	Y	80.1	Confident	70	Confident	11 Å²	11	84 Å²	84	4%	0.043	44%	0.443	C	S	.	.	H	α-helix	trans	-76.4	-37.3	-177.7	169.2	-106.6	0	0	0	112.7	L20 S21 W22 E23 E28 T29 K389 V403 E419 P453	L20-Y25 HydrophobicContact CD1-CG 4.36Å; S21-Y25 WeakPolarHBondContact O-CB 3.2Å; S21-Y25 PolarHBondContact O-N 3.47Å; W22-Y25 AromaticContact CE3-CD1 3.84Å; W22-Y25 HydrophobicContact CE3-CD1 3.84Å; W22-Y25 HydrophobicContact CE3-CE1 4.33Å; W22-Y25 AromaticContact CZ3-CD1 3.87Å; W22-Y25 HydrophobicContact CZ3-CD1 3.87Å; W22-Y25 AromaticContact CZ3-CE1 3.9Å; W22-Y25 HydrophobicContact CZ3-CE1 3.9Å; W22-Y25 PolarHBondContact O-N 3.09Å; E23-Y25 VanDerWaalsContact C-N 3.32Å; E23-Y25 PolarHBondContact O-N 2.97Å; Y25-E28 PolarHBondContact O-N 3.2Å; Y25-T29 HydrophobicContact CD2-CG2 4.04Å; Y25-T29 HydrophobicContact CE2-CG2 3.68Å; Y25-T29 WeakPolarHBondContact O-CB 3.15Å; Y25-T29 WeakPolarHBondContact O-CG2 3.46Å; Y25-T29 PolarHBondContact O-N 2.89Å; Y25-T29 PolarHBondContact O-OG1 3.38Å; Y25-K389 HydrophobicContact CD1-CD 4.39Å; Y25-K389 HydrophobicContact CE1-CD 3.43Å; Y25-K389 VanDerWaalsContact CE1-CD 3.43Å; Y25-K389 VanDerWaalsContact OH-CE 3.27Å; Y25-K389 WeakPolarHBondContact OH-CE 3.46Å; Y25-K389 PolarHBondContact OH-NZ 2.77Å; Y25-K389 VanDerWaalsContact OH-NZ 3.11Å; Y25-V403 HydrophobicContact CE1-CG1 3.89Å; Y25-E419 PolarHBondContact OH-OE1 2.77Å; Y25-E419 PolarHBondContact OH-OE2 2.94Å; Y25-P453 HydrophobicContact CE2-CG 3.88Å
26	L	80.6	Confident	72.2	Confident	34 Å²	34	80.7 Å²	80.7	18%	0.178	42%	0.422	C	S	.	.	H	α-helix	trans	-67.2	-40.7	171.7	-69	172.8	0	0	0	111	W22 E23 G30 S31 A33 K389 L440	W22-L26 WeakPolarHBondContact O-CB 3.2Å; W22-L26 WeakPolarHBondContact O-CG 3.32Å; W22-L26 PolarHBondContact O-N 2.94Å; E23-L26 PolarHBondContact O-N 3.16Å; L26-G30 PolarHBondContact O-N 3.27Å; L26-S31 WeakPolarHBondContact CD2-OG 3.25Å; L26-S31 PolarHBondContact O-N 3.43Å; L26-A33 HydrophobicContact CD1-CB 4.3Å; L26-K389 HydrophobicContact CD2-CB 4.38Å; L26-K389 HydrophobicContact CD2-CD 4.17Å; L26-L440 HydrophobicContact CD1-CD1 4.22Å; L26-L440 HydrophobicContact CD2-CD1 4.15Å
27	E	79.6	Confident	74.1	Confident	153 Å²	153	75.4 Å²	75.4	72%	0.715	41%	0.412	S	S	*	.	H	α-helix	trans	-63.6	-43.4	171.9	-75.9	-160.8	169.1	0	0	112.5	E23 T29 G30	E23-E27 PolarHBondContact O-N 3.36Å; E27-T29 VanDerWaalsContact C-N 3.33Å; E27-T29 PolarHBondContact O-N 2.86Å; E27-G30 PolarHBondContact O-N 3.49Å
28	E	83.4	Confident	76.3	Confident	117 Å²	117	67.2 Å²	67.2	55%	0.547	38%	0.375	S	S	.	.	H	α-helix	trans	-66.9	-32.1	180	179.9	160.4	-124.3	0	0	112.9	D24 Y25	D24-E28 WeakPolarHBondContact O-CB 3.33Å; D24-E28 PolarHBondContact O-N 2.83Å; Y25-E28 PolarHBondContact O-N 3.2Å
29	T	84.3	Confident	78.3	Confident	54 Å²	54	60.8 Å²	60.8	33%	0.331	34%	0.342	S	S	.	.	H	α-helix	trans	-93.4	-11.1	179	53.7	0	0	0	0	114.2	Y25 E27 S31 K389	Y25-T29 HydrophobicContact CD2-CG2 4.04Å; Y25-T29 HydrophobicContact CE2-CG2 3.68Å; Y25-T29 WeakPolarHBondContact O-CB 3.15Å; Y25-T29 WeakPolarHBondContact O-CG2 3.46Å; Y25-T29 PolarHBondContact O-N 2.89Å; Y25-T29 PolarHBondContact O-OG1 3.38Å; E27-T29 VanDerWaalsContact C-N 3.33Å; E27-T29 PolarHBondContact O-N 2.86Å; T29-S31 VanDerWaalsContact C-N 3.27Å; T29-S31 PolarHBondContact O-N 3.12Å; T29-S31 PolarHBondContact OG1-OG 3.25Å; T29-K389 VanDerWaalsContact OG1-CE 3.24Å; T29-K389 WeakPolarHBondContact OG1-CE 3.28Å
30	G	82.8	Confident	79.7	Confident	57 Å²	57	60.8 Å²	60.8	59%	0.588	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	30	-177.1	0	0	0	0	0	113.3	L26 E27 N387	L26-G30 PolarHBondContact O-N 3.27Å; E27-G30 PolarHBondContact O-N 3.49Å; G30-N387 PolarHBondContact O-ND2 3.11Å; G30-N387 VanDerWaalsContact O-ND2 3.12Å
31	S	90	Very high	80.5	Confident	10 Å²	10	59.5 Å²	59.5	7%	0.07	33%	0.333	C	S	.	.			trans	-111.4	176	-176.1	68.7	0	0	0	0	112	L26 T29 N387 K389	L26-S31 WeakPolarHBondContact CD2-OG 3.25Å; L26-S31 PolarHBondContact O-N 3.43Å; T29-S31 VanDerWaalsContact C-N 3.27Å; T29-S31 PolarHBondContact O-N 3.12Å; T29-S31 PolarHBondContact OG1-OG 3.25Å; S31-N387 WeakPolarHBondContact CB-O 3.15Å; S31-K389 WeakPolarHBondContact OG-CD 3.42Å; S31-K389 WeakPolarHBondContact OG-CE 3.36Å
32	T	88.5	Confident	80.6	Confident	81 Å²	81	57.6 Å²	57.6	50%	0.497	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	152.5	175.2	50.7	0	0	0	0	111.5	M388 K389	T32-M388 CarbonylContact O-C 3.59Å; T32-M388 VanDerWaalsContact O-CA 3.23Å; T32-M388 WeakPolarHBondContact O-CA 3.36Å; T32-K389 PolarHBondContact O-N 2.61Å
33	A	86.8	Confident	80.1	Confident	43 Å²	43	59.1 Å²	59.1	36%	0.355	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	143.7	171.8	0	0	0	0	0	110.5	L26 L440	L26-A33 HydrophobicContact CD1-CB 4.3Å; A33-L440 HydrophobicContact CB-CD1 3.65Å; A33-L440 HydrophobicContact CB-CG 4.19Å
34	V	87.1	Confident	79.7	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.036	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-65.1	136.4	163.4	-179.6	0	0	0	0	109.3	F39 F384 M388 K389 L390 I406	V34-F39 HydrophobicContact CB-CE2 3.72Å; V34-F39 HydrophobicContact CB-CZ 3.73Å; V34-F39 HydrophobicContact CG1-CD2 4.4Å; V34-F39 HydrophobicContact CG1-CE2 3.45Å; V34-F39 VanDerWaalsContact CG1-CE2 3.45Å; V34-F39 HydrophobicContact CG1-CZ 3.61Å; V34-F39 HydrophobicContact CG2-CZ 4.38Å; V34-F384 HydrophobicContact CG1-CD1 3.71Å; V34-F384 HydrophobicContact CG1-CE1 3.65Å; V34-F384 HydrophobicContact CG1-CG 4.43Å; V34-F384 HydrophobicContact CG1-CZ 4.31Å; V34-F384 HydrophobicContact CG2-CD1 4.02Å; V34-F384 HydrophobicContact CG2-CE1 4.38Å; V34-M388 HydrophobicContact CG2-CB 3.7Å; V34-M388 HydrophobicContact CG2-CG 4.42Å; V34-M388 HydrophobicContact CG2-SD 3.98Å; V34-K389 PolarHBondContact N-O 2.9Å; V34-L390 HydrophobicContact CG2-CB 4.08Å; V34-L390 HydrophobicContact CG2-CD2 4.09Å; V34-I406 HydrophobicContact CG2-CD1 4Å
35	P	77	Confident	78.9	Confident	49 Å²	49	51 Å²	51	32%	0.318	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.2	143.4	176.9	-22.9	34.5	0	0	0	113.1	G37 S38 F39 E383	P35-G37 VanDerWaalsContact C-N 3.3Å; P35-G37 PolarHBondContact O-N 3.4Å; P35-S38 VanDerWaalsContact O-CB 3.31Å; P35-S38 WeakPolarHBondContact O-CB 3.33Å; P35-S38 PolarHBondContact O-N 3.17Å; P35-S38 VanDerWaalsContact O-N 3.07Å; P35-F39 WeakPolarHBondContact O-CD2 3.15Å; P35-E383 VanDerWaalsContact CB-OE2 3.29Å; P35-E383 WeakPolarHBondContact CB-OE2 3.47Å; P35-E383 HydrophobicContact CG-CB 4.34Å; P35-E383 WeakPolarHBondContact CG-OE2 3.48Å
36	Y	73.6	Confident	77.4	Confident	98 Å²	98	55 Å²	55	38%	0.384	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-57.7	-40.5	-177.1	-162	-78.3	0	0	0	113	S38 F39 V42 L46 P439	Y36-S38 PolarHBondContact O-N 2.88Å; Y36-S38 VanDerWaalsContact O-N 3.16Å; Y36-F39 PolarHBondContact O-N 2.93Å; Y36-F39 VanDerWaalsContact O-N 3.09Å; Y36-V42 HydrophobicContact CE1-CB 4.5Å; Y36-V42 HydrophobicContact CE1-CG1 3.94Å; Y36-V42 HydrophobicContact CE2-CG1 4.44Å; Y36-V42 WeakPolarHBondContact OH-CG1 3.35Å; Y36-L46 HydrophobicContact CE1-CD1 3.76Å; Y36-L46 HydrophobicContact CE1-CG 4.31Å; Y36-P439 HydrophobicContact CD2-CB 3.79Å; Y36-P439 HydrophobicContact CD2-CG 3.56Å; Y36-P439 HydrophobicContact CE2-CB 4.32Å; Y36-P439 HydrophobicContact CE2-CG 3.62Å; Y36-P439 HydrophobicContact CG-CB 4.35Å; Y36-P439 HydrophobicContact CG-CG 4.2Å
37	G	72.9	Confident	76.1	Confident	54 Å²	54	57.5 Å²	57.5	56%	0.557	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-67.1	-10.1	179.4	0	0	0	0	0	115.2	P35 F39	P35-G37 VanDerWaalsContact C-N 3.3Å; P35-G37 PolarHBondContact O-N 3.4Å; G37-F39 PolarHBondContact O-N 3.46Å
38	S	83.8	Confident	75	Confident	15 Å²	15	51.3 Å²	51.3	11%	0.105	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-70.6	-21.8	170.5	-67.5	0	0	0	0	112.6	P35 Y36 K40 E383	P35-S38 VanDerWaalsContact O-CB 3.31Å; P35-S38 WeakPolarHBondContact O-CB 3.33Å; P35-S38 PolarHBondContact O-N 3.17Å; P35-S38 VanDerWaalsContact O-N 3.07Å; Y36-S38 PolarHBondContact O-N 2.88Å; Y36-S38 VanDerWaalsContact O-N 3.16Å; S38-K40 PolarHBondContact O-N 3.34Å; S38-E383 WeakPolarHBondContact OG-CB 3.46Å; S38-E383 PolarHBondContact OG-OE2 2.75Å
39	F	85.3	Confident	73.9	Confident	2 Å²	2	46 Å²	46	1%	0.009	27%	0.27	C	S	.	.			trans	-97	75.5	-175.1	-58.7	-86.4	0	0	0	111.3	V34 P35 Y36 G37 H41 V42 D43 F384 L390 I437 F438 P439	V34-F39 HydrophobicContact CB-CE2 3.72Å; V34-F39 HydrophobicContact CB-CZ 3.73Å; V34-F39 HydrophobicContact CG1-CD2 4.4Å; V34-F39 HydrophobicContact CG1-CE2 3.45Å; V34-F39 VanDerWaalsContact CG1-CE2 3.45Å; V34-F39 HydrophobicContact CG1-CZ 3.61Å; V34-F39 HydrophobicContact CG2-CZ 4.38Å; P35-F39 WeakPolarHBondContact O-CD2 3.15Å; Y36-F39 PolarHBondContact O-N 2.93Å; Y36-F39 VanDerWaalsContact O-N 3.09Å; G37-F39 PolarHBondContact O-N 3.46Å; F39-H41 VanDerWaalsContact C-N 3.3Å; F39-H41 PolarHBondContact O-N 3.11Å; F39-H41 VanDerWaalsContact O-N 3.11Å; F39-V42 HydrophobicContact CB-CB 4.02Å; F39-V42 HydrophobicContact CB-CG2 3.8Å; F39-V42 WeakPolarHBondContact O-CA 3.21Å; F39-V42 WeakPolarHBondContact O-CB 3.41Å; F39-V42 PolarHBondContact O-N 3.06Å; F39-D43 PolarHBondContact O-N 3.01Å; F39-F384 HydrophobicContact CD1-CZ 4.48Å; F39-F384 HydrophobicContact CE1-CE1 4.01Å; F39-F384 HydrophobicContact CE1-CZ 4.28Å; F39-F384 HydrophobicContact CZ-CE1 4.1Å; F39-L390 HydrophobicContact CE1-CB 4.33Å; F39-L390 HydrophobicContact CE1-CD2 4.26Å; F39-L390 HydrophobicContact CZ-CB 3.81Å; F39-L390 HydrophobicContact CZ-CD2 4.23Å; F39-I437 HydrophobicContact CD1-CG1 4.23Å; F39-I437 VanDerWaalsContact CD1-O 3.27Å; F39-I437 WeakPolarHBondContact CD1-O 3.43Å; F39-I437 HydrophobicContact CE1-CB 4.23Å; F39-I437 HydrophobicContact CE1-CD1 4.42Å; F39-I437 HydrophobicContact CE1-CG1 4.16Å; F39-F438 VanDerWaalsContact CE1-C 3.45Å; F39-F438 WeakPolarHBondContact CZ-O 3.37Å; F39-P439 HydrophobicContact CD2-CB 3.76Å; F39-P439 HydrophobicContact CD2-CG 4.09Å; F39-P439 HydrophobicContact CE2-CB 3.73Å; F39-P439 HydrophobicContact CE2-CG 4.47Å
40	K	81.6	Confident	73.2	Confident	126 Å²	126	43.9 Å²	43.9	55%	0.548	26%	0.256	S	S	.	.	H	α-helix	trans	-43.9	-49.2	-174	-65.3	-177.8	178.9	-179.8	0	114.2	S38 V42 D43 T44 E433	S38-K40 PolarHBondContact O-N 3.34Å; K40-V42 VanDerWaalsContact C-N 3.25Å; K40-V42 PolarHBondContact O-N 3.47Å; K40-D43 PolarHBondContact O-N 3.44Å; K40-T44 PolarHBondContact O-N 2.9Å; K40-T44 PolarHBondContact O-OG1 3.4Å; K40-T44 VanDerWaalsContact O-OG1 3.11Å; K40-E433 IonicContact NZ-OE1 3.83Å; K40-E433 PolarHBondContact NZ-OE1 2.57Å
41	H	82.8	Confident	72.6	Confident	13 Å²	13	42.8 Å²	42.8	6%	0.06	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-24.2	-178.1	66.8	-91.4	0	0	0	113.4	F39 Y210 S434 M435 I437 F438	F39-H41 VanDerWaalsContact C-N 3.3Å; F39-H41 PolarHBondContact O-N 3.11Å; F39-H41 VanDerWaalsContact O-N 3.11Å; H41-Y210 HydrophobicContact CB-CD1 4.39Å; H41-Y210 HydrophobicContact CB-CE1 3.93Å; H41-Y210 AromaticContact CD2-CE1 3.97Å; H41-Y210 AromaticContact CD2-CZ 3.81Å; H41-Y210 PolarHBondContact O-OH 2.89Å; H41-S434 PolarHBondContact CE1-O 3.12Å; H41-S434 PolarHBondContact ND1-O 3.28Å; H41-M435 HydrophobicContact CB-CG 4.22Å; H41-I437 PolarHBondContact CE1-O 2.99Å; H41-I437 PolarHBondContact NE2-O 2.92Å; H41-F438 AromaticContact NE2-CD1 3.51Å; H41-F438 AromaticContact NE2-CE1 3.31Å; H41-F438 VanDerWaalsContact NE2-CE1 3.31Å; H41-F438 WeakPolarHBondContact NE2-CE1 3.16Å
42	V	74.9	Confident	72	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-84.6	-32	173.9	-166.6	0	0	0	0	111.5	Y36 F39 K40 R45 F438 P439	Y36-V42 HydrophobicContact CE1-CB 4.5Å; Y36-V42 HydrophobicContact CE1-CG1 3.94Å; Y36-V42 HydrophobicContact CE2-CG1 4.44Å; Y36-V42 WeakPolarHBondContact OH-CG1 3.35Å; F39-V42 HydrophobicContact CB-CB 4.02Å; F39-V42 HydrophobicContact CB-CG2 3.8Å; F39-V42 WeakPolarHBondContact O-CA 3.21Å; F39-V42 WeakPolarHBondContact O-CB 3.41Å; F39-V42 PolarHBondContact O-N 3.06Å; K40-V42 VanDerWaalsContact C-N 3.25Å; K40-V42 PolarHBondContact O-N 3.47Å; V42-R45 WeakPolarHBondContact O-CB 3.42Å; V42-R45 PolarHBondContact O-N 3.06Å; V42-F438 HydrophobicContact CG2-CD1 3.91Å; V42-P439 HydrophobicContact CG1-CG 4.26Å
43	D	64.7	Low	71.8	Confident	72 Å²	72	44.6 Å²	44.6	39%	0.385	26%	0.264	S	S	.	.	H	α-helix	trans	-68.3	-41.9	173	-167.5	57.6	0	0	0	111.4	F39 K40 R45 L46	F39-D43 PolarHBondContact O-N 3.01Å; K40-D43 PolarHBondContact O-N 3.44Å; D43-R45 PolarHBondContact O-N 3.49Å; D43-L46 WeakPolarHBondContact O-CB 3.24Å; D43-L46 PolarHBondContact O-N 3.02Å
44	T	60.2	Low	71.9	Confident	27 Å²	27	43.9 Å²	43.9	17%	0.166	25%	0.253	C	S	.	.	H	α-helix	trans	-53.2	-39.3	171.1	-59	0	0	0	0	112.2	K40 L46 Q47 L212 D266	K40-T44 PolarHBondContact O-N 2.9Å; K40-T44 PolarHBondContact O-OG1 3.4Å; K40-T44 VanDerWaalsContact O-OG1 3.11Å; T44-L46 PolarHBondContact O-N 3.02Å; T44-Q47 WeakPolarHBondContact O-CB 3.37Å; T44-Q47 PolarHBondContact O-N 3.11Å; T44-L212 HydrophobicContact CG2-CD1 4.02Å; T44-D266 HydrophobicContact CG2-CB 3.51Å
45	R	56.5	Low	72.2	Confident	48 Å²	48	45.1 Å²	45.1	18%	0.181	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-28.1	177.7	167.8	-177.2	-178.5	-159.4	10.8	113.7	V42 D43 Q47 N157 L159 N446	V42-R45 WeakPolarHBondContact O-CB 3.42Å; V42-R45 PolarHBondContact O-N 3.06Å; D43-R45 PolarHBondContact O-N 3.49Å; R45-Q47 PolarHBondContact O-N 3.03Å; R45-N157 PolarHBondContact O-ND2 3.44Å; R45-L159 HydrophobicContact CB-CD1 4.46Å; R45-L159 HydrophobicContact CG-CD1 3.65Å; R45-N446 PolarHBondContact NH1-ND2 3.12Å; R45-N446 PolarHBondContact NH1-OD1 3.44Å; R45-N446 PolarHBondContact NH2-OD1 2.88Å
46	L	49.2	Very low	72.9	Confident	95 Å²	95	42.8 Å²	42.8	50%	0.497	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-14.7	178.2	-60.8	179.9	0	0	0	112.4	Y36 D43 T44 N48	Y36-L46 HydrophobicContact CE1-CD1 3.76Å; Y36-L46 HydrophobicContact CE1-CG 4.31Å; D43-L46 WeakPolarHBondContact O-CB 3.24Å; D43-L46 PolarHBondContact O-N 3.02Å; T44-L46 PolarHBondContact O-N 3.02Å; L46-N48 PolarHBondContact O-N 3.19Å
47	Q	54.2	Low	73.8	Confident	88 Å²	88	38.3 Å²	38.3	41%	0.411	23%	0.226	S	C	.	.			trans	-87.3	103.7	-179.7	-50.8	-174.2	24.5	0	0	110.2	T44 R45 G49	T44-Q47 WeakPolarHBondContact O-CB 3.37Å; T44-Q47 PolarHBondContact O-N 3.11Å; R45-Q47 PolarHBondContact O-N 3.03Å; Q47-G49 PolarHBondContact O-N 2.87Å
48	N	55.1	Low	74.6	Confident	22 Å²	22	36 Å²	36	12%	0.118	20%	0.201	C	C	.	.			trans	-71.9	38.9	-179.8	-78.1	-20.7	0	0	0	114.1	L46 F50 E77 N157	L46-N48 PolarHBondContact O-N 3.19Å; N48-F50 WeakPolarHBondContact O-CD2 3.38Å; N48-F50 PolarHBondContact O-N 3.34Å; N48-E77 WeakPolarHBondContact ND2-CA 3.46Å; N48-E77 PolarHBondContact ND2-O 2.99Å; N48-N157 PolarHBondContact OD1-ND2 3.15Å
49	G	60.6	Low	74.7	Confident	6 Å²	6	36.1 Å²	36.1	6%	0.062	20%	0.203	C	C	.	.	S	Bend	trans	75.8	-42.9	-177.8	0	0	0	0	0	114.5	Q47 K265	Q47-G49 PolarHBondContact O-N 2.87Å; G49-K265 PolarHBondContact O-NZ 3.18Å
50	F	69.6	Low	74.6	Confident	9 Å²	9	36.3 Å²	36.3	4%	0.039	20%	0.204	C	C	.	.			trans	-62	142	173.8	-61.2	-81.1	0	0	0	112.6	N48 I72 T75 L80 I99 P144 L148 L149	N48-F50 WeakPolarHBondContact O-CD2 3.38Å; N48-F50 PolarHBondContact O-N 3.34Å; F50-I72 HydrophobicContact CB-CD1 4.13Å; F50-I72 HydrophobicContact CD1-CD1 3.71Å; F50-I72 HydrophobicContact CG-CD1 4.32Å; F50-T75 HydrophobicContact CB-CG2 3.87Å; F50-L80 HydrophobicContact CB-CD2 4.07Å; F50-L80 HydrophobicContact CD1-CD1 4.17Å; F50-L80 HydrophobicContact CD1-CD2 4.46Å; F50-L80 HydrophobicContact CD2-CD2 4.37Å; F50-L80 HydrophobicContact CE1-CD1 4.23Å; F50-L80 HydrophobicContact CG-CD2 4.05Å; F50-I99 HydrophobicContact CD2-CD1 3.99Å; F50-I99 HydrophobicContact CE2-CD1 3.77Å; F50-I99 HydrophobicContact CE2-CG1 4.49Å; F50-I99 HydrophobicContact CE2-CG2 4.14Å; F50-I99 HydrophobicContact CZ-CD1 4.49Å; F50-I99 HydrophobicContact CZ-CG2 4.15Å; F50-P144 HydrophobicContact CD1-CB 3.73Å; F50-P144 HydrophobicContact CD1-CG 3.78Å; F50-P144 HydrophobicContact CE1-CB 3.54Å; F50-P144 HydrophobicContact CE1-CG 3.79Å; F50-L148 HydrophobicContact CD2-CD1 4.4Å; F50-L148 HydrophobicContact CE1-CB 4.4Å; F50-L148 HydrophobicContact CE2-CB 3.98Å; F50-L148 HydrophobicContact CE2-CD1 4.23Å; F50-L148 HydrophobicContact CZ-CB 3.7Å; F50-L148 HydrophobicContact CZ-CD1 4.34Å; F50-L149 HydrophobicContact CE1-CD2 3.71Å; F50-L149 HydrophobicContact CE1-CG 4.23Å; F50-L149 HydrophobicContact CZ-CD2 3.74Å; F50-L149 HydrophobicContact CZ-CG 4.29Å
51	A	70.3	Confident	74	Confident	35 Å²	35	39 Å²	39	29%	0.289	21%	0.211	S	C	.	.			trans	-130.4	151.9	174.7	0	0	0	0	0	111.5	M54	A51-M54 HydrophobicContact CB-CE 4.04Å; A51-M54 HydrophobicContact CB-CG 4.38Å; A51-M54 HydrophobicContact CB-SD 4.29Å; A51-M54 PolarHBondContact N-SD 3.49Å; A51-M54 VanDerWaalsContact N-SD 3.36Å; A51-M54 WeakPolarHBondContact O-CB 3.49Å; A51-M54 WeakPolarHBondContact O-CG 3.34Å; A51-M54 PolarHBondContact O-N 3.05Å
52	P	78.4	Confident	73.3	Confident	80 Å²	80	43.3 Å²	43.3	52%	0.519	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	144.4	167.1	-22.5	33.5	0	0	0	111.7	M54 I72	P52-M54 VanDerWaalsContact C-N 3.29Å; P52-M54 PolarHBondContact O-N 2.87Å; P52-I72 CarbonylContact C-O 3.48Å; P52-I72 WeakPolarHBondContact CA-O 3.36Å
53	G	83.2	Confident	73.1	Confident	48 Å²	48	46.9 Å²	46.9	50%	0.495	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	-14.3	-177.1	0	0	0	0	0	115.2	I72	G53-I72 PolarHBondContact N-O 3.17Å
54	M	88.2	Confident	73.2	Confident	28 Å²	28	48 Å²	48	14%	0.138	27%	0.268	C	S	.	.			trans	-62.7	147.4	169.3	-73	-178.7	172.9	0	0	111.1	A51 P52 T71 I72 C142 P144	A51-M54 HydrophobicContact CB-CE 4.04Å; A51-M54 HydrophobicContact CB-CG 4.38Å; A51-M54 HydrophobicContact CB-SD 4.29Å; A51-M54 PolarHBondContact N-SD 3.49Å; A51-M54 VanDerWaalsContact N-SD 3.36Å; A51-M54 WeakPolarHBondContact O-CB 3.49Å; A51-M54 WeakPolarHBondContact O-CG 3.34Å; A51-M54 PolarHBondContact O-N 3.05Å; P52-M54 VanDerWaalsContact C-N 3.29Å; P52-M54 PolarHBondContact O-N 2.87Å; M54-T71 WeakPolarHBondContact O-CA 3.5Å; M54-I72 HydrophobicContact CB-CD1 3.99Å; M54-I72 HydrophobicContact CB-CG1 4.35Å; M54-I72 PolarHBondContact O-N 3.43Å; M54-C142 CarbonylContact C-O 3.58Å; M54-C142 WeakPolarHBondContact CA-O 3.47Å; M54-C142 WeakPolarHBondContact CB-O 3.29Å; M54-C142 HydrophobicContact CG-CB 4.36Å; M54-P144 HydrophobicContact CB-CG 4.22Å; M54-P144 HydrophobicContact SD-CB 4.21Å; M54-P144 HydrophobicContact SD-CG 4.02Å
55	K	93.3	Very high	74	Confident	32 Å²	32	52.2 Å²	52.2	14%	0.139	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	141.1	177.2	-62.3	-172.9	-176	-74.1	0	111.3	V69 A70 T71 D85 I107 T137 L138 A141 C142 S143 P144	K55-V69 HydrophobicContact CB-CG1 4.23Å; K55-V69 HydrophobicContact CD-CG1 4.29Å; K55-A70 WeakPolarHBondContact CA-O 3.47Å; K55-T71 PolarHBondContact NZ-OG1 2.89Å; K55-D85 WeakPolarHBondContact CD-OD2 3.42Å; K55-D85 WeakPolarHBondContact CE-OD2 3.31Å; K55-D85 IonicContact NZ-OD1 2.69Å; K55-D85 IonicContact NZ-OD2 3.66Å; K55-D85 PolarHBondContact NZ-OD2 3.45Å; K55-I107 HydrophobicContact CB-CD1 4.05Å; K55-I107 HydrophobicContact CB-CG1 4.32Å; K55-I107 WeakPolarHBondContact O-CG1 3.44Å; K55-T137 HydrophobicContact CD-CG2 4.13Å; K55-T137 WeakPolarHBondContact CE-O 3.46Å; K55-L138 HydrophobicContact CD-CD2 4.08Å; K55-A141 HydrophobicContact CD-CB 3.71Å; K55-A141 HydrophobicContact CG-CB 4.23Å; K55-C142 PolarHBondContact N-O 2.83Å; K55-S143 WeakPolarHBondContact O-CA 3.15Å; K55-P144 WeakPolarHBondContact O-CD 3.37Å
56	L	92.1	Very high	75.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	163.6	178	56.3	74.1	0	0	0	110.9	V58 V69 A70 I72 L80 L82 L104 Y105 P144	L56-V58 HydrophobicContact CD1-CB 3.84Å; L56-V58 HydrophobicContact CD1-CG1 4.27Å; L56-V69 CarbonylContact O-C 3.58Å; L56-V69 WeakPolarHBondContact O-CA 3.35Å; L56-A70 HydrophobicContact CD1-CB 4.37Å; L56-A70 PolarHBondContact N-O 3.41Å; L56-A70 PolarHBondContact O-N 3.41Å; L56-I72 HydrophobicContact CD2-CD1 4.2Å; L56-I72 HydrophobicContact CD2-CG1 4.25Å; L56-L80 HydrophobicContact CD2-CD1 4.09Å; L56-L82 HydrophobicContact CD1-CD1 4.13Å; L56-L82 HydrophobicContact CD2-CD2 4.36Å; L56-L104 HydrophobicContact CD1-CD2 3.57Å; L56-L104 HydrophobicContact CD2-CD2 4Å; L56-L104 HydrophobicContact CG-CD2 4.47Å; L56-Y105 WeakPolarHBondContact CB-O 3.21Å; L56-P144 HydrophobicContact CB-CG 4.32Å; L56-P144 HydrophobicContact CD2-CG 4.31Å
57	E	92.1	Very high	77.3	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.019	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.1	169.4	-67.7	173.2	-171.4	0	0	108.6	Y105 I107 G108 W109 C110 L117	E57-Y105 PolarHBondContact N-O 3.4Å; E57-Y105 PolarHBondContact O-N 2.62Å; E57-I107 HydrophobicContact CG-CD1 4.19Å; E57-G108 PolarHBondContact OE1-N 3.04Å; E57-W109 PolarHBondContact OE2-N 2.99Å; E57-C110 VanDerWaalsContact OE2-CB 3.31Å; E57-C110 WeakPolarHBondContact OE2-CB 3.45Å; E57-C110 PolarHBondContact OE2-N 2.78Å; E57-C110 PolarHBondContact OE2-SG 3.02Å; E57-L117 HydrophobicContact CG-CD2 4.07Å
58	V	90.3	Very high	79.1	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.03	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.8	178.6	65.3	0	0	0	0	110.9	L56 V60 Y67 W68 A70 L82 Y84 F95 L104	L56-V58 HydrophobicContact CD1-CB 3.84Å; L56-V58 HydrophobicContact CD1-CG1 4.27Å; V58-V60 PolarHBondContact O-N 2.79Å; V58-Y67 WeakPolarHBondContact O-CA 3.23Å; V58-W68 PolarHBondContact N-O 3.14Å; V58-W68 PolarHBondContact O-N 3.38Å; V58-A70 HydrophobicContact CG1-CB 3.8Å; V58-L82 HydrophobicContact CG1-CD1 4.45Å; V58-L82 HydrophobicContact CG2-CD1 4.4Å; V58-Y84 HydrophobicContact CG1-CD1 4.23Å; V58-Y84 HydrophobicContact CG1-CE1 3.55Å; V58-F95 HydrophobicContact CG1-CZ 4.12Å; V58-L104 HydrophobicContact CB-CD2 3.8Å; V58-L104 HydrophobicContact CG2-CD2 3.48Å; V58-L104 VanDerWaalsContact CG2-CD2 3.48Å; V58-L104 HydrophobicContact CG2-CG 4.41Å
59	A	86.1	Confident	80.9	Confident	18 Å²	18	41.7 Å²	41.7	15%	0.149	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	138.6	176.9	0	0	0	0	0	111.8	T66 Y67 Y84 D103	A59-T66 WeakPolarHBondContact CA-O 3.43Å; A59-Y67 HydrophobicContact CB-CD1 4.23Å; A59-Y67 HydrophobicContact CB-CE1 3.84Å; A59-Y84 PolarHBondContact O-OH 3.12Å; A59-D103 HydrophobicContact CB-CB 4.33Å; A59-D103 PolarHBondContact N-O 3.31Å
60	V	82.9	Confident	82.4	Confident	6 Å²	6	41.4 Å²	41.4	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.6	179	-171.1	0	0	0	0	109.3	V58 T62 D63 T66 W68 Y84 P120	V58-V60 PolarHBondContact O-N 2.79Å; V60-T62 WeakPolarHBondContact CG1-OG1 3.22Å; V60-T62 PolarHBondContact O-N 3.35Å; V60-D63 CarbonylContact O-C 3.31Å; V60-D63 VanDerWaalsContact O-C 3.31Å; V60-D63 PolarHBondContact O-N 2.88Å; V60-D63 VanDerWaalsContact O-O 3.06Å; V60-T66 WeakPolarHBondContact CB-OG1 3.18Å; V60-T66 PolarHBondContact N-O 3.36Å; V60-W68 HydrophobicContact CG2-CB 3.91Å; V60-Y84 WeakPolarHBondContact CA-OH 3.35Å; V60-P120 HydrophobicContact CG1-CB 4.17Å; V60-P120 HydrophobicContact CG1-CG 3.98Å
61	R	68.8	Low	83.5	Confident	184 Å²	184	42 Å²	42	69%	0.694	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-13.1	-175.4	-77.2	-177	165.4	-178.4	-0.5	116	W96	R61-W96 PolarHBondContact NH2-O 3.33Å
62	T	67.9	Low	84.4	Confident	103 Å²	103	40.4 Å²	40.4	63%	0.632	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-27.5	176.9	47.2	0	0	0	0	113.7	V60	V60-T62 WeakPolarHBondContact CG1-OG1 3.22Å; V60-T62 PolarHBondContact O-N 3.35Å
63	D	72.3	Confident	84.6	Confident	74 Å²	74	39.1 Å²	39.1	40%	0.396	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	112.6	177.6	-173.2	-23.2	0	0	0	110.2	V60 E65 T66	V60-D63 CarbonylContact O-C 3.31Å; V60-D63 VanDerWaalsContact O-C 3.31Å; V60-D63 PolarHBondContact O-N 2.88Å; V60-D63 VanDerWaalsContact O-O 3.06Å; D63-E65 PolarHBondContact O-N 2.95Å; D63-E65 PolarHBondContact OD1-N 2.79Å; D63-T66 HydrophobicContact CB-CG2 4.12Å; D63-T66 PolarHBondContact O-N 2.89Å; D63-T66 VanDerWaalsContact O-N 3.08Å; D63-T66 PolarHBondContact O-OG1 3.06Å
64	P	66.8	Low	84	Confident	95 Å²	95	39.5 Å²	39.5	62%	0.617	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	-8.8	-175.1	31.3	-37.2	0	0	0	114.8
65	E	77.1	Confident	82.7	Confident	116 Å²	116	40.5 Å²	40.5	54%	0.542	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-8.7	172.3	-71	-67	158.4	0	0	112.8	D63 K115	D63-E65 PolarHBondContact O-N 2.95Å; D63-E65 PolarHBondContact OD1-N 2.79Å; E65-K115 IonicContact OE2-NZ 2.72Å; E65-K115 PolarHBondContact OE2-NZ 3.17Å
66	T	83.4	Confident	80.8	Confident	15 Å²	15	42.2 Å²	42.2	9%	0.092	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	148.3	179.6	67.3	0	0	0	0	112.2	A59 V60 D63 E118	A59-T66 WeakPolarHBondContact CA-O 3.43Å; V60-T66 WeakPolarHBondContact CB-OG1 3.18Å; V60-T66 PolarHBondContact N-O 3.36Å; D63-T66 HydrophobicContact CB-CG2 4.12Å; D63-T66 PolarHBondContact O-N 2.89Å; D63-T66 VanDerWaalsContact O-N 3.08Å; D63-T66 PolarHBondContact O-OG1 3.06Å; T66-E118 HydrophobicContact CG2-CB 4.36Å; T66-E118 HydrophobicContact CG2-CG 4.24Å
67	Y	90.5	Very high	79.2	Confident	14 Å²	14	48.6 Å²	48.6	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	155.4	-175.2	-67.1	-96	0	0	0	110.9	V58 A59 D103 Y105 W109 C110 K115 T116 L117 E118	V58-Y67 WeakPolarHBondContact O-CA 3.23Å; A59-Y67 HydrophobicContact CB-CD1 4.23Å; A59-Y67 HydrophobicContact CB-CE1 3.84Å; Y67-D103 HydrophobicContact CE1-CB 4.37Å; Y67-Y105 HydrophobicContact CD1-CD2 4.14Å; Y67-Y105 HydrophobicContact CD1-CE2 4.46Å; Y67-Y105 AromaticContact CE1-CD2 3.72Å; Y67-Y105 HydrophobicContact CE1-CD2 3.72Å; Y67-Y105 AromaticContact CE1-CE2 3.6Å; Y67-Y105 HydrophobicContact CE1-CE2 3.6Å; Y67-W109 HydrophobicContact CE1-CZ3 4.29Å; Y67-W109 HydrophobicContact CE2-CZ3 4.37Å; Y67-C110 WeakPolarHBondContact CB-SG 3.35Å; Y67-C110 VanDerWaalsContact CG-SG 3.57Å; Y67-K115 HydrophobicContact CD2-CB 4.14Å; Y67-K115 HydrophobicContact CD2-CG 4.47Å; Y67-K115 HydrophobicContact CE2-CB 4.41Å; Y67-K115 HydrophobicContact CE2-CD 4.35Å; Y67-K115 HydrophobicContact CE2-CG 4.25Å; Y67-T116 PolarHBondContact N-O 2.81Å; Y67-L117 CarbonylContact O-C 3.6Å; Y67-L117 VanDerWaalsContact O-CA 3.23Å; Y67-L117 WeakPolarHBondContact O-CA 3.46Å; Y67-E118 PolarHBondContact O-N 2.87Å
68	W	92.2	Very high	77.6	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156.4	169.9	-163.2	-113.6	0	0	0	112.3	V58 V60 Y84 D85 L117 A119 P120 W130 F133 L134	V58-W68 PolarHBondContact N-O 3.14Å; V58-W68 PolarHBondContact O-N 3.38Å; V60-W68 HydrophobicContact CG2-CB 3.91Å; W68-Y84 HydrophobicContact CB-CD1 3.89Å; W68-Y84 HydrophobicContact CB-CE1 4.05Å; W68-Y84 AromaticContact CD1-CD1 3.87Å; W68-Y84 HydrophobicContact CG-CD1 4.29Å; W68-D85 PolarHBondContact NE1-O 3.36Å; W68-L117 HydrophobicContact CE3-CB 4.07Å; W68-L117 HydrophobicContact CZ3-CB 4.03Å; W68-A119 HydrophobicContact CD2-CB 4.27Å; W68-A119 HydrophobicContact CE3-CB 4.31Å; W68-A119 HydrophobicContact CH2-CB 3.99Å; W68-A119 HydrophobicContact CZ2-CB 3.94Å; W68-A119 HydrophobicContact CZ3-CB 4.17Å; W68-P120 HydrophobicContact CB-CG 4.37Å; W68-P120 HydrophobicContact CG-CG 4.39Å; W68-W130 HydrophobicContact CH2-CD2 4.42Å; W68-W130 AromaticContact CH2-CE3 3.51Å; W68-W130 HydrophobicContact CH2-CE3 3.51Å; W68-W130 AromaticContact CH2-CZ3 3.92Å; W68-W130 HydrophobicContact CH2-CZ3 3.92Å; W68-W130 AromaticContact CZ2-CE3 3.64Å; W68-W130 HydrophobicContact CZ2-CE3 3.64Å; W68-W130 AromaticContact CZ2-CZ3 3.6Å; W68-W130 HydrophobicContact CZ2-CZ3 3.6Å; W68-F133 HydrophobicContact CZ2-CE1 4.39Å; W68-L134 HydrophobicContact CH2-CD1 3.9Å; W68-L134 HydrophobicContact CH2-CD2 3.98Å; W68-L134 HydrophobicContact CH2-CG 4.11Å; W68-L134 HydrophobicContact CZ2-CD2 4.05Å; W68-L134 HydrophobicContact CZ3-CD1 4.2Å
69	V	93.3	Very high	76.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.5	175.4	-176.1	0	0	0	0	109.8	K55 L56 D85 I107 L134 L138	K55-V69 HydrophobicContact CB-CG1 4.23Å; K55-V69 HydrophobicContact CD-CG1 4.29Å; L56-V69 CarbonylContact O-C 3.58Å; L56-V69 WeakPolarHBondContact O-CA 3.35Å; V69-D85 HydrophobicContact CB-CB 4.41Å; V69-D85 HydrophobicContact CG1-CB 4.35Å; V69-D85 WeakPolarHBondContact CG1-OD2 3.47Å; V69-D85 PolarHBondContact O-N 3.11Å; V69-I107 HydrophobicContact CG1-CD1 4.04Å; V69-I107 HydrophobicContact CG2-CD1 4.43Å; V69-L134 HydrophobicContact CB-CD2 4.47Å; V69-L134 HydrophobicContact CG2-CD2 3.85Å; V69-L138 HydrophobicContact CG1-CD2 4.02Å; V69-L138 HydrophobicContact CG2-CD2 4.48Å
70	A	92.8	Very high	75.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.1	174.5	0	0	0	0	0	111.7	K55 L56 V58 L82 R83 Y84	K55-A70 WeakPolarHBondContact CA-O 3.47Å; L56-A70 HydrophobicContact CD1-CB 4.37Å; L56-A70 PolarHBondContact N-O 3.41Å; L56-A70 PolarHBondContact O-N 3.41Å; V58-A70 HydrophobicContact CG1-CB 3.8Å; A70-L82 HydrophobicContact CB-CB 4.31Å; A70-R83 CarbonylContact C-O 3.48Å; A70-R83 WeakPolarHBondContact CA-O 3.4Å; A70-R83 WeakPolarHBondContact CB-O 3.35Å; A70-Y84 HydrophobicContact CB-CD1 4.18Å
71	T	91.9	Very high	75.4	Confident	22 Å²	22	54.7 Å²	54.7	14%	0.135	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.1	173.4	-57.8	0	0	0	0	110.7	M54 K55 I73 L82 R83 D85	M54-T71 WeakPolarHBondContact O-CA 3.5Å; K55-T71 PolarHBondContact NZ-OG1 2.89Å; T71-I73 PolarHBondContact O-N 2.83Å; T71-L82 WeakPolarHBondContact O-CA 3.31Å; T71-R83 PolarHBondContact N-O 2.84Å; T71-R83 PolarHBondContact O-N 3.2Å; T71-D85 WeakPolarHBondContact CB-OD1 3.49Å; T71-D85 PolarHBondContact N-OD1 3.4Å; T71-D85 PolarHBondContact OG1-OD1 2.83Å; T71-D85 PolarHBondContact OG1-OD2 2.84Å
72	I	88.2	Confident	76.3	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	114.1	169.1	-55.6	-175.8	0	0	0	108.8	F50 P52 G53 M54 L56 T75 L80 L82 P144	F50-I72 HydrophobicContact CB-CD1 4.13Å; F50-I72 HydrophobicContact CD1-CD1 3.71Å; F50-I72 HydrophobicContact CG-CD1 4.32Å; P52-I72 CarbonylContact C-O 3.48Å; P52-I72 WeakPolarHBondContact CA-O 3.36Å; G53-I72 PolarHBondContact N-O 3.17Å; M54-I72 HydrophobicContact CB-CD1 3.99Å; M54-I72 HydrophobicContact CB-CG1 4.35Å; M54-I72 PolarHBondContact O-N 3.43Å; L56-I72 HydrophobicContact CD2-CD1 4.2Å; L56-I72 HydrophobicContact CD2-CG1 4.25Å; I72-T75 HydrophobicContact CG2-CG2 3.95Å; I72-L80 HydrophobicContact CD1-CD1 4Å; I72-L80 HydrophobicContact CD1-CD2 4.26Å; I72-L80 HydrophobicContact CG1-CD1 4.47Å; I72-L80 HydrophobicContact CG2-CD2 4.33Å; I72-L82 HydrophobicContact CB-CD2 4.38Å; I72-L82 HydrophobicContact CG1-CD2 3.79Å; I72-P144 HydrophobicContact CD1-CG 4.33Å
73	I	82.9	Confident	77.4	Confident	53 Å²	53	41.6 Å²	41.6	27%	0.272	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-39.6	177.2	-57.6	-57.2	0	0	0	111	T71 L81 R83	T71-I73 PolarHBondContact O-N 2.83Å; I73-L81 HydrophobicContact CB-CB 4.4Å; I73-L81 HydrophobicContact CB-CD2 4.16Å; I73-L81 HydrophobicContact CB-CG 4.18Å; I73-L81 HydrophobicContact CG2-CD2 3.98Å; I73-L81 PolarHBondContact N-O 3.1Å; I73-R83 HydrophobicContact CD1-CB 3.82Å; I73-R83 HydrophobicContact CG1-CB 3.72Å
74	T	70.8	Confident	78.2	Confident	56 Å²	56	38.9 Å²	38.9	34%	0.344	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	161.9	169.7	-167.8	0	0	0	0	111.6	L81 W96	T74-L81 HydrophobicContact CG2-CB 3.73Å; T74-L81 HydrophobicContact CG2-CD2 3.99Å; T74-L81 PolarHBondContact O-N 3.16Å; T74-W96 HydrophobicContact CG2-CH2 3.95Å
75	T	61.7	Low	79.3	Confident	49 Å²	49	35 Å²	35	30%	0.301	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.4	177.3	59.6	0	0	0	0	110.3	F50 I72 L80	F50-T75 HydrophobicContact CB-CG2 3.87Å; I72-T75 HydrophobicContact CG2-CG2 3.95Å; T75-L80 HydrophobicContact CG2-CD2 3.81Å
76	C	53.9	Low	79.7	Confident	67 Å²	67	30.6 Å²	30.6	45%	0.453	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	79.5	178.5	-178.7	0	0	0	0	108.9	Q78 L79 W96	C76-Q78 PolarHBondContact O-N 2.82Å; C76-L79 HydrophobicContact CB-CB 4.36Å; C76-L79 PolarHBondContact N-O 3.06Å; C76-L79 PolarHBondContact O-N 3.24Å; C76-W96 HydrophobicContact CB-CH2 3.89Å; C76-W96 HydrophobicContact CB-CZ3 3.75Å
77	E	57.4	Low	79.6	Confident	134 Å²	134	32.3 Å²	32.3	63%	0.626	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.9	-101.3	-168.3	-63.5	179.1	-155.6	0	0	112.8	N48 L79	N48-E77 WeakPolarHBondContact ND2-CA 3.46Å; N48-E77 PolarHBondContact ND2-O 2.99Å; E77-L79 VanDerWaalsContact C-N 3.34Å
78	Q	57.9	Low	79.2	Confident	70 Å²	70	34.1 Å²	34.1	33%	0.327	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1.1	-173.5	-62.2	160.3	47.6	0	0	112.2	C76 I99	C76-Q78 PolarHBondContact O-N 2.82Å; Q78-I99 WeakPolarHBondContact O-CG1 3.2Å; Q78-I99 PolarHBondContact O-N 3.49Å
79	L	60	Low	78.4	Confident	66 Å²	66	41.2 Å²	41.2	35%	0.346	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133.9	179.3	-57.7	-179.6	0	0	0	110.7	C76 E77 W96 C97 D98	C76-L79 HydrophobicContact CB-CB 4.36Å; C76-L79 PolarHBondContact N-O 3.06Å; C76-L79 PolarHBondContact O-N 3.24Å; E77-L79 VanDerWaalsContact C-N 3.34Å; L79-W96 HydrophobicContact CB-CE3 3.78Å; L79-W96 HydrophobicContact CB-CZ3 4.03Å; L79-C97 CarbonylContact C-O 3.58Å; L79-C97 VanDerWaalsContact CA-O 3.24Å; L79-C97 WeakPolarHBondContact CA-O 3.34Å; L79-D98 HydrophobicContact CD2-CB 3.87Å
80	L	73.4	Confident	77.6	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.6	169.1	-56.3	177.6	0	0	0	108.6	F50 L56 I72 T75 L82 W96 C97 I99 L104	F50-L80 HydrophobicContact CB-CD2 4.07Å; F50-L80 HydrophobicContact CD1-CD1 4.17Å; F50-L80 HydrophobicContact CD1-CD2 4.46Å; F50-L80 HydrophobicContact CD2-CD2 4.37Å; F50-L80 HydrophobicContact CE1-CD1 4.23Å; F50-L80 HydrophobicContact CG-CD2 4.05Å; L56-L80 HydrophobicContact CD2-CD1 4.09Å; I72-L80 HydrophobicContact CD1-CD1 4Å; I72-L80 HydrophobicContact CD1-CD2 4.26Å; I72-L80 HydrophobicContact CG1-CD1 4.47Å; I72-L80 HydrophobicContact CG2-CD2 4.33Å; T75-L80 HydrophobicContact CG2-CD2 3.81Å; L80-L82 HydrophobicContact CB-CD2 3.76Å; L80-L82 HydrophobicContact CB-CG 4.1Å; L80-L82 HydrophobicContact CD1-CD2 4.26Å; L80-W96 WeakPolarHBondContact O-CA 3.41Å; L80-C97 PolarHBondContact N-O 3.49Å; L80-C97 PolarHBondContact O-N 3.04Å; L80-I99 HydrophobicContact CD1-CD1 4.35Å; L80-I99 HydrophobicContact CD1-CG1 3.97Å; L80-I99 HydrophobicContact CD2-CD1 3.99Å; L80-I99 HydrophobicContact CD2-CG1 4.39Å; L80-I99 HydrophobicContact CG-CD1 3.92Å; L80-I99 HydrophobicContact CG-CG1 3.75Å; L80-L104 HydrophobicContact CD1-CD1 4.37Å
81	L	81	Confident	76.7	Confident	24 Å²	24	53.4 Å²	53.4	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.2	162.9	-173.2	64.8	0	0	0	107.3	I73 T74 D94 W96	I73-L81 HydrophobicContact CB-CB 4.4Å; I73-L81 HydrophobicContact CB-CD2 4.16Å; I73-L81 HydrophobicContact CB-CG 4.18Å; I73-L81 HydrophobicContact CG2-CD2 3.98Å; I73-L81 PolarHBondContact N-O 3.1Å; T74-L81 HydrophobicContact CG2-CB 3.73Å; T74-L81 HydrophobicContact CG2-CD2 3.99Å; T74-L81 PolarHBondContact O-N 3.16Å; L81-D94 HydrophobicContact CD1-CB 3.85Å; L81-D94 HydrophobicContact CD2-CB 4.29Å; L81-D94 HydrophobicContact CG-CB 4.09Å; L81-W96 HydrophobicContact CB-CD2 4.25Å; L81-W96 HydrophobicContact CB-CE3 3.95Å; L81-W96 HydrophobicContact CB-CH2 3.96Å; L81-W96 HydrophobicContact CB-CZ2 4.23Å; L81-W96 HydrophobicContact CB-CZ3 3.81Å; L81-W96 HydrophobicContact CD1-CD2 3.89Å; L81-W96 HydrophobicContact CD1-CE3 4.42Å; L81-W96 HydrophobicContact CD1-CG 4.08Å; L81-W96 HydrophobicContact CD1-CZ2 4.29Å
82	L	87.4	Confident	75.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	145.9	-177.2	-58.5	-177.4	0	0	0	110.7	L56 V58 A70 T71 I72 L80 D94 F95 C97 L104	L56-L82 HydrophobicContact CD1-CD1 4.13Å; L56-L82 HydrophobicContact CD2-CD2 4.36Å; V58-L82 HydrophobicContact CG1-CD1 4.45Å; V58-L82 HydrophobicContact CG2-CD1 4.4Å; A70-L82 HydrophobicContact CB-CB 4.31Å; T71-L82 WeakPolarHBondContact O-CA 3.31Å; I72-L82 HydrophobicContact CB-CD2 4.38Å; I72-L82 HydrophobicContact CG1-CD2 3.79Å; L80-L82 HydrophobicContact CB-CD2 3.76Å; L80-L82 HydrophobicContact CB-CG 4.1Å; L80-L82 HydrophobicContact CD1-CD2 4.26Å; L82-D94 CarbonylContact O-C 3.54Å; L82-D94 WeakPolarHBondContact O-CA 3.4Å; L82-F95 HydrophobicContact CB-CD1 4.4Å; L82-F95 HydrophobicContact CB-CD2 4.43Å; L82-F95 HydrophobicContact CB-CE1 3.93Å; L82-F95 HydrophobicContact CB-CE2 3.98Å; L82-F95 HydrophobicContact CB-CZ 3.71Å; L82-F95 HydrophobicContact CD1-CE2 3.97Å; L82-F95 HydrophobicContact CD1-CZ 4.08Å; L82-F95 HydrophobicContact CG-CE2 4.48Å; L82-F95 PolarHBondContact N-O 3.49Å; L82-F95 WeakPolarHBondContact O-CD1 3.39Å; L82-F95 PolarHBondContact O-N 2.79Å; L82-C97 HydrophobicContact CD1-CB 3.57Å; L82-C97 HydrophobicContact CG-CB 3.96Å; L82-L104 HydrophobicContact CD1-CD2 3.8Å
83	R	89.8	Confident	75.2	Confident	13 Å²	13	64.2 Å²	64.2	5%	0.049	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.4	165.6	-176.3	-177	-61.5	148.4	13.8	108.5	A70 T71 I73 G88 E89 D94	A70-R83 CarbonylContact C-O 3.48Å; A70-R83 WeakPolarHBondContact CA-O 3.4Å; A70-R83 WeakPolarHBondContact CB-O 3.35Å; T71-R83 PolarHBondContact N-O 2.84Å; T71-R83 PolarHBondContact O-N 3.2Å; I73-R83 HydrophobicContact CD1-CB 3.82Å; I73-R83 HydrophobicContact CG1-CB 3.72Å; R83-G88 WeakPolarHBondContact CD-O 3.26Å; R83-G88 PolarHBondContact NH1-O 2.64Å; R83-E89 IonicContact CZ-OE2 2.68Å; R83-E89 IonicContact NH1-OE1 2.72Å; R83-E89 IonicContact NH1-OE2 2.9Å; R83-E89 PolarHBondContact NH1-OE2 2.86Å; R83-D94 IonicContact CZ-OD1 2.69Å; R83-D94 VanDerWaalsContact CZ-OD1 3.27Å; R83-D94 IonicContact CZ-OD2 3.69Å; R83-D94 IonicContact NE-OD1 2.73Å; R83-D94 PolarHBondContact NE-OD1 3.36Å; R83-D94 IonicContact NH2-OD1 3.56Å; R83-D94 PolarHBondContact NH2-OD1 3.14Å; R83-D94 IonicContact NH2-OD2 2.65Å; R83-D94 PolarHBondContact NH2-OD2 3.09Å
84	Y	91	Very high	75.1	Confident	16 Å²	16	63.3 Å²	63.3	6%	0.063	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.7	172.1	-71.6	-66.6	0	0	0	110.7	V58 A59 V60 W68 A70 G86 Y87 F95 P120	V58-Y84 HydrophobicContact CG1-CD1 4.23Å; V58-Y84 HydrophobicContact CG1-CE1 3.55Å; A59-Y84 PolarHBondContact O-OH 3.12Å; V60-Y84 WeakPolarHBondContact CA-OH 3.35Å; W68-Y84 HydrophobicContact CB-CD1 3.89Å; W68-Y84 HydrophobicContact CB-CE1 4.05Å; W68-Y84 AromaticContact CD1-CD1 3.87Å; W68-Y84 HydrophobicContact CG-CD1 4.29Å; A70-Y84 HydrophobicContact CB-CD1 4.18Å; Y84-G86 PolarHBondContact O-N 3.24Å; Y84-Y87 WeakPolarHBondContact O-CD2 3.25Å; Y84-Y87 PolarHBondContact O-N 2.75Å; Y84-F95 HydrophobicContact CD1-CE1 4.37Å; Y84-F95 HydrophobicContact CD2-CD1 4.26Å; Y84-F95 AromaticContact CD2-CE1 3.51Å; Y84-F95 HydrophobicContact CD2-CE1 3.51Å; Y84-F95 HydrophobicContact CD2-CZ 4.25Å; Y84-F95 HydrophobicContact CE1-CE1 4.27Å; Y84-F95 HydrophobicContact CE1-CZ 4.08Å; Y84-F95 HydrophobicContact CE2-CD1 4.11Å; Y84-F95 AromaticContact CE2-CE1 3.36Å; Y84-F95 HydrophobicContact CE2-CE1 3.36Å; Y84-F95 AromaticContact CE2-CZ 3.74Å; Y84-F95 HydrophobicContact CE2-CZ 3.74Å; Y84-F95 HydrophobicContact CG-CE1 4.03Å; Y84-F95 AromaticContact CZ-CE1 3.77Å; Y84-F95 AromaticContact CZ-CZ 3.64Å; Y84-P120 HydrophobicContact CD1-CG 4.02Å; Y84-P120 HydrophobicContact CD2-CG 3.85Å; Y84-P120 HydrophobicContact CE1-CG 4.25Å; Y84-P120 HydrophobicContact CE2-CG 4.1Å; Y84-P120 HydrophobicContact CG-CG 3.81Å
85	D	88.9	Confident	75.4	Confident	13 Å²	13	61.5 Å²	61.5	7%	0.07	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	129	-176.1	-76	6.2	0	0	0	110.7	K55 W68 V69 T71 I123 F133 T137	K55-D85 WeakPolarHBondContact CD-OD2 3.42Å; K55-D85 WeakPolarHBondContact CE-OD2 3.31Å; K55-D85 IonicContact NZ-OD1 2.69Å; K55-D85 IonicContact NZ-OD2 3.66Å; K55-D85 PolarHBondContact NZ-OD2 3.45Å; W68-D85 PolarHBondContact NE1-O 3.36Å; V69-D85 HydrophobicContact CB-CB 4.41Å; V69-D85 HydrophobicContact CG1-CB 4.35Å; V69-D85 WeakPolarHBondContact CG1-OD2 3.47Å; V69-D85 PolarHBondContact O-N 3.11Å; T71-D85 WeakPolarHBondContact CB-OD1 3.49Å; T71-D85 PolarHBondContact N-OD1 3.4Å; T71-D85 PolarHBondContact OG1-OD1 2.83Å; T71-D85 PolarHBondContact OG1-OD2 2.84Å; D85-I123 VanDerWaalsContact O-CD1 3.28Å; D85-I123 WeakPolarHBondContact O-CD1 3.44Å; D85-F133 HydrophobicContact CB-CE1 4.45Å; D85-F133 HydrophobicContact CB-CZ 4.39Å; D85-T137 HydrophobicContact CB-CG2 4.12Å; D85-T137 WeakPolarHBondContact OD2-CG2 3.27Å
86	G	85.3	Confident	76.2	Confident	24 Å²	24	65.1 Å²	65.1	25%	0.247	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	113.1	-8.8	-171.3	0	0	0	0	0	114.8	Y84	Y84-G86 PolarHBondContact O-N 3.24Å
87	Y	82.4	Confident	77.2	Confident	51 Å²	51	62.5 Å²	62.5	20%	0.2	30%	0.296	C	S	.	.	S	Bend	trans	-82.7	-9	168.2	-78.1	-78.4	0	0	0	114.6	Y84 E89 D90 A93 G122 I123	Y84-Y87 WeakPolarHBondContact O-CD2 3.25Å; Y84-Y87 PolarHBondContact O-N 2.75Å; Y87-E89 PolarHBondContact O-N 2.75Å; Y87-D90 PolarHBondContact O-N 2.9Å; Y87-A93 HydrophobicContact CD1-CB 3.52Å; Y87-A93 HydrophobicContact CD2-CB 3.62Å; Y87-A93 HydrophobicContact CE1-CB 3.95Å; Y87-A93 HydrophobicContact CE2-CB 4.01Å; Y87-A93 HydrophobicContact CG-CB 3.36Å; Y87-G122 WeakPolarHBondContact CE1-O 3.47Å; Y87-G122 VanDerWaalsContact OH-CA 3.28Å; Y87-G122 WeakPolarHBondContact OH-CA 3.47Å; Y87-I123 HydrophobicContact CD2-CD1 3.51Å; Y87-I123 HydrophobicContact CD2-CG1 3.69Å; Y87-I123 HydrophobicContact CE1-CG1 4.35Å; Y87-I123 HydrophobicContact CE2-CD1 3.42Å; Y87-I123 VanDerWaalsContact CE2-CD1 3.42Å; Y87-I123 HydrophobicContact CE2-CG1 3.27Å; Y87-I123 HydrophobicContact CG-CD1 4.47Å; Y87-I123 HydrophobicContact CG-CG1 4.4Å
88	G	80.5	Confident	77.8	Confident	52 Å²	52	58 Å²	58	54%	0.536	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	-126.2	-177.8	0	0	0	0	0	111.5	R83	R83-G88 WeakPolarHBondContact CD-O 3.26Å; R83-G88 PolarHBondContact NH1-O 2.64Å
89	E	75.1	Confident	78.5	Confident	153 Å²	153	54.9 Å²	54.9	72%	0.715	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	14.6	178.4	-69.2	-54.7	150.9	0	0	115.5	R83 Y87 R91	R83-E89 IonicContact CZ-OE2 2.68Å; R83-E89 IonicContact NH1-OE1 2.72Å; R83-E89 IonicContact NH1-OE2 2.9Å; R83-E89 PolarHBondContact NH1-OE2 2.86Å; Y87-E89 PolarHBondContact O-N 2.75Å; E89-R91 PolarHBondContact O-N 2.93Å
90	D	76.9	Confident	78.7	Confident	65 Å²	65	57.2 Å²	57.2	35%	0.348	27%	0.266	S	S	.	.			trans	-74.6	90.5	177	-169.2	4.1	0	0	0	112.5	Y87 R92 A93	Y87-D90 PolarHBondContact O-N 2.9Å; D90-R92 PolarHBondContact O-N 3.04Å; D90-R92 WeakPolarHBondContact OD1-CB 3.08Å; D90-R92 WeakPolarHBondContact OD1-CD 3.43Å; D90-R92 WeakPolarHBondContact OD1-CG 3.48Å; D90-R92 PolarHBondContact OD1-N 2.73Å; D90-A93 WeakPolarHBondContact O-CB 3.46Å; D90-A93 PolarHBondContact O-N 3.19Å
91	R	74.1	Confident	78.4	Confident	191 Å²	191	63.9 Å²	63.9	72%	0.721	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-56.9	-8.9	174.3	-63.3	-176.9	-176.3	-161.9	-1.3	114.8	E89 A93 D94	E89-R91 PolarHBondContact O-N 2.93Å; R91-A93 VanDerWaalsContact C-N 3.29Å; R91-D94 WeakPolarHBondContact CA-OD2 3.49Å; R91-D94 WeakPolarHBondContact O-CB 3.46Å; R91-D94 PolarHBondContact O-N 3.03Å
92	R	74.7	Confident	77.9	Confident	230 Å²	230	63.8 Å²	63.8	87%	0.868	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-76	-18.8	172.7	-58.5	170.2	178.2	-174.3	1.2	112.8	D90 D94	D90-R92 PolarHBondContact O-N 3.04Å; D90-R92 WeakPolarHBondContact OD1-CB 3.08Å; D90-R92 WeakPolarHBondContact OD1-CD 3.43Å; D90-R92 WeakPolarHBondContact OD1-CG 3.48Å; D90-R92 PolarHBondContact OD1-N 2.73Å; R92-D94 VanDerWaalsContact C-N 3.34Å
93	A	74.3	Confident	77.5	Confident	20 Å²	20	67.9 Å²	67.9	17%	0.165	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-86.6	-5.1	173.6	0	0	0	0	0	113.1	Y87 D90 R91	Y87-A93 HydrophobicContact CD1-CB 3.52Å; Y87-A93 HydrophobicContact CD2-CB 3.62Å; Y87-A93 HydrophobicContact CE1-CB 3.95Å; Y87-A93 HydrophobicContact CE2-CB 4.01Å; Y87-A93 HydrophobicContact CG-CB 3.36Å; D90-A93 WeakPolarHBondContact O-CB 3.46Å; D90-A93 PolarHBondContact O-N 3.19Å; R91-A93 VanDerWaalsContact C-N 3.29Å
94	D	81.6	Confident	77.3	Confident	35 Å²	35	67.4 Å²	67.4	19%	0.187	32%	0.318	C	S	.	.			trans	-70.7	130.3	-179.5	-61.1	0.1	0	0	0	110.3	L81 L82 R83 R91 R92	L81-D94 HydrophobicContact CD1-CB 3.85Å; L81-D94 HydrophobicContact CD2-CB 4.29Å; L81-D94 HydrophobicContact CG-CB 4.09Å; L82-D94 CarbonylContact O-C 3.54Å; L82-D94 WeakPolarHBondContact O-CA 3.4Å; R83-D94 IonicContact CZ-OD1 2.69Å; R83-D94 VanDerWaalsContact CZ-OD1 3.27Å; R83-D94 IonicContact CZ-OD2 3.69Å; R83-D94 IonicContact NE-OD1 2.73Å; R83-D94 PolarHBondContact NE-OD1 3.36Å; R83-D94 IonicContact NH2-OD1 3.56Å; R83-D94 PolarHBondContact NH2-OD1 3.14Å; R83-D94 IonicContact NH2-OD2 2.65Å; R83-D94 PolarHBondContact NH2-OD2 3.09Å; R91-D94 WeakPolarHBondContact CA-OD2 3.49Å; R91-D94 WeakPolarHBondContact O-CB 3.46Å; R91-D94 PolarHBondContact O-N 3.03Å; R92-D94 VanDerWaalsContact C-N 3.34Å
95	F	76.9	Confident	77	Confident	17 Å²	17	68.7 Å²	68.7	8%	0.075	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.7	179.6	65.9	-84.3	0	0	0	112.5	V58 L82 Y84 C97	V58-F95 HydrophobicContact CG1-CZ 4.12Å; L82-F95 HydrophobicContact CB-CD1 4.4Å; L82-F95 HydrophobicContact CB-CD2 4.43Å; L82-F95 HydrophobicContact CB-CE1 3.93Å; L82-F95 HydrophobicContact CB-CE2 3.98Å; L82-F95 HydrophobicContact CB-CZ 3.71Å; L82-F95 HydrophobicContact CD1-CE2 3.97Å; L82-F95 HydrophobicContact CD1-CZ 4.08Å; L82-F95 HydrophobicContact CG-CE2 4.48Å; L82-F95 PolarHBondContact N-O 3.49Å; L82-F95 WeakPolarHBondContact O-CD1 3.39Å; L82-F95 PolarHBondContact O-N 2.79Å; Y84-F95 HydrophobicContact CD1-CE1 4.37Å; Y84-F95 HydrophobicContact CD2-CD1 4.26Å; Y84-F95 AromaticContact CD2-CE1 3.51Å; Y84-F95 HydrophobicContact CD2-CE1 3.51Å; Y84-F95 HydrophobicContact CD2-CZ 4.25Å; Y84-F95 HydrophobicContact CE1-CE1 4.27Å; Y84-F95 HydrophobicContact CE1-CZ 4.08Å; Y84-F95 HydrophobicContact CE2-CD1 4.11Å; Y84-F95 AromaticContact CE2-CE1 3.36Å; Y84-F95 HydrophobicContact CE2-CE1 3.36Å; Y84-F95 AromaticContact CE2-CZ 3.74Å; Y84-F95 HydrophobicContact CE2-CZ 3.74Å; Y84-F95 HydrophobicContact CG-CE1 4.03Å; Y84-F95 AromaticContact CZ-CE1 3.77Å; Y84-F95 AromaticContact CZ-CZ 3.64Å; F95-C97 HydrophobicContact CE2-CB 4.38Å
96	W	77.8	Confident	77	Confident	126 Å²	126	68.7 Å²	68.7	48%	0.477	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.9	172.4	-71.6	104.5	0	0	0	111.1	R61 T74 C76 L79 L80 L81	R61-W96 PolarHBondContact NH2-O 3.33Å; T74-W96 HydrophobicContact CG2-CH2 3.95Å; C76-W96 HydrophobicContact CB-CH2 3.89Å; C76-W96 HydrophobicContact CB-CZ3 3.75Å; L79-W96 HydrophobicContact CB-CE3 3.78Å; L79-W96 HydrophobicContact CB-CZ3 4.03Å; L80-W96 WeakPolarHBondContact O-CA 3.41Å; L81-W96 HydrophobicContact CB-CD2 4.25Å; L81-W96 HydrophobicContact CB-CE3 3.95Å; L81-W96 HydrophobicContact CB-CH2 3.96Å; L81-W96 HydrophobicContact CB-CZ2 4.23Å; L81-W96 HydrophobicContact CB-CZ3 3.81Å; L81-W96 HydrophobicContact CD1-CD2 3.89Å; L81-W96 HydrophobicContact CD1-CE3 4.42Å; L81-W96 HydrophobicContact CD1-CG 4.08Å; L81-W96 HydrophobicContact CD1-CZ2 4.29Å
97	C	74.1	Confident	77.2	Confident	11 Å²	11	69.9 Å²	69.9	7%	0.074	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.7	-176.7	-155	0	0	0	0	109.6	L79 L80 L82 F95 A102	L79-C97 CarbonylContact C-O 3.58Å; L79-C97 VanDerWaalsContact CA-O 3.24Å; L79-C97 WeakPolarHBondContact CA-O 3.34Å; L80-C97 PolarHBondContact N-O 3.49Å; L80-C97 PolarHBondContact O-N 3.04Å; L82-C97 HydrophobicContact CD1-CB 3.57Å; L82-C97 HydrophobicContact CG-CB 3.96Å; F95-C97 HydrophobicContact CE2-CB 4.38Å; C97-A102 WeakPolarHBondContact SG-CB 3.45Å
98	D	70.9	Confident	77.3	Confident	40 Å²	40	68.2 Å²	68.2	21%	0.214	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	113.8	-175.8	-178.5	-49.6	0	0	0	108.6	L79 R100 K101 A102	L79-D98 HydrophobicContact CD2-CB 3.87Å; D98-R100 PolarHBondContact O-N 2.8Å; D98-R100 VanDerWaalsContact O-N 3.08Å; D98-R100 PolarHBondContact OD1-N 2.92Å; D98-K101 HydrophobicContact CB-CB 4.19Å; D98-K101 HydrophobicContact CB-CD 4.48Å; D98-K101 PolarHBondContact O-N 3.36Å; D98-K101 IonicContact OD1-NZ 2.79Å; D98-K101 PolarHBondContact OD1-NZ 3.43Å; D98-K101 IonicContact OD2-NZ 3.2Å; D98-K101 PolarHBondContact OD2-NZ 1.89Å; D98-A102 PolarHBondContact O-N 3.22Å
99	I	72.2	Confident	77.6	Confident	4 Å²	4	67 Å²	67	2%	0.021	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-34.2	-164.6	-59.1	165.1	0	0	0	111.6	F50 Q78 L80 N154	F50-I99 HydrophobicContact CD2-CD1 3.99Å; F50-I99 HydrophobicContact CE2-CD1 3.77Å; F50-I99 HydrophobicContact CE2-CG1 4.49Å; F50-I99 HydrophobicContact CE2-CG2 4.14Å; F50-I99 HydrophobicContact CZ-CD1 4.49Å; F50-I99 HydrophobicContact CZ-CG2 4.15Å; Q78-I99 WeakPolarHBondContact O-CG1 3.2Å; Q78-I99 PolarHBondContact O-N 3.49Å; L80-I99 HydrophobicContact CD1-CD1 4.35Å; L80-I99 HydrophobicContact CD1-CG1 3.97Å; L80-I99 HydrophobicContact CD2-CD1 3.99Å; L80-I99 HydrophobicContact CD2-CG1 4.39Å; L80-I99 HydrophobicContact CG-CD1 3.92Å; L80-I99 HydrophobicContact CG-CG1 3.75Å; I99-N154 WeakPolarHBondContact CG2-OD1 3.29Å; I99-N154 PolarHBondContact O-ND2 3.14Å; I99-N154 PolarHBondContact O-OD1 3.37Å; I99-N154 VanDerWaalsContact O-OD1 3.07Å
100	R	65.3	Low	78.2	Confident	115 Å²	115	59.7 Å²	59.7	43%	0.434	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	3.4	-180	-56.3	-166.1	-152.3	99.5	2.3	115	D98 G155	D98-R100 PolarHBondContact O-N 2.8Å; D98-R100 VanDerWaalsContact O-N 3.08Å; D98-R100 PolarHBondContact OD1-N 2.92Å; R100-G155 VanDerWaalsContact CZ-O 3.28Å; R100-G155 PolarHBondContact NE-O 3.39Å; R100-G155 PolarHBondContact NH2-O 3.12Å; R100-G155 VanDerWaalsContact NH2-O 3.11Å
101	K	66.6	Low	78.6	Confident	141 Å²	141	64.6 Å²	64.6	61%	0.613	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.9	-5.9	-174.8	-62.7	-179.2	-164	68.4	0	114.4	D98	D98-K101 HydrophobicContact CB-CB 4.19Å; D98-K101 HydrophobicContact CB-CD 4.48Å; D98-K101 PolarHBondContact O-N 3.36Å; D98-K101 IonicContact OD1-NZ 2.79Å; D98-K101 PolarHBondContact OD1-NZ 3.43Å; D98-K101 IonicContact OD2-NZ 3.2Å; D98-K101 PolarHBondContact OD2-NZ 1.89Å
102	A	69.8	Low	79.2	Confident	22 Å²	22	62.7 Å²	62.7	18%	0.182	29%	0.288	C	S	.	.	S	Bend	trans	-114.3	139.8	179.1	0	0	0	0	0	109.7	C97 D98 L104	C97-A102 WeakPolarHBondContact SG-CB 3.45Å; D98-A102 PolarHBondContact O-N 3.22Å; A102-L104 VanDerWaalsContact C-N 3.34Å; A102-L104 HydrophobicContact CB-CD1 4.18Å; A102-L104 HydrophobicContact CB-CG 3.99Å; A102-L104 PolarHBondContact O-N 2.89Å
103	D	78.8	Confident	79.6	Confident	86 Å²	86	55.5 Å²	55.5	46%	0.46	27%	0.267	S	S	.	.			trans	-74.9	91.9	175	-48	-73.6	0	0	0	107.9	A59 Y67 Y105	A59-D103 HydrophobicContact CB-CB 4.33Å; A59-D103 PolarHBondContact N-O 3.31Å; Y67-D103 HydrophobicContact CE1-CB 4.37Å; D103-Y105 HydrophobicContact CB-CE2 3.87Å
104	L	86.1	Confident	80.2	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.7	-177	-66.6	165.5	0	0	0	108.3	L56 V58 L80 L82 A102 L149	L56-L104 HydrophobicContact CD1-CD2 3.57Å; L56-L104 HydrophobicContact CD2-CD2 4Å; L56-L104 HydrophobicContact CG-CD2 4.47Å; V58-L104 HydrophobicContact CB-CD2 3.8Å; V58-L104 HydrophobicContact CG2-CD2 3.48Å; V58-L104 VanDerWaalsContact CG2-CD2 3.48Å; V58-L104 HydrophobicContact CG2-CG 4.41Å; L80-L104 HydrophobicContact CD1-CD1 4.37Å; L82-L104 HydrophobicContact CD1-CD2 3.8Å; A102-L104 VanDerWaalsContact C-N 3.34Å; A102-L104 HydrophobicContact CB-CD1 4.18Å; A102-L104 HydrophobicContact CB-CG 3.99Å; A102-L104 PolarHBondContact O-N 2.89Å; L104-L149 HydrophobicContact CB-CD2 3.65Å
105	Y	85.9	Confident	80.5	Confident	43 Å²	43	65.5 Å²	65.5	17%	0.169	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	152.6	-171.3	-63.9	-63.4	0	0	0	112.2	L56 E57 Y67 D103 W109 E150	L56-Y105 WeakPolarHBondContact CB-O 3.21Å; E57-Y105 PolarHBondContact N-O 3.4Å; E57-Y105 PolarHBondContact O-N 2.62Å; Y67-Y105 HydrophobicContact CD1-CD2 4.14Å; Y67-Y105 HydrophobicContact CD1-CE2 4.46Å; Y67-Y105 AromaticContact CE1-CD2 3.72Å; Y67-Y105 HydrophobicContact CE1-CD2 3.72Å; Y67-Y105 AromaticContact CE1-CE2 3.6Å; Y67-Y105 HydrophobicContact CE1-CE2 3.6Å; D103-Y105 HydrophobicContact CB-CE2 3.87Å; Y105-W109 AromaticContact CD1-CD1 3.7Å; Y105-W109 AromaticContact CD1-CD2 3.66Å; Y105-W109 HydrophobicContact CD1-CD2 3.66Å; Y105-W109 AromaticContact CD1-CE2 3.44Å; Y105-W109 VanDerWaalsContact CD1-CE2 3.44Å; Y105-W109 HydrophobicContact CD1-CE3 4.28Å; Y105-W109 AromaticContact CD1-CG 3.85Å; Y105-W109 HydrophobicContact CD1-CG 3.85Å; Y105-W109 AromaticContact CD1-CZ2 3.96Å; Y105-W109 HydrophobicContact CD1-CZ2 3.96Å; Y105-W109 AromaticContact CD1-NE1 3.44Å; Y105-W109 AromaticContact CD2-CD2 3.76Å; Y105-W109 HydrophobicContact CD2-CD2 3.76Å; Y105-W109 AromaticContact CD2-CE3 3.51Å; Y105-W109 HydrophobicContact CD2-CE3 3.51Å; Y105-W109 HydrophobicContact CD2-CG 4.49Å; Y105-W109 AromaticContact CD2-CH2 3.94Å; Y105-W109 HydrophobicContact CD2-CH2 3.94Å; Y105-W109 HydrophobicContact CD2-CZ2 4.16Å; Y105-W109 AromaticContact CD2-CZ3 3.59Å; Y105-W109 HydrophobicContact CD2-CZ3 3.59Å; Y105-W109 HydrophobicContact CE1-CD2 4.16Å; Y105-W109 AromaticContact CE1-CE2 3.52Å; Y105-W109 HydrophobicContact CE1-CH2 4.18Å; Y105-W109 AromaticContact CE1-CZ2 3.57Å; Y105-W109 HydrophobicContact CE1-CZ2 3.57Å; Y105-W109 AromaticContact CE1-NE1 3.69Å; Y105-W109 HydrophobicContact CE2-CD2 4.23Å; Y105-W109 AromaticContact CE2-CE3 3.96Å; Y105-W109 HydrophobicContact CE2-CE3 3.96Å; Y105-W109 AromaticContact CE2-CH2 3.47Å; Y105-W109 HydrophobicContact CE2-CH2 3.47Å; Y105-W109 VanDerWaalsContact CE2-CH2 3.47Å; Y105-W109 AromaticContact CE2-CZ2 3.76Å; Y105-W109 HydrophobicContact CE2-CZ2 3.76Å; Y105-W109 AromaticContact CE2-CZ3 3.56Å; Y105-W109 HydrophobicContact CE2-CZ3 3.56Å; Y105-W109 HydrophobicContact CG-CB 4.34Å; Y105-W109 AromaticContact CG-CD2 3.44Å; Y105-W109 HydrophobicContact CG-CD2 3.44Å; Y105-W109 VanDerWaalsContact CG-CD2 3.44Å; Y105-W109 AromaticContact CG-CE2 3.73Å; Y105-W109 AromaticContact CG-CE3 3.69Å; Y105-W109 HydrophobicContact CG-CE3 3.69Å; Y105-W109 AromaticContact CG-CG 3.74Å; Y105-W109 HydrophobicContact CG-CG 3.74Å; Y105-W109 HydrophobicContact CG-CH2 4.45Å; Y105-W109 HydrophobicContact CG-CZ2 4.25Å; Y105-W109 HydrophobicContact CG-CZ3 4.18Å; Y105-W109 AromaticContact CZ-CE2 3.85Å; Y105-W109 AromaticContact CZ-CH2 3.61Å; Y105-W109 AromaticContact CZ-CZ2 3.45Å; Y105-W109 VanDerWaalsContact CZ-CZ2 3.45Å; Y105-E150 HydrophobicContact CD1-CG 4.13Å; Y105-E150 HydrophobicContact CE1-CG 4.4Å
106	P	87.8	Confident	80.8	Confident	13 Å²	13	68.5 Å²	68.5	8%	0.084	33%	0.325	C	S	.	.			trans	-66.2	156.8	175.1	30.5	-36.8	0	0	0	111	G108 W109 S143 V146 L149 E150	P106-G108 PolarHBondContact O-N 3.03Å; P106-W109 HydrophobicContact CG-CB 4.26Å; P106-W109 VanDerWaalsContact O-CB 3.28Å; P106-W109 WeakPolarHBondContact O-CB 3.37Å; P106-W109 PolarHBondContact O-N 3.47Å; P106-W109 VanDerWaalsContact O-N 3.14Å; P106-S143 WeakPolarHBondContact CA-OG 3.18Å; P106-S143 WeakPolarHBondContact CB-OG 3.3Å; P106-V146 HydrophobicContact CB-CG2 4.34Å; P106-V146 HydrophobicContact CG-CG1 4.3Å; P106-V146 HydrophobicContact CG-CG2 4.08Å; P106-L149 HydrophobicContact CB-CD1 4.41Å; P106-E150 WeakPolarHBondContact CD-OE1 3.27Å; P106-E150 WeakPolarHBondContact CG-OE1 3.27Å
107	I	89.1	Confident	81.3	Confident	49 Å²	49	65 Å²	65	25%	0.251	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	129.7	174.7	-58.2	-58.2	0	0	0	110.2	K55 E57 V69 L138 S143	K55-I107 HydrophobicContact CB-CD1 4.05Å; K55-I107 HydrophobicContact CB-CG1 4.32Å; K55-I107 WeakPolarHBondContact O-CG1 3.44Å; E57-I107 HydrophobicContact CG-CD1 4.19Å; V69-I107 HydrophobicContact CG1-CD1 4.04Å; V69-I107 HydrophobicContact CG2-CD1 4.43Å; I107-L138 HydrophobicContact CD1-CD2 3.94Å; I107-L138 HydrophobicContact CG1-CD2 4.21Å; I107-L138 HydrophobicContact CG2-CD1 3.94Å; I107-L138 HydrophobicContact CG2-CD2 3.97Å; I107-S143 PolarHBondContact N-OG 3.3Å; I107-S143 VanDerWaalsContact N-OG 3.16Å
108	G	84.4	Confident	81.8	Confident	17 Å²	17	69.1 Å²	69.1	18%	0.175	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-1.1	-176.8	0	0	0	0	0	114.6	E57 P106 Q112	E57-G108 PolarHBondContact OE1-N 3.04Å; P106-G108 PolarHBondContact O-N 3.03Å; G108-Q112 WeakPolarHBondContact O-CG 3.44Å; G108-Q112 PolarHBondContact O-N 3.47Å; G108-Q112 PolarHBondContact O-NE2 3.26Å
109	W	87.8	Confident	82.4	Confident	25 Å²	25	67.9 Å²	67.9	10%	0.095	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-40.6	178.9	-179	95.9	0	0	0	112.3	E57 Y67 Y105 P106 E111 Q112 N113 K115	E57-W109 PolarHBondContact OE2-N 2.99Å; Y67-W109 HydrophobicContact CE1-CZ3 4.29Å; Y67-W109 HydrophobicContact CE2-CZ3 4.37Å; Y105-W109 AromaticContact CD1-CD1 3.7Å; Y105-W109 AromaticContact CD1-CD2 3.66Å; Y105-W109 HydrophobicContact CD1-CD2 3.66Å; Y105-W109 AromaticContact CD1-CE2 3.44Å; Y105-W109 VanDerWaalsContact CD1-CE2 3.44Å; Y105-W109 HydrophobicContact CD1-CE3 4.28Å; Y105-W109 AromaticContact CD1-CG 3.85Å; Y105-W109 HydrophobicContact CD1-CG 3.85Å; Y105-W109 AromaticContact CD1-CZ2 3.96Å; Y105-W109 HydrophobicContact CD1-CZ2 3.96Å; Y105-W109 AromaticContact CD1-NE1 3.44Å; Y105-W109 AromaticContact CD2-CD2 3.76Å; Y105-W109 HydrophobicContact CD2-CD2 3.76Å; Y105-W109 AromaticContact CD2-CE3 3.51Å; Y105-W109 HydrophobicContact CD2-CE3 3.51Å; Y105-W109 HydrophobicContact CD2-CG 4.49Å; Y105-W109 AromaticContact CD2-CH2 3.94Å; Y105-W109 HydrophobicContact CD2-CH2 3.94Å; Y105-W109 HydrophobicContact CD2-CZ2 4.16Å; Y105-W109 AromaticContact CD2-CZ3 3.59Å; Y105-W109 HydrophobicContact CD2-CZ3 3.59Å; Y105-W109 HydrophobicContact CE1-CD2 4.16Å; Y105-W109 AromaticContact CE1-CE2 3.52Å; Y105-W109 HydrophobicContact CE1-CH2 4.18Å; Y105-W109 AromaticContact CE1-CZ2 3.57Å; Y105-W109 HydrophobicContact CE1-CZ2 3.57Å; Y105-W109 AromaticContact CE1-NE1 3.69Å; Y105-W109 HydrophobicContact CE2-CD2 4.23Å; Y105-W109 AromaticContact CE2-CE3 3.96Å; Y105-W109 HydrophobicContact CE2-CE3 3.96Å; Y105-W109 AromaticContact CE2-CH2 3.47Å; Y105-W109 HydrophobicContact CE2-CH2 3.47Å; Y105-W109 VanDerWaalsContact CE2-CH2 3.47Å; Y105-W109 AromaticContact CE2-CZ2 3.76Å; Y105-W109 HydrophobicContact CE2-CZ2 3.76Å; Y105-W109 AromaticContact CE2-CZ3 3.56Å; Y105-W109 HydrophobicContact CE2-CZ3 3.56Å; Y105-W109 HydrophobicContact CG-CB 4.34Å; Y105-W109 AromaticContact CG-CD2 3.44Å; Y105-W109 HydrophobicContact CG-CD2 3.44Å; Y105-W109 VanDerWaalsContact CG-CD2 3.44Å; Y105-W109 AromaticContact CG-CE2 3.73Å; Y105-W109 AromaticContact CG-CE3 3.69Å; Y105-W109 HydrophobicContact CG-CE3 3.69Å; Y105-W109 AromaticContact CG-CG 3.74Å; Y105-W109 HydrophobicContact CG-CG 3.74Å; Y105-W109 HydrophobicContact CG-CH2 4.45Å; Y105-W109 HydrophobicContact CG-CZ2 4.25Å; Y105-W109 HydrophobicContact CG-CZ3 4.18Å; Y105-W109 AromaticContact CZ-CE2 3.85Å; Y105-W109 AromaticContact CZ-CH2 3.61Å; Y105-W109 AromaticContact CZ-CZ2 3.45Å; Y105-W109 VanDerWaalsContact CZ-CZ2 3.45Å; P106-W109 HydrophobicContact CG-CB 4.26Å; P106-W109 VanDerWaalsContact O-CB 3.28Å; P106-W109 WeakPolarHBondContact O-CB 3.37Å; P106-W109 PolarHBondContact O-N 3.47Å; P106-W109 VanDerWaalsContact O-N 3.14Å; W109-E111 VanDerWaalsContact C-N 3.34Å; W109-E111 PolarHBondContact O-N 3.47Å; W109-Q112 PolarHBondContact O-N 3.27Å; W109-N113 HydrophobicContact CD2-CB 4.33Å; W109-N113 HydrophobicContact CE3-CB 4.37Å; W109-N113 HydrophobicContact CH2-CB 4.22Å; W109-N113 HydrophobicContact CZ2-CB 4.16Å; W109-N113 HydrophobicContact CZ3-CB 4.34Å; W109-N113 PolarHBondContact NE1-ND2 2.81Å; W109-N113 VanDerWaalsContact NE1-ND2 3.18Å; W109-N113 WeakPolarHBondContact O-CB 3.46Å; W109-N113 PolarHBondContact O-N 2.91Å; W109-N113 PolarHBondContact O-ND2 3.27Å; W109-K115 HydrophobicContact CH2-CG 4.32Å; W109-K115 HydrophobicContact CZ3-CB 4.49Å; W109-K115 HydrophobicContact CZ3-CG 3.87Å
110	C	87.4	Confident	82.9	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.007	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-40.5	177.9	-74.7	0	0	0	0	112.3	E57 Y67 N113 K114 K115 L117	E57-C110 VanDerWaalsContact OE2-CB 3.31Å; E57-C110 WeakPolarHBondContact OE2-CB 3.45Å; E57-C110 PolarHBondContact OE2-N 2.78Å; E57-C110 PolarHBondContact OE2-SG 3.02Å; Y67-C110 WeakPolarHBondContact CB-SG 3.35Å; Y67-C110 VanDerWaalsContact CG-SG 3.57Å; C110-N113 CarbonylContact O-C 3.07Å; C110-N113 PolarHBondContact O-N 2.87Å; C110-K114 WeakPolarHBondContact O-CA 3.43Å; C110-K114 PolarHBondContact O-N 3.45Å; C110-K115 HydrophobicContact CB-CB 4.01Å; C110-K115 PolarHBondContact O-N 2.65Å; C110-L117 HydrophobicContact CB-CD2 4.13Å; C110-L117 HydrophobicContact CB-CG 4.13Å
111	E	85.4	Confident	83.5	Confident	168 Å²	168	69 Å²	69	79%	0.785	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-46.3	176.3	-174.8	174.8	-158.2	0	0	111.1	W109 N113 K114	W109-E111 VanDerWaalsContact C-N 3.34Å; W109-E111 PolarHBondContact O-N 3.47Å; E111-N113 PolarHBondContact O-N 3.42Å; E111-K114 PolarHBondContact O-N 3.09Å
112	Q	86.2	Confident	83.9	Confident	151 Å²	151	64.1 Å²	64.1	71%	0.706	33%	0.329	S	S	*	.	H	α-helix	trans	-62.2	-41.7	177.3	-67.7	170.6	47.4	0	0	112.4	G108 W109	G108-Q112 WeakPolarHBondContact O-CG 3.44Å; G108-Q112 PolarHBondContact O-N 3.47Å; G108-Q112 PolarHBondContact O-NE2 3.26Å; W109-Q112 PolarHBondContact O-N 3.27Å
113	N	84.3	Confident	84.4	Confident	79 Å²	79	63 Å²	63	42%	0.422	32%	0.32	S	S	.	.	H	α-helix	trans	-91	2.7	-176.3	-70.5	-87.8	0	0	0	114	W109 C110 E111 K115	W109-N113 HydrophobicContact CD2-CB 4.33Å; W109-N113 HydrophobicContact CE3-CB 4.37Å; W109-N113 HydrophobicContact CH2-CB 4.22Å; W109-N113 HydrophobicContact CZ2-CB 4.16Å; W109-N113 HydrophobicContact CZ3-CB 4.34Å; W109-N113 PolarHBondContact NE1-ND2 2.81Å; W109-N113 VanDerWaalsContact NE1-ND2 3.18Å; W109-N113 WeakPolarHBondContact O-CB 3.46Å; W109-N113 PolarHBondContact O-N 2.91Å; W109-N113 PolarHBondContact O-ND2 3.27Å; C110-N113 CarbonylContact O-C 3.07Å; C110-N113 PolarHBondContact O-N 2.87Å; E111-N113 PolarHBondContact O-N 3.42Å; N113-K115 VanDerWaalsContact C-N 3.29Å; N113-K115 HydrophobicContact CB-CG 4.39Å; N113-K115 PolarHBondContact O-N 3.47Å
114	K	86.1	Confident	84.2	Confident	194 Å²	194	66 Å²	66	84%	0.843	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	39	-179.2	-53.7	172.1	-174.3	170.6	0	113.1	C110 E111	C110-K114 WeakPolarHBondContact O-CA 3.43Å; C110-K114 PolarHBondContact O-N 3.45Å; E111-K114 PolarHBondContact O-N 3.09Å
115	K	87.6	Confident	83.6	Confident	70 Å²	70	73.4 Å²	73.4	30%	0.304	37%	0.365	S	S	.	.			trans	-95.1	158.5	169.7	-64.2	-64.6	-166.9	178.7	0	110.3	E65 Y67 W109 C110 N113	E65-K115 IonicContact OE2-NZ 2.72Å; E65-K115 PolarHBondContact OE2-NZ 3.17Å; Y67-K115 HydrophobicContact CD2-CB 4.14Å; Y67-K115 HydrophobicContact CD2-CG 4.47Å; Y67-K115 HydrophobicContact CE2-CB 4.41Å; Y67-K115 HydrophobicContact CE2-CD 4.35Å; Y67-K115 HydrophobicContact CE2-CG 4.25Å; W109-K115 HydrophobicContact CH2-CG 4.32Å; W109-K115 HydrophobicContact CZ3-CB 4.49Å; W109-K115 HydrophobicContact CZ3-CG 3.87Å; C110-K115 HydrophobicContact CB-CB 4.01Å; C110-K115 PolarHBondContact O-N 2.65Å; N113-K115 VanDerWaalsContact C-N 3.29Å; N113-K115 HydrophobicContact CB-CG 4.39Å; N113-K115 PolarHBondContact O-N 3.47Å
116	T	83.8	Confident	83	Confident	80 Å²	80	77.1 Å²	77.1	49%	0.491	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.6	-179.9	-43.7	0	0	0	0	110.9	Y67 E118	Y67-T116 PolarHBondContact N-O 2.81Å; T116-E118 HydrophobicContact CG2-CG 3.58Å
117	L	88.2	Confident	82.6	Confident	54 Å²	54	77.8 Å²	77.8	28%	0.283	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	112.2	162.4	-68.3	174.7	0	0	0	108.9	E57 Y67 W68 C110 L134	E57-L117 HydrophobicContact CG-CD2 4.07Å; Y67-L117 CarbonylContact O-C 3.6Å; Y67-L117 VanDerWaalsContact O-CA 3.23Å; Y67-L117 WeakPolarHBondContact O-CA 3.46Å; W68-L117 HydrophobicContact CE3-CB 4.07Å; W68-L117 HydrophobicContact CZ3-CB 4.03Å; C110-L117 HydrophobicContact CB-CD2 4.13Å; C110-L117 HydrophobicContact CB-CG 4.13Å; L117-L134 HydrophobicContact CD1-CD1 4.49Å
118	E	85.1	Confident	81.9	Confident	97 Å²	97	81.8 Å²	81.8	45%	0.453	42%	0.418	S	S	.	.			trans	-122.8	130.9	176.8	-63	-158.5	-172.7	0	0	111.9	T66 Y67 T116	T66-E118 HydrophobicContact CG2-CB 4.36Å; T66-E118 HydrophobicContact CG2-CG 4.24Å; Y67-E118 PolarHBondContact O-N 2.87Å; T116-E118 HydrophobicContact CG2-CG 3.58Å
119	A	83.3	Confident	81.9	Confident	13 Å²	13	85 Å²	85	11%	0.107	43%	0.431	C	S	.	.			trans	-70	133.8	-177.9	0	0	0	0	0	111.7	W68 R124 W130	W68-A119 HydrophobicContact CD2-CB 4.27Å; W68-A119 HydrophobicContact CE3-CB 4.31Å; W68-A119 HydrophobicContact CH2-CB 3.99Å; W68-A119 HydrophobicContact CZ2-CB 3.94Å; W68-A119 HydrophobicContact CZ3-CB 4.17Å; A119-R124 HydrophobicContact CB-CG 4.1Å; A119-R124 VanDerWaalsContact O-CD 3.27Å; A119-R124 WeakPolarHBondContact O-CD 3.42Å; A119-R124 WeakPolarHBondContact O-CG 3.35Å; A119-W130 HydrophobicContact CB-CD2 4.48Å; A119-W130 HydrophobicContact CB-CE3 4Å; A119-W130 HydrophobicContact CB-CH2 3.31Å; A119-W130 HydrophobicContact CB-CZ2 3.92Å; A119-W130 HydrophobicContact CB-CZ3 3.38Å
120	P	82.6	Confident	81.6	Confident	11 Å²	11	87 Å²	87	7%	0.071	44%	0.438	C	S	.	.			trans	-57.3	147.7	173.2	-22.9	30.2	0	0	0	112.4	V60 W68 Y84 G122 I123 R124	V60-P120 HydrophobicContact CG1-CB 4.17Å; V60-P120 HydrophobicContact CG1-CG 3.98Å; W68-P120 HydrophobicContact CB-CG 4.37Å; W68-P120 HydrophobicContact CG-CG 4.39Å; Y84-P120 HydrophobicContact CD1-CG 4.02Å; Y84-P120 HydrophobicContact CD2-CG 3.85Å; Y84-P120 HydrophobicContact CE1-CG 4.25Å; Y84-P120 HydrophobicContact CE2-CG 4.1Å; Y84-P120 HydrophobicContact CG-CG 3.81Å; P120-G122 VanDerWaalsContact C-N 3.31Å; P120-G122 PolarHBondContact O-N 3.3Å; P120-G122 VanDerWaalsContact O-N 3.1Å; P120-I123 HydrophobicContact CB-CG1 4.41Å; P120-I123 HydrophobicContact CG-CD1 4.23Å; P120-I123 WeakPolarHBondContact O-CA 3.46Å; P120-I123 PolarHBondContact O-N 2.89Å; P120-R124 PolarHBondContact O-N 2.7Å
121	E	76.5	Confident	81.2	Confident	133 Å²	133	92.1 Å²	92.1	62%	0.621	47%	0.466	S	S	*	.	H	α-helix	trans	-47.6	-46.4	-172.4	-62.7	-173	138.3	0	0	114.3	I123 R124	E121-I123 PolarHBondContact O-N 2.91Å; E121-R124 PolarHBondContact O-N 2.97Å; E121-R124 VanDerWaalsContact O-N 3.08Å
122	G	75	Confident	81.2	Confident	37 Å²	37	87.6 Å²	87.6	38%	0.381	45%	0.445	S	S	.	.	H	α-helix	trans	-69.3	3.5	178.2	0	0	0	0	0	116	Y87 P120 K126	Y87-G122 WeakPolarHBondContact CE1-O 3.47Å; Y87-G122 VanDerWaalsContact OH-CA 3.28Å; Y87-G122 WeakPolarHBondContact OH-CA 3.47Å; P120-G122 VanDerWaalsContact C-N 3.31Å; P120-G122 PolarHBondContact O-N 3.3Å; P120-G122 VanDerWaalsContact O-N 3.1Å; G122-K126 WeakPolarHBondContact O-CE 3.34Å; G122-K126 PolarHBondContact O-NZ 3.31Å
123	I	80.2	Confident	81.3	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-113.4	-28.4	167.8	-34.4	-173.5	0	0	0	111.6	D85 Y87 P120 E121 D125 K126 V127 W130	D85-I123 VanDerWaalsContact O-CD1 3.28Å; D85-I123 WeakPolarHBondContact O-CD1 3.44Å; Y87-I123 HydrophobicContact CD2-CD1 3.51Å; Y87-I123 HydrophobicContact CD2-CG1 3.69Å; Y87-I123 HydrophobicContact CE1-CG1 4.35Å; Y87-I123 HydrophobicContact CE2-CD1 3.42Å; Y87-I123 VanDerWaalsContact CE2-CD1 3.42Å; Y87-I123 HydrophobicContact CE2-CG1 3.27Å; Y87-I123 HydrophobicContact CG-CD1 4.47Å; Y87-I123 HydrophobicContact CG-CG1 4.4Å; P120-I123 HydrophobicContact CB-CG1 4.41Å; P120-I123 HydrophobicContact CG-CD1 4.23Å; P120-I123 WeakPolarHBondContact O-CA 3.46Å; P120-I123 PolarHBondContact O-N 2.89Å; E121-I123 PolarHBondContact O-N 2.91Å; I123-D125 PolarHBondContact O-N 3.41Å; I123-K126 WeakPolarHBondContact O-CB 3.45Å; I123-K126 PolarHBondContact O-N 3.04Å; I123-V127 HydrophobicContact CG2-CG2 4.45Å; I123-W130 HydrophobicContact CB-CH2 4.13Å; I123-W130 HydrophobicContact CG2-CH2 3.77Å; I123-W130 HydrophobicContact CG2-CZ3 4.05Å; I123-W130 WeakPolarHBondContact O-CH2 3.42Å
124	R	74.9	Confident	81.4	Confident	147 Å²	147	80.1 Å²	80.1	56%	0.555	41%	0.407	S	S	*	.	H	α-helix	trans	-52.6	-33.4	-172.2	-70.1	178.2	74.4	-155.6	4.9	114.3	A119 P120 E121	A119-R124 HydrophobicContact CB-CG 4.1Å; A119-R124 VanDerWaalsContact O-CD 3.27Å; A119-R124 WeakPolarHBondContact O-CD 3.42Å; A119-R124 WeakPolarHBondContact O-CG 3.35Å; P120-R124 PolarHBondContact O-N 2.7Å; E121-R124 PolarHBondContact O-N 2.97Å; E121-R124 VanDerWaalsContact O-N 3.08Å
125	D	73.3	Confident	81.3	Confident	160 Å²	160	77 Å²	77	86%	0.856	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.1	179.8	-56.8	-36.5	0	0	0	114.3	I123	I123-D125 PolarHBondContact O-N 3.41Å
126	K	74.5	Confident	81.2	Confident	121 Å²	121	80 Å²	80	53%	0.526	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-22.1	-173.5	-63.7	178.6	-179.9	155.8	0	114.8	G122 I123	G122-K126 WeakPolarHBondContact O-CE 3.34Å; G122-K126 PolarHBondContact O-NZ 3.31Å; I123-K126 WeakPolarHBondContact O-CB 3.45Å; I123-K126 PolarHBondContact O-N 3.04Å
127	V	78.6	Confident	81.2	Confident	27 Å²	27	77.5 Å²	77.5	16%	0.164	39%	0.39	C	S	.	.			trans	-124.8	127.4	-175.6	179.2	0	0	0	0	109.1	I123 D129 W130 F133	I123-V127 HydrophobicContact CG2-CG2 4.45Å; V127-D129 VanDerWaalsContact CG1-O 3.27Å; V127-D129 WeakPolarHBondContact CG1-O 3.19Å; V127-W130 HydrophobicContact CB-CD2 4.12Å; V127-W130 HydrophobicContact CB-CE3 3.98Å; V127-W130 HydrophobicContact CB-CH2 3.61Å; V127-W130 HydrophobicContact CB-CZ2 3.68Å; V127-W130 HydrophobicContact CB-CZ3 3.74Å; V127-W130 HydrophobicContact CG1-CD2 3.98Å; V127-W130 HydrophobicContact CG1-CE3 3.92Å; V127-W130 HydrophobicContact CG1-CH2 4.45Å; V127-W130 HydrophobicContact CG1-CZ2 4.44Å; V127-W130 HydrophobicContact CG1-CZ3 4.18Å; V127-W130 HydrophobicContact CG2-CH2 4Å; V127-W130 HydrophobicContact CG2-CZ3 3.97Å; V127-W130 WeakPolarHBondContact O-CZ2 3.2Å; V127-W130 PolarHBondContact O-NE1 2.82Å; V127-F133 HydrophobicContact CG1-CB 3.67Å; V127-F133 HydrophobicContact CG1-CD2 4.43Å; V127-F133 HydrophobicContact CG1-CG 3.97Å; V127-F133 HydrophobicContact CG2-CD2 4.33Å; V127-F133 HydrophobicContact CG2-CG 4.4Å
128	S	74.8	Confident	81.1	Confident	132 Å²	132	77.2 Å²	77.2	92%	0.923	39%	0.388	S	S	*	.	S	Bend	trans	-95.9	-22	-176.6	54.9	0	0	0	0	114.3
129	D	83.7	Confident	81.1	Confident	84 Å²	84	79 Å²	79	45%	0.449	40%	0.399	S	S	.	.			trans	-130.9	108.1	174.6	-173.2	-32.1	0	0	0	108.1	V127 D131 E132 F133	V127-D129 VanDerWaalsContact CG1-O 3.27Å; V127-D129 WeakPolarHBondContact CG1-O 3.19Å; D129-D131 PolarHBondContact OD1-N 2.61Å; D129-E132 HydrophobicContact CB-CB 4.39Å; D129-E132 WeakPolarHBondContact OD1-CB 3.49Å; D129-E132 PolarHBondContact OD1-N 2.85Å; D129-F133 VanDerWaalsContact O-CB 3.26Å; D129-F133 WeakPolarHBondContact O-CB 3.31Å; D129-F133 PolarHBondContact O-N 2.88Å
130	W	81.1	Confident	80.6	Confident	68 Å²	68	82.1 Å²	82.1	26%	0.258	43%	0.433	S	S	.	.	H	α-helix	trans	-83.3	-32.6	-174.7	-65.6	96.3	0	0	0	112.8	W68 A119 I123 V127 F133 L134	W68-W130 HydrophobicContact CH2-CD2 4.42Å; W68-W130 AromaticContact CH2-CE3 3.51Å; W68-W130 HydrophobicContact CH2-CE3 3.51Å; W68-W130 AromaticContact CH2-CZ3 3.92Å; W68-W130 HydrophobicContact CH2-CZ3 3.92Å; W68-W130 AromaticContact CZ2-CE3 3.64Å; W68-W130 HydrophobicContact CZ2-CE3 3.64Å; W68-W130 AromaticContact CZ2-CZ3 3.6Å; W68-W130 HydrophobicContact CZ2-CZ3 3.6Å; A119-W130 HydrophobicContact CB-CD2 4.48Å; A119-W130 HydrophobicContact CB-CE3 4Å; A119-W130 HydrophobicContact CB-CH2 3.31Å; A119-W130 HydrophobicContact CB-CZ2 3.92Å; A119-W130 HydrophobicContact CB-CZ3 3.38Å; I123-W130 HydrophobicContact CB-CH2 4.13Å; I123-W130 HydrophobicContact CG2-CH2 3.77Å; I123-W130 HydrophobicContact CG2-CZ3 4.05Å; I123-W130 WeakPolarHBondContact O-CH2 3.42Å; V127-W130 HydrophobicContact CB-CD2 4.12Å; V127-W130 HydrophobicContact CB-CE3 3.98Å; V127-W130 HydrophobicContact CB-CH2 3.61Å; V127-W130 HydrophobicContact CB-CZ2 3.68Å; V127-W130 HydrophobicContact CB-CZ3 3.74Å; V127-W130 HydrophobicContact CG1-CD2 3.98Å; V127-W130 HydrophobicContact CG1-CE3 3.92Å; V127-W130 HydrophobicContact CG1-CH2 4.45Å; V127-W130 HydrophobicContact CG1-CZ2 4.44Å; V127-W130 HydrophobicContact CG1-CZ3 4.18Å; V127-W130 HydrophobicContact CG2-CH2 4Å; V127-W130 HydrophobicContact CG2-CZ3 3.97Å; V127-W130 WeakPolarHBondContact O-CZ2 3.2Å; V127-W130 PolarHBondContact O-NE1 2.82Å; W130-F133 HydrophobicContact CE3-CD1 4.38Å; W130-L134 VanDerWaalsContact O-CB 3.32Å; W130-L134 WeakPolarHBondContact O-CB 3.32Å; W130-L134 VanDerWaalsContact O-CG 3.27Å; W130-L134 WeakPolarHBondContact O-CG 3.44Å; W130-L134 PolarHBondContact O-N 2.99Å
131	D	80.6	Confident	80.6	Confident	108 Å²	108	83.3 Å²	83.3	58%	0.578	44%	0.444	S	S	*	.	H	α-helix	trans	-67.3	-45.1	179	-73.2	-18.7	0	0	0	110.1	D129 L134 R135	D129-D131 PolarHBondContact OD1-N 2.61Å; D131-L134 PolarHBondContact O-N 2.94Å; D131-R135 VanDerWaalsContact O-CG 3.3Å; D131-R135 WeakPolarHBondContact O-CG 3.46Å; D131-R135 PolarHBondContact O-N 3.48Å
132	E	85.1	Confident	80.8	Confident	74 Å²	74	81 Å²	81	35%	0.346	44%	0.441	S	S	.	.	H	α-helix	trans	-72.1	-36.6	178.5	-171	56.2	-158.9	0	0	112.1	D129 R135 Q136	D129-E132 HydrophobicContact CB-CB 4.39Å; D129-E132 WeakPolarHBondContact OD1-CB 3.49Å; D129-E132 PolarHBondContact OD1-N 2.85Å; E132-R135 PolarHBondContact O-N 3.37Å; E132-R135 IonicContact OE2-CZ 3.44Å; E132-R135 IonicContact OE2-NH1 3.17Å; E132-R135 PolarHBondContact OE2-NH1 2.94Å; E132-Q136 WeakPolarHBondContact O-CG 3.11Å; E132-Q136 PolarHBondContact O-N 2.83Å; E132-Q136 PolarHBondContact OE1-NE2 3.4Å
133	F	87.5	Confident	81.3	Confident	48 Å²	48	81.1 Å²	81.1	21%	0.211	44%	0.436	C	S	.	.	H	α-helix	trans	-59.9	-47	171.3	173.5	-99.4	0	0	0	112	W68 D85 V127 D129 W130 Q136 T137	W68-F133 HydrophobicContact CZ2-CE1 4.39Å; D85-F133 HydrophobicContact CB-CE1 4.45Å; D85-F133 HydrophobicContact CB-CZ 4.39Å; V127-F133 HydrophobicContact CG1-CB 3.67Å; V127-F133 HydrophobicContact CG1-CD2 4.43Å; V127-F133 HydrophobicContact CG1-CG 3.97Å; V127-F133 HydrophobicContact CG2-CD2 4.33Å; V127-F133 HydrophobicContact CG2-CG 4.4Å; D129-F133 VanDerWaalsContact O-CB 3.26Å; D129-F133 WeakPolarHBondContact O-CB 3.31Å; D129-F133 PolarHBondContact O-N 2.88Å; W130-F133 HydrophobicContact CE3-CD1 4.38Å; F133-Q136 PolarHBondContact O-N 3.12Å; F133-T137 WeakPolarHBondContact CZ-OG1 3.44Å; F133-T137 WeakPolarHBondContact O-CB 3.41Å; F133-T137 PolarHBondContact O-N 2.94Å; F133-T137 PolarHBondContact O-OG1 3.2Å
134	L	86.6	Confident	81.2	Confident	24 Å²	24	81.2 Å²	81.2	13%	0.126	44%	0.437	C	S	.	.	H	α-helix	trans	-66.9	-40	178.6	-73.9	173.2	0	0	0	111.7	W68 V69 L117 W130 D131 T137 L138	W68-L134 HydrophobicContact CH2-CD1 3.9Å; W68-L134 HydrophobicContact CH2-CD2 3.98Å; W68-L134 HydrophobicContact CH2-CG 4.11Å; W68-L134 HydrophobicContact CZ2-CD2 4.05Å; W68-L134 HydrophobicContact CZ3-CD1 4.2Å; V69-L134 HydrophobicContact CB-CD2 4.47Å; V69-L134 HydrophobicContact CG2-CD2 3.85Å; L117-L134 HydrophobicContact CD1-CD1 4.49Å; W130-L134 VanDerWaalsContact O-CB 3.32Å; W130-L134 WeakPolarHBondContact O-CB 3.32Å; W130-L134 VanDerWaalsContact O-CG 3.27Å; W130-L134 WeakPolarHBondContact O-CG 3.44Å; W130-L134 PolarHBondContact O-N 2.99Å; D131-L134 PolarHBondContact O-N 2.94Å; L134-T137 PolarHBondContact O-N 2.94Å; L134-L138 VanDerWaalsContact O-CB 3.29Å; L134-L138 WeakPolarHBondContact O-CB 3.27Å; L134-L138 VanDerWaalsContact O-CG 3.27Å; L134-L138 WeakPolarHBondContact O-CG 3.4Å; L134-L138 PolarHBondContact O-N 3.49Å
135	R	84.9	Confident	81	Confident	129 Å²	129	76.2 Å²	76.2	49%	0.487	42%	0.424	S	S	.	.	H	α-helix	trans	-56.2	-55.2	172	-74.9	178	-152.1	114	9.5	111.4	D131 E132 T137 L138 I139	D131-R135 VanDerWaalsContact O-CG 3.3Å; D131-R135 WeakPolarHBondContact O-CG 3.46Å; D131-R135 PolarHBondContact O-N 3.48Å; E132-R135 PolarHBondContact O-N 3.37Å; E132-R135 IonicContact OE2-CZ 3.44Å; E132-R135 IonicContact OE2-NH1 3.17Å; E132-R135 PolarHBondContact OE2-NH1 2.94Å; R135-T137 PolarHBondContact O-N 3.31Å; R135-L138 PolarHBondContact O-N 3.2Å; R135-I139 WeakPolarHBondContact O-CB 3.09Å; R135-I139 WeakPolarHBondContact O-CD1 3.36Å; R135-I139 WeakPolarHBondContact O-CG1 3.45Å; R135-I139 PolarHBondContact O-N 3.25Å
136	Q	84.7	Confident	80.8	Confident	133 Å²	133	72 Å²	72	62%	0.621	40%	0.403	S	S	*	.	H	α-helix	trans	-63.7	-30.2	-178.3	-67.9	-178.8	19.3	0	0	112.6	E132 F133	E132-Q136 WeakPolarHBondContact O-CG 3.11Å; E132-Q136 PolarHBondContact O-N 2.83Å; E132-Q136 PolarHBondContact OE1-NE2 3.4Å; F133-Q136 PolarHBondContact O-N 3.12Å
137	T	84.4	Confident	80.3	Confident	27 Å²	27	68.3 Å²	68.3	17%	0.166	39%	0.392	C	S	.	.	H	α-helix	trans	-78.2	-31.8	178.2	-59.5	0	0	0	0	113.2	K55 D85 F133 L134 R135	K55-T137 HydrophobicContact CD-CG2 4.13Å; K55-T137 WeakPolarHBondContact CE-O 3.46Å; D85-T137 HydrophobicContact CB-CG2 4.12Å; D85-T137 WeakPolarHBondContact OD2-CG2 3.27Å; F133-T137 WeakPolarHBondContact CZ-OG1 3.44Å; F133-T137 WeakPolarHBondContact O-CB 3.41Å; F133-T137 PolarHBondContact O-N 2.94Å; F133-T137 PolarHBondContact O-OG1 3.2Å; L134-T137 PolarHBondContact O-N 2.94Å; R135-T137 PolarHBondContact O-N 3.31Å
138	L	86.3	Confident	79.7	Confident	48 Å²	48	67.3 Å²	67.3	25%	0.251	39%	0.385	S	S	.	.	H	α-helix	trans	-96.9	-16.7	-176.6	-63.3	177.2	0	0	0	113.9	K55 V69 I107 L134 R135 G140 A141	K55-L138 HydrophobicContact CD-CD2 4.08Å; V69-L138 HydrophobicContact CG1-CD2 4.02Å; V69-L138 HydrophobicContact CG2-CD2 4.48Å; I107-L138 HydrophobicContact CD1-CD2 3.94Å; I107-L138 HydrophobicContact CG1-CD2 4.21Å; I107-L138 HydrophobicContact CG2-CD1 3.94Å; I107-L138 HydrophobicContact CG2-CD2 3.97Å; L134-L138 VanDerWaalsContact O-CB 3.29Å; L134-L138 WeakPolarHBondContact O-CB 3.27Å; L134-L138 VanDerWaalsContact O-CG 3.27Å; L134-L138 WeakPolarHBondContact O-CG 3.4Å; L134-L138 PolarHBondContact O-N 3.49Å; R135-L138 PolarHBondContact O-N 3.2Å; L138-G140 PolarHBondContact O-N 3.06Å; L138-G140 VanDerWaalsContact O-N 3.12Å; L138-A141 WeakPolarHBondContact O-CB 3.45Å; L138-A141 PolarHBondContact O-N 3.29Å
139	I	83.9	Confident	79.5	Confident	135 Å²	135	61.2 Å²	61.2	69%	0.692	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	116.3	172.1	-78.3	161.6	0	0	0	109.9	R135 A141	R135-I139 WeakPolarHBondContact O-CB 3.09Å; R135-I139 WeakPolarHBondContact O-CD1 3.36Å; R135-I139 WeakPolarHBondContact O-CG1 3.45Å; R135-I139 PolarHBondContact O-N 3.25Å; I139-A141 VanDerWaalsContact C-N 3.26Å; I139-A141 PolarHBondContact O-N 3.42Å
140	G	74.3	Confident	78.5	Confident	79 Å²	79	60.2 Å²	60.2	81%	0.814	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	5.6	-179	0	0	0	0	0	115.3	L138	L138-G140 PolarHBondContact O-N 3.06Å; L138-G140 VanDerWaalsContact O-N 3.12Å
141	A	80.9	Confident	77.3	Confident	36 Å²	36	60.1 Å²	60.1	30%	0.298	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-75	137.8	179.7	0	0	0	0	0	112.7	K55 L138 I139	K55-A141 HydrophobicContact CD-CB 3.71Å; K55-A141 HydrophobicContact CG-CB 4.23Å; L138-A141 WeakPolarHBondContact O-CB 3.45Å; L138-A141 PolarHBondContact O-N 3.29Å; I139-A141 VanDerWaalsContact C-N 3.26Å; I139-A141 PolarHBondContact O-N 3.42Å
142	C	82.4	Confident	75.7	Confident	83 Å²	83	62.5 Å²	62.5	56%	0.561	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-88.8	117.8	173.1	-59.3	0	0	0	0	110.9	M54 K55	M54-C142 CarbonylContact C-O 3.58Å; M54-C142 WeakPolarHBondContact CA-O 3.47Å; M54-C142 WeakPolarHBondContact CB-O 3.29Å; M54-C142 HydrophobicContact CG-CB 4.36Å; K55-C142 PolarHBondContact N-O 2.83Å
143	S	83.9	Confident	74.2	Confident	40 Å²	40	61.7 Å²	61.7	28%	0.28	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-79.8	145.9	165.6	-176.6	0	0	0	0	110.6	K55 P106 I107	K55-S143 WeakPolarHBondContact O-CA 3.15Å; P106-S143 WeakPolarHBondContact CA-OG 3.18Å; P106-S143 WeakPolarHBondContact CB-OG 3.3Å; I107-S143 PolarHBondContact N-OG 3.3Å; I107-S143 VanDerWaalsContact N-OG 3.16Å
144	P	78.9	Confident	72.8	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.013	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-58.6	145.3	163.7	-18.9	30.4	0	0	0	110.9	F50 M54 K55 L56 I72 L149	F50-P144 HydrophobicContact CD1-CB 3.73Å; F50-P144 HydrophobicContact CD1-CG 3.78Å; F50-P144 HydrophobicContact CE1-CB 3.54Å; F50-P144 HydrophobicContact CE1-CG 3.79Å; M54-P144 HydrophobicContact CB-CG 4.22Å; M54-P144 HydrophobicContact SD-CB 4.21Å; M54-P144 HydrophobicContact SD-CG 4.02Å; K55-P144 WeakPolarHBondContact O-CD 3.37Å; L56-P144 HydrophobicContact CB-CG 4.32Å; L56-P144 HydrophobicContact CD2-CG 4.31Å; I72-P144 HydrophobicContact CD1-CG 4.33Å; P144-L149 HydrophobicContact CB-CD1 4.01Å; P144-L149 HydrophobicContact CB-CG 4.4Å; P144-L149 HydrophobicContact CG-CD1 4.31Å
145	P	70.6	Confident	71.1	Confident	43 Å²	43	60.6 Å²	60.6	28%	0.279	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-56.4	134.5	172.9	-28	34.2	0	0	0	113.4	P147 L148 Y262	P145-P147 VanDerWaalsContact C-CD 3.42Å; P145-P147 VanDerWaalsContact C-N 3.32Å; P145-P147 VanDerWaalsContact O-N 3.15Å; P145-L148 HydrophobicContact CG-CD1 4.39Å; P145-L148 WeakPolarHBondContact O-CB 3.24Å; P145-L148 PolarHBondContact O-N 3.24Å; P145-Y262 HydrophobicContact CB-CD1 3.57Å; P145-Y262 HydrophobicContact CB-CE1 3.76Å; P145-Y262 HydrophobicContact CB-CG 4.1Å; P145-Y262 HydrophobicContact CG-CD1 3.96Å; P145-Y262 HydrophobicContact CG-CD2 4.44Å; P145-Y262 HydrophobicContact CG-CE1 4.47Å; P145-Y262 HydrophobicContact CG-CG 3.96Å
146	V	69.3	Low	69.7	Low	71 Å²	71	59.7 Å²	59.7	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-45.7	-45.3	179.6	-165.8	0	0	0	0	113.5	P106 L148 L149 E150	P106-V146 HydrophobicContact CB-CG2 4.34Å; P106-V146 HydrophobicContact CG-CG1 4.3Å; P106-V146 HydrophobicContact CG-CG2 4.08Å; V146-L148 PolarHBondContact O-N 2.87Å; V146-L148 VanDerWaalsContact O-N 3.12Å; V146-L149 PolarHBondContact O-N 3.33Å; V146-E150 HydrophobicContact CG1-CB 4.16Å; V146-E150 HydrophobicContact CG1-CG 4.13Å; V146-E150 WeakPolarHBondContact CG1-OE1 3.37Å; V146-E150 PolarHBondContact O-N 3.27Å
147	P	64	Low	68.5	Low	44 Å²	44	54.6 Å²	54.6	29%	0.286	33%	0.333	S	S	.	.	H	α-helix	trans	-73.1	-2.4	-176.9	-16.4	32.5	0	0	0	115.8	P145 P260 Y262	P145-P147 VanDerWaalsContact C-CD 3.42Å; P145-P147 VanDerWaalsContact C-N 3.32Å; P145-P147 VanDerWaalsContact O-N 3.15Å; P147-P260 HydrophobicContact CB-CG 4.17Å; P147-P260 HydrophobicContact CG-CG 4.24Å; P147-Y262 HydrophobicContact CB-CE1 4.05Å; P147-Y262 HydrophobicContact CG-CE1 4.04Å
148	L	65.5	Low	67.5	Low	5 Å²	5	54 Å²	54	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-85.6	-23.1	167.5	-68	177.3	0	0	0	112.4	F50 P145 V146 N154 G155 Y262	F50-L148 HydrophobicContact CD2-CD1 4.4Å; F50-L148 HydrophobicContact CE1-CB 4.4Å; F50-L148 HydrophobicContact CE2-CB 3.98Å; F50-L148 HydrophobicContact CE2-CD1 4.23Å; F50-L148 HydrophobicContact CZ-CB 3.7Å; F50-L148 HydrophobicContact CZ-CD1 4.34Å; P145-L148 HydrophobicContact CG-CD1 4.39Å; P145-L148 WeakPolarHBondContact O-CB 3.24Å; P145-L148 PolarHBondContact O-N 3.24Å; V146-L148 PolarHBondContact O-N 2.87Å; V146-L148 VanDerWaalsContact O-N 3.12Å; L148-N154 PolarHBondContact O-OD1 3.47Å; L148-G155 PolarHBondContact O-N 3.41Å; L148-Y262 HydrophobicContact CD1-CE2 4.33Å; L148-Y262 HydrophobicContact CD2-CE2 3.76Å; L148-Y262 VanDerWaalsContact CD2-OH 3.29Å; L148-Y262 WeakPolarHBondContact CD2-OH 3.35Å; L148-Y262 HydrophobicContact CG-CE2 3.95Å
149	L	70.7	Confident	66.7	Low	4 Å²	4	51.9 Å²	51.9	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-105.4	-37.2	-172.2	-69.4	177.3	0	0	0	112.3	F50 L104 P106 P144 V146 N154	F50-L149 HydrophobicContact CE1-CD2 3.71Å; F50-L149 HydrophobicContact CE1-CG 4.23Å; F50-L149 HydrophobicContact CZ-CD2 3.74Å; F50-L149 HydrophobicContact CZ-CG 4.29Å; L104-L149 HydrophobicContact CB-CD2 3.65Å; P106-L149 HydrophobicContact CB-CD1 4.41Å; P144-L149 HydrophobicContact CB-CD1 4.01Å; P144-L149 HydrophobicContact CB-CG 4.4Å; P144-L149 HydrophobicContact CG-CD1 4.31Å; V146-L149 PolarHBondContact O-N 3.33Å; L149-N154 WeakPolarHBondContact O-CB 3.5Å; L149-N154 PolarHBondContact O-ND2 3.13Å; L149-N154 VanDerWaalsContact O-ND2 3.16Å
150	E	63.4	Low	66.1	Low	63 Å²	63	49.5 Å²	49.5	29%	0.294	31%	0.307	S	S	.	.	S	Bend	trans	-112.5	156	-170.6	-65.3	-176.8	-135.9	0	0	114	Y105 P106 V146	Y105-E150 HydrophobicContact CD1-CG 4.13Å; Y105-E150 HydrophobicContact CE1-CG 4.4Å; P106-E150 WeakPolarHBondContact CD-OE1 3.27Å; P106-E150 WeakPolarHBondContact CG-OE1 3.27Å; V146-E150 HydrophobicContact CG1-CB 4.16Å; V146-E150 HydrophobicContact CG1-CG 4.13Å; V146-E150 WeakPolarHBondContact CG1-OE1 3.37Å; V146-E150 PolarHBondContact O-N 3.27Å
151	G	56.3	Low	66.1	Low	66 Å²	66	46.3 Å²	46.3	68%	0.68	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	72.5	-166.1	173.1	0	0	0	0	0	115.9	R153 N154	G151-R153 PolarHBondContact O-N 2.82Å; G151-N154 PolarHBondContact O-N 3.12Å
152	L	46.8	Very low	66.4	Low	159 Å²	159	44.7 Å²	44.7	83%	0.832	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-61.5	-7.2	-179.2	-78.7	146.2	0	0	0	114.6	R156	L152-R156 PolarHBondContact O-NE 3.22Å; L152-R156 PolarHBondContact O-NH2 3.45Å
153	R	53.2	Low	66.6	Low	56 Å²	56	42.8 Å²	42.8	21%	0.211	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-102.1	-12	-175	-57.9	-173.9	-164.6	-152.7	-1.4	112.9	G151 G155 R156 L161 E257	G151-R153 PolarHBondContact O-N 2.82Å; R153-G155 PolarHBondContact O-N 2.96Å; R153-R156 WeakPolarHBondContact O-CB 3.27Å; R153-R156 WeakPolarHBondContact O-CG 3.5Å; R153-R156 PolarHBondContact O-N 3.24Å; R153-L161 HydrophobicContact CB-CD2 3.73Å; R153-L161 HydrophobicContact CG-CD2 4.01Å; R153-E257 IonicContact CZ-OE2 3.53Å; R153-E257 IonicContact NE-OE2 2.85Å; R153-E257 VanDerWaalsContact NH2-CB 3.33Å; R153-E257 IonicContact NH2-OE2 2.7Å; R153-E257 PolarHBondContact NH2-OE2 2.96Å
154	N	57	Low	66.8	Low	43 Å²	43	45.2 Å²	45.2	23%	0.23	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	126.7	-178.4	179.9	3.5	0	0	0	113.4	I99 L148 L149 G151 R156	I99-N154 WeakPolarHBondContact CG2-OD1 3.29Å; I99-N154 PolarHBondContact O-ND2 3.14Å; I99-N154 PolarHBondContact O-OD1 3.37Å; I99-N154 VanDerWaalsContact O-OD1 3.07Å; L148-N154 PolarHBondContact O-OD1 3.47Å; L149-N154 WeakPolarHBondContact O-CB 3.5Å; L149-N154 PolarHBondContact O-ND2 3.13Å; L149-N154 VanDerWaalsContact O-ND2 3.16Å; G151-N154 PolarHBondContact O-N 3.12Å; N154-R156 PolarHBondContact O-N 3.45Å; N154-R156 VanDerWaalsContact O-N 3.1Å
155	G	50.8	Low	67.3	Low	7 Å²	7	46.8 Å²	46.8	7%	0.072	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	18.4	171.9	0	0	0	0	0	115.4	R100 L148 R153	R100-G155 VanDerWaalsContact CZ-O 3.28Å; R100-G155 PolarHBondContact NE-O 3.39Å; R100-G155 PolarHBondContact NH2-O 3.12Å; R100-G155 VanDerWaalsContact NH2-O 3.11Å; L148-G155 PolarHBondContact O-N 3.41Å; R153-G155 PolarHBondContact O-N 2.96Å
156	R	56.5	Low	68.3	Low	109 Å²	109	45.8 Å²	45.8	41%	0.411	27%	0.273	S	S	.	.			trans	-72.7	154.5	161.5	-71.2	-172	-171.1	-136.8	6.7	109.9	L152 R153 N154 D160 L161	L152-R156 PolarHBondContact O-NE 3.22Å; L152-R156 PolarHBondContact O-NH2 3.45Å; R153-R156 WeakPolarHBondContact O-CB 3.27Å; R153-R156 WeakPolarHBondContact O-CG 3.5Å; R153-R156 PolarHBondContact O-N 3.24Å; N154-R156 PolarHBondContact O-N 3.45Å; N154-R156 VanDerWaalsContact O-N 3.1Å; R156-D160 HydrophobicContact CB-CB 4.03Å; R156-D160 HydrophobicContact CG-CB 4.46Å; R156-L161 HydrophobicContact CB-CD2 3.77Å; R156-L161 HydrophobicContact CG-CD2 4.28Å
157	N	59.6	Low	69.4	Low	27 Å²	27	44 Å²	44	14%	0.144	26%	0.259	C	S	.	.			trans	-66.6	146.8	164.3	177.4	-88	0	0	0	108.1	R45 N48 L159 D160	R45-N157 PolarHBondContact O-ND2 3.44Å; N48-N157 PolarHBondContact OD1-ND2 3.15Å; N157-L159 PolarHBondContact O-N 2.84Å; N157-L159 VanDerWaalsContact OD1-CB 3.26Å; N157-L159 WeakPolarHBondContact OD1-CB 3.39Å; N157-L159 WeakPolarHBondContact OD1-CG 3.34Å; N157-L159 PolarHBondContact OD1-N 3.4Å; N157-D160 WeakPolarHBondContact CB-OD2 3.45Å; N157-D160 PolarHBondContact N-OD2 3.33Å; N157-D160 WeakPolarHBondContact O-CB 3.5Å; N157-D160 PolarHBondContact O-N 3.19Å
158	P	63.2	Low	70.9	Confident	13 Å²	13	42 Å²	42	8%	0.084	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-47.3	-34.4	175.6	-34	38.7	0	0	0	114.6	L161 L263	P158-L161 WeakPolarHBondContact O-CB 3.46Å; P158-L161 PolarHBondContact O-N 2.89Å; P158-L263 HydrophobicContact CB-CD2 3.6Å; P158-L263 WeakPolarHBondContact O-CD2 3.11Å
159	L	69.9	Low	72.3	Confident	5 Å²	5	42 Å²	42	3%	0.026	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-72.9	-30.9	176.5	-62.5	176.5	0	0	0	113.9	R45 N157 L161 I162 N187 Y211	R45-L159 HydrophobicContact CB-CD1 4.46Å; R45-L159 HydrophobicContact CG-CD1 3.65Å; N157-L159 PolarHBondContact O-N 2.84Å; N157-L159 VanDerWaalsContact OD1-CB 3.26Å; N157-L159 WeakPolarHBondContact OD1-CB 3.39Å; N157-L159 WeakPolarHBondContact OD1-CG 3.34Å; N157-L159 PolarHBondContact OD1-N 3.4Å; L159-L161 PolarHBondContact O-N 2.99Å; L159-L161 VanDerWaalsContact O-N 3.12Å; L159-I162 HydrophobicContact CD2-CD1 4.35Å; L159-I162 PolarHBondContact O-N 3.2Å; L159-N187 PolarHBondContact O-ND2 3.13Å; L159-Y211 HydrophobicContact CD2-CD1 3.55Å; L159-Y211 HydrophobicContact CD2-CD2 4Å; L159-Y211 HydrophobicContact CD2-CE1 3.61Å; L159-Y211 HydrophobicContact CD2-CE2 4.06Å; L159-Y211 HydrophobicContact CD2-CG 3.74Å
160	D	70.4	Confident	73.4	Confident	84 Å²	84	41.9 Å²	41.9	45%	0.449	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-68.7	-6.3	175.7	-50.7	-33.6	0	0	0	112.1	R156 N157	R156-D160 HydrophobicContact CB-CB 4.03Å; R156-D160 HydrophobicContact CG-CB 4.46Å; N157-D160 WeakPolarHBondContact CB-OD2 3.45Å; N157-D160 PolarHBondContact N-OD2 3.33Å; N157-D160 WeakPolarHBondContact O-CB 3.5Å; N157-D160 PolarHBondContact O-N 3.19Å
161	L	75.9	Confident	74.8	Confident	13 Å²	13	38.9 Å²	38.9	7%	0.068	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-83.8	-30.1	169.8	-52.5	-166.8	0	0	0	111.7	R153 R156 P158 L159 A163 L259 Y262 L263	R153-L161 HydrophobicContact CB-CD2 3.73Å; R153-L161 HydrophobicContact CG-CD2 4.01Å; R156-L161 HydrophobicContact CB-CD2 3.77Å; R156-L161 HydrophobicContact CG-CD2 4.28Å; P158-L161 WeakPolarHBondContact O-CB 3.46Å; P158-L161 PolarHBondContact O-N 2.89Å; L159-L161 PolarHBondContact O-N 2.99Å; L159-L161 VanDerWaalsContact O-N 3.12Å; L161-A163 VanDerWaalsContact C-N 3.26Å; L161-A163 PolarHBondContact O-N 3.45Å; L161-L259 VanDerWaalsContact O-CD2 3.29Å; L161-L259 WeakPolarHBondContact O-CD2 3.48Å; L161-Y262 WeakPolarHBondContact CD1-OH 3.38Å; L161-L263 HydrophobicContact CB-CD1 4.32Å; L161-L263 HydrophobicContact CD1-CD2 4.27Å
162	I	86.3	Confident	76.4	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	20%	0.2	C	C	.	.	S	Bend	trans	-82.8	74.5	177.2	-49.5	179	0	0	0	108.2	L159 V184 N187 L192 Y211 L259 L263	L159-I162 HydrophobicContact CD2-CD1 4.35Å; L159-I162 PolarHBondContact O-N 3.2Å; I162-V184 HydrophobicContact CG2-CG1 4.44Å; I162-V184 HydrophobicContact CG2-CG2 3.93Å; I162-N187 WeakPolarHBondContact O-CB 3.4Å; I162-N187 PolarHBondContact O-ND2 3.13Å; I162-L192 HydrophobicContact CG2-CD1 3.96Å; I162-L192 HydrophobicContact CG2-CD2 3.73Å; I162-Y211 HydrophobicContact CD1-CD2 4.1Å; I162-Y211 HydrophobicContact CD1-CG 4.28Å; I162-L259 HydrophobicContact CB-CD1 4.38Å; I162-L259 HydrophobicContact CG1-CD1 4.1Å; I162-L259 HydrophobicContact CG1-CD2 4.32Å; I162-L259 HydrophobicContact CG2-CD1 4.06Å; I162-L263 HydrophobicContact CD1-CD1 4.46Å; I162-L263 HydrophobicContact CG1-CD1 4.03Å
163	A	85.6	Confident	78.3	Confident	42 Å²	42	30.3 Å²	30.3	35%	0.347	17%	0.169	S	C	.	.			trans	-83.5	156.9	-179.9	0	0	0	0	0	112.1	L161 G165 S166	L161-A163 VanDerWaalsContact C-N 3.26Å; L161-A163 PolarHBondContact O-N 3.45Å; A163-G165 PolarHBondContact O-N 2.89Å; A163-S166 PolarHBondContact N-OG 3.39Å; A163-S166 WeakPolarHBondContact O-CB 3.46Å; A163-S166 PolarHBondContact O-N 3.49Å; A163-S166 PolarHBondContact O-OG 2.92Å
164	P	89.8	Confident	79.8	Confident	91 Å²	91	31.3 Å²	31.3	59%	0.591	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.7	135.4	165.4	-27.2	36.5	0	0	0	111.8	V184	P164-V184 CarbonylContact C-O 3.59Å; P164-V184 WeakPolarHBondContact CA-O 3.46Å
165	G	89.2	Confident	81	Confident	36 Å²	36	32 Å²	32	37%	0.371	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-18.9	-169.9	0	0	0	0	0	114.4	A163 R167 V184	A163-G165 PolarHBondContact O-N 2.89Å; G165-R167 PolarHBondContact O-N 2.62Å; G165-V184 PolarHBondContact N-O 3.26Å
166	S	91.1	Very high	82.8	Confident	21 Å²	21	32.8 Å²	32.8	15%	0.147	18%	0.184	C	C	.	.			trans	-64.2	133.2	-179.4	-53.9	0	0	0	0	111.9	A163 V184	A163-S166 PolarHBondContact N-OG 3.39Å; A163-S166 WeakPolarHBondContact O-CB 3.46Å; A163-S166 PolarHBondContact O-N 3.49Å; A163-S166 PolarHBondContact O-OG 2.92Å; S166-V184 WeakPolarHBondContact O-CG2 3.31Å; S166-V184 PolarHBondContact O-N 3.43Å
167	R	92.8	Very high	84.3	Confident	35 Å²	35	28.5 Å²	28.5	13%	0.132	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	143.2	177.1	-71.1	168.8	168.7	141.1	-10.9	112.4	G165 I181 V182 E197 V219 E254 E256	G165-R167 PolarHBondContact O-N 2.62Å; R167-I181 HydrophobicContact CB-CG2 4.19Å; R167-I181 HydrophobicContact CG-CG2 4.25Å; R167-V182 WeakPolarHBondContact CA-O 3.49Å; R167-E197 IonicContact CZ-OE1 3.7Å; R167-E197 VanDerWaalsContact CZ-OE1 3.24Å; R167-E197 IonicContact NE-OE1 3.37Å; R167-E197 PolarHBondContact NE-OE1 3.43Å; R167-E197 IonicContact NH2-OE1 2.59Å; R167-E197 PolarHBondContact NH2-OE1 2.81Å; R167-V219 HydrophobicContact CB-CG2 4.13Å; R167-V219 WeakPolarHBondContact O-CG2 3.41Å; R167-E254 IonicContact CZ-OE2 3.22Å; R167-E254 IonicContact NH1-OE2 2.73Å; R167-E254 PolarHBondContact NH1-OE2 3.09Å; R167-E254 IonicContact NH2-OE2 2.9Å; R167-E254 PolarHBondContact NH2-OE2 3.01Å; R167-E256 IonicContact CZ-OE2 3.83Å; R167-E256 IonicContact NE-OE2 2.62Å; R167-E256 IonicContact NH1-OE2 2.7Å; R167-E256 PolarHBondContact NH1-OE2 3.18Å
168	L	94.5	Very high	85.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	168	177.1	-69.3	176.8	0	0	0	110.1	I181 V182 V184 L192 L216 H217 L259 F264	L168-I181 CarbonylContact O-C 3.58Å; L168-I181 WeakPolarHBondContact O-CA 3.44Å; L168-V182 HydrophobicContact CB-CG2 3.98Å; L168-V182 PolarHBondContact N-O 3.18Å; L168-V182 PolarHBondContact O-N 2.88Å; L168-V184 HydrophobicContact CD1-CG2 4.27Å; L168-L192 HydrophobicContact CD1-CD1 4.05Å; L168-L216 HydrophobicContact CB-CD1 3.99Å; L168-L216 HydrophobicContact CD1-CD1 4.08Å; L168-L216 HydrophobicContact CD1-CD2 3.93Å; L168-L216 HydrophobicContact CD1-CG 4.08Å; L168-H217 WeakPolarHBondContact CD2-O 3.35Å; L168-L259 HydrophobicContact CD1-CD1 4.37Å; L168-L259 HydrophobicContact CD2-CB 4.23Å; L168-L259 HydrophobicContact CD2-CD1 3.62Å; L168-L259 HydrophobicContact CG-CD1 3.99Å; L168-F264 HydrophobicContact CD1-CZ 4.28Å; L168-F264 HydrophobicContact CD2-CE2 4.11Å; L168-F264 HydrophobicContact CD2-CZ 3.55Å
169	E	94.6	Very high	87.3	Confident	7 Å²	7	27.9 Å²	27.9	3%	0.033	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.9	173.9	-77.1	173.1	-173	0	0	109.8	T179 H217 G220 W221 A222 L229	E169-T179 HydrophobicContact CB-CG2 4Å; E169-H217 PolarHBondContact N-O 3.21Å; E169-H217 PolarHBondContact O-N 3.11Å; E169-G220 VanDerWaalsContact CD-N 3.31Å; E169-G220 PolarHBondContact OE1-N 3.2Å; E169-G220 PolarHBondContact OE2-N 2.96Å; E169-W221 PolarHBondContact OE2-N 3.48Å; E169-W221 VanDerWaalsContact OE2-N 3.09Å; E169-A222 VanDerWaalsContact OE2-CB 3.25Å; E169-A222 WeakPolarHBondContact OE2-CB 3.49Å; E169-A222 PolarHBondContact OE2-N 3.05Å; E169-L229 HydrophobicContact CG-CD2 4.25Å
170	C	94.8	Very high	88.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.5	177.3	-167.8	0	0	0	0	109.7	T179 W180 V182 L216	C170-T179 WeakPolarHBondContact O-CA 3.4Å; C170-W180 PolarHBondContact N-O 2.83Å; C170-W180 PolarHBondContact O-N 3.11Å; C170-V182 HydrophobicContact CB-CB 4.32Å; C170-V182 HydrophobicContact CB-CG1 3.57Å; C170-V182 HydrophobicContact CB-CG2 3.74Å; C170-L216 HydrophobicContact CB-CD1 4Å
171	Q	93.1	Very high	89.7	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	138.3	165.4	-60	-171.7	-91.4	0	0	108.9	F173 T179 F215 H217 W221 Y305	Q171-F173 PolarHBondContact O-N 2.97Å; Q171-T179 HydrophobicContact CG-CG2 4.25Å; Q171-F215 HydrophobicContact CB-CB 4.18Å; Q171-F215 HydrophobicContact CB-CD1 4.14Å; Q171-F215 PolarHBondContact N-O 3.26Å; Q171-H217 PolarHBondContact OE1-NE2 2.87Å; Q171-W221 VanDerWaalsContact CD-CH2 3.49Å; Q171-W221 HydrophobicContact CG-CH2 4.27Å; Q171-W221 HydrophobicContact CG-CZ3 3.91Å; Q171-W221 VanDerWaalsContact OE1-CH2 3.28Å; Q171-Y305 PolarHBondContact OE1-OH 2.64Å
172	A	89.5	Confident	90.5	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.033	14%	0.143	C	C	.	.			trans	-55.2	139.9	159.8	0	0	0	0	0	109.1	S176 S178 P232	A172-S176 CarbonylContact C-O 3.58Å; A172-S176 WeakPolarHBondContact CB-OG 3.38Å; A172-S178 WeakPolarHBondContact CB-O 2.79Å; A172-S178 WeakPolarHBondContact CB-OG 3.44Å; A172-S178 PolarHBondContact N-O 3.12Å; A172-P232 HydrophobicContact CB-CB 4.14Å; A172-P232 HydrophobicContact CB-CG 4.21Å
173	F	86.7	Confident	90.9	Very high	41 Å²	41	24.5 Å²	24.5	18%	0.18	15%	0.15	C	C	.	.			trans	-127.7	7.7	178.8	60.9	-93.9	0	0	0	112.4	Q171 L209 F215 W287 V324	Q171-F173 PolarHBondContact O-N 2.97Å; F173-L209 HydrophobicContact CE1-CD1 4.37Å; F173-L209 HydrophobicContact CE1-CD2 4.18Å; F173-L209 HydrophobicContact CZ-CD2 4.3Å; F173-F215 HydrophobicContact CB-CB 4.41Å; F173-F215 HydrophobicContact CB-CD1 3.89Å; F173-F215 HydrophobicContact CB-CD2 3.62Å; F173-F215 HydrophobicContact CB-CE1 4Å; F173-F215 HydrophobicContact CB-CE2 3.74Å; F173-F215 HydrophobicContact CB-CG 3.69Å; F173-F215 HydrophobicContact CB-CZ 3.93Å; F173-F215 HydrophobicContact CD1-CB 4.49Å; F173-F215 HydrophobicContact CG-CD2 4.24Å; F173-F215 HydrophobicContact CG-CG 4.48Å; F173-W287 HydrophobicContact CE2-CZ2 4.47Å; F173-V324 PolarHBondContact O-N 3.09Å
174	Q	85	Confident	91.3	Very high	78 Å²	78	22.5 Å²	22.5	36%	0.364	13%	0.134	S	C	.	.	S	Bend	trans	-93.9	-56.4	-177	-52.7	-166.7	-11.3	0	0	111.1	W287 L307 S322 F323	Q174-W287 HydrophobicContact CB-CH2 4.39Å; Q174-W287 HydrophobicContact CB-CZ2 4.49Å; Q174-W287 HydrophobicContact CG-CH2 4.21Å; Q174-W287 HydrophobicContact CG-CZ2 3.86Å; Q174-L307 WeakPolarHBondContact O-CD1 3.4Å; Q174-S322 CarbonylContact O-C 3.58Å; Q174-F323 VanDerWaalsContact O-CA 3.27Å; Q174-F323 WeakPolarHBondContact O-CA 3.45Å; Q174-F323 PolarHBondContact O-N 2.85Å
175	D	81.9	Confident	91.5	Very high	58 Å²	58	20.3 Å²	20.3	31%	0.31	12%	0.118	S	C	.	.	S	Bend	trans	-129.4	-13.9	-171.5	69.5	-26.3	0	0	0	114.6	S233	D175-S233 PolarHBondContact OD1-OG 2.96Å; D175-S233 WeakPolarHBondContact OD2-CB 3.07Å; D175-S233 PolarHBondContact OD2-OG 3.17Å
176	S	87.9	Confident	91.6	Very high	23 Å²	23	22.8 Å²	22.8	16%	0.161	12%	0.12	C	C	.	.			trans	-156	176.8	-162.1	61.4	0	0	0	0	110.3	A172 S178 V324	A172-S176 CarbonylContact C-O 3.58Å; A172-S176 WeakPolarHBondContact CB-OG 3.38Å; S176-S178 PolarHBondContact OG-OG 2.83Å; S176-V324 WeakPolarHBondContact O-CG2 3.31Å
177	L	89.6	Confident	91.5	Very high	18 Å²	18	23.7 Å²	23.7	9%	0.094	12%	0.123	C	C	.	.			trans	-117.8	25	172.5	-72	173.2	0	0	0	111.5	T179 F215 F301 Y305 V324	L177-T179 PolarHBondContact O-N 2.9Å; L177-F215 HydrophobicContact CD2-CE1 4.32Å; L177-F301 HydrophobicContact CD1-CB 3.63Å; L177-F301 HydrophobicContact CD1-CD1 3.76Å; L177-F301 HydrophobicContact CD1-CD2 4.02Å; L177-F301 HydrophobicContact CD1-CE1 4.36Å; L177-F301 HydrophobicContact CD1-CG 3.57Å; L177-F301 HydrophobicContact CG-CD1 4.05Å; L177-F301 HydrophobicContact CG-CD2 4.38Å; L177-F301 HydrophobicContact CG-CE1 4.14Å; L177-F301 HydrophobicContact CG-CE2 4.48Å; L177-F301 HydrophobicContact CG-CG 4.18Å; L177-F301 HydrophobicContact CG-CZ 4.37Å; L177-Y305 HydrophobicContact CD1-CD2 3.84Å; L177-Y305 HydrophobicContact CD1-CG 3.99Å; L177-Y305 HydrophobicContact CD2-CD1 4.42Å; L177-Y305 HydrophobicContact CD2-CD2 4.34Å; L177-Y305 HydrophobicContact CD2-CG 4.21Å; L177-V324 HydrophobicContact CD2-CG1 3.94Å
178	S	91.1	Very high	91.3	Very high	27 Å²	27	22.6 Å²	22.6	19%	0.189	12%	0.12	C	C	.	.			trans	-61.9	126.4	175.9	54.1	0	0	0	0	109.6	A172 S176	A172-S178 WeakPolarHBondContact CB-O 2.79Å; A172-S178 WeakPolarHBondContact CB-OG 3.44Å; A172-S178 PolarHBondContact N-O 3.12Å; S176-S178 PolarHBondContact OG-OG 2.83Å
179	T	94.1	Very high	90.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.2	-177.9	-48.5	0	0	0	0	109.9	E169 C170 Q171 L177 A222 L229 Q230	E169-T179 HydrophobicContact CB-CG2 4Å; C170-T179 WeakPolarHBondContact O-CA 3.4Å; Q171-T179 HydrophobicContact CG-CG2 4.25Å; L177-T179 PolarHBondContact O-N 2.9Å; T179-A222 HydrophobicContact CG2-CB 3.97Å; T179-L229 HydrophobicContact CG2-CD2 4.16Å; T179-L229 CarbonylContact O-C 3.5Å; T179-L229 VanDerWaalsContact O-CA 3.28Å; T179-L229 WeakPolarHBondContact O-CA 3.5Å; T179-Q230 PolarHBondContact O-N 3.49Å; T179-Q230 VanDerWaalsContact O-O 3.14Å
180	W	95	Very high	90.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	159.5	176.3	-164.5	-111.1	0	0	0	111.8	C170 Y196 E197 L229 P231 P232 W244 I247 L248	C170-W180 PolarHBondContact N-O 2.83Å; C170-W180 PolarHBondContact O-N 3.11Å; W180-Y196 HydrophobicContact CB-CD1 4.44Å; W180-E197 PolarHBondContact NE1-O 3.13Å; W180-E197 VanDerWaalsContact NE1-O 3.1Å; W180-L229 HydrophobicContact CE3-CB 4.22Å; W180-L229 HydrophobicContact CZ3-CB 4.29Å; W180-P231 HydrophobicContact CD2-CB 4.17Å; W180-P231 HydrophobicContact CE3-CB 4.32Å; W180-P231 VanDerWaalsContact CE3-N 3.33Å; W180-P232 HydrophobicContact CB-CG 4.48Å; W180-W244 HydrophobicContact CH2-CB 4.16Å; W180-W244 HydrophobicContact CH2-CE3 4.26Å; W180-W244 HydrophobicContact CZ2-CD2 4.43Å; W180-W244 AromaticContact CZ2-CE3 3.6Å; W180-W244 HydrophobicContact CZ2-CE3 3.6Å; W180-W244 HydrophobicContact CZ2-CZ3 4.2Å; W180-I247 HydrophobicContact CZ2-CG2 4.4Å; W180-L248 HydrophobicContact CH2-CD1 3.8Å; W180-L248 HydrophobicContact CH2-CD2 3.76Å; W180-L248 HydrophobicContact CH2-CG 3.55Å; W180-L248 HydrophobicContact CZ2-CD2 4.29Å; W180-L248 HydrophobicContact CZ2-CG 4.34Å; W180-L248 HydrophobicContact CZ3-CD1 3.75Å; W180-L248 HydrophobicContact CZ3-CD2 3.89Å; W180-L248 HydrophobicContact CZ3-CG 3.92Å
181	I	94.4	Very high	90	Very high	9 Å²	9	22.9 Å²	22.9	5%	0.046	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132.4	176.5	-53	-177.1	0	0	0	108.5	R167 L168 E197 L229 L248 V251	R167-I181 HydrophobicContact CB-CG2 4.19Å; R167-I181 HydrophobicContact CG-CG2 4.25Å; L168-I181 CarbonylContact O-C 3.58Å; L168-I181 WeakPolarHBondContact O-CA 3.44Å; I181-E197 HydrophobicContact CB-CB 3.88Å; I181-E197 HydrophobicContact CB-CG 4.47Å; I181-E197 HydrophobicContact CG2-CB 3.97Å; I181-E197 HydrophobicContact CG2-CG 4.26Å; I181-E197 WeakPolarHBondContact O-CB 3.38Å; I181-E197 PolarHBondContact O-N 3.41Å; I181-L229 HydrophobicContact CD1-CD1 4.08Å; I181-L229 HydrophobicContact CG1-CD1 4.06Å; I181-L248 HydrophobicContact CD1-CD2 4Å; I181-V251 HydrophobicContact CD1-CB 4.27Å; I181-V251 HydrophobicContact CD1-CG1 3.67Å
182	V	94.6	Very high	90.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.4	170.9	-65.9	0	0	0	0	109.4	R167 L168 C170 L194 R195 Y196 L216	R167-V182 WeakPolarHBondContact CA-O 3.49Å; L168-V182 HydrophobicContact CB-CG2 3.98Å; L168-V182 PolarHBondContact N-O 3.18Å; L168-V182 PolarHBondContact O-N 2.88Å; C170-V182 HydrophobicContact CB-CB 4.32Å; C170-V182 HydrophobicContact CB-CG1 3.57Å; C170-V182 HydrophobicContact CB-CG2 3.74Å; V182-L194 HydrophobicContact CB-CB 4.38Å; V182-L194 HydrophobicContact CG2-CD1 4.31Å; V182-L194 HydrophobicContact CG2-CD2 4.1Å; V182-R195 CarbonylContact C-O 3.14Å; V182-R195 VanDerWaalsContact CA-O 3.3Å; V182-R195 WeakPolarHBondContact CA-O 3.19Å; V182-Y196 HydrophobicContact CG1-CD1 3.55Å; V182-Y196 HydrophobicContact CG1-CE1 3.84Å; V182-Y196 HydrophobicContact CG1-CG 4.31Å; V182-L216 HydrophobicContact CG2-CD1 3.83Å
183	T	93.8	Very high	90.3	Very high	24 Å²	24	23.8 Å²	23.8	15%	0.147	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.5	178.4	-66.5	0	0	0	0	108.8	V185 R195 E197	T183-V185 PolarHBondContact O-N 2.66Å; T183-R195 PolarHBondContact N-O 2.87Å; T183-R195 PolarHBondContact O-N 2.94Å; T183-R195 VanDerWaalsContact O-N 3.1Å; T183-E197 PolarHBondContact OG1-OE2 3.26Å
184	V	94.3	Very high	90.7	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	115.6	178.3	176.7	0	0	0	0	108.9	I162 P164 G165 S166 L168 N187 L192 L194	I162-V184 HydrophobicContact CG2-CG1 4.44Å; I162-V184 HydrophobicContact CG2-CG2 3.93Å; P164-V184 CarbonylContact C-O 3.59Å; P164-V184 WeakPolarHBondContact CA-O 3.46Å; G165-V184 PolarHBondContact N-O 3.26Å; S166-V184 WeakPolarHBondContact O-CG2 3.31Å; S166-V184 PolarHBondContact O-N 3.43Å; L168-V184 HydrophobicContact CD1-CG2 4.27Å; V184-N187 HydrophobicContact CG1-CB 4.46Å; V184-L192 HydrophobicContact CG1-CD2 4.47Å; V184-L192 HydrophobicContact CG2-CD1 4.38Å; V184-L194 HydrophobicContact CG2-CD2 3.93Å
185	V	93.4	Very high	91.2	Very high	44 Å²	44	20.5 Å²	20.5	27%	0.267	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-40.2	173.9	-177.4	0	0	0	0	110.2	T183 K193 R195	T183-V185 PolarHBondContact O-N 2.66Å; V185-K193 HydrophobicContact CB-CB 4.26Å; V185-K193 HydrophobicContact CB-CD 4.46Å; V185-K193 HydrophobicContact CB-CG 4.45Å; V185-K193 HydrophobicContact CG1-CD 4.39Å; V185-K193 PolarHBondContact N-O 2.8Å; V185-R195 HydrophobicContact CG2-CB 3.68Å
186	E	91.3	Very high	91.7	Very high	89 Å²	89	18.6 Å²	18.6	42%	0.416	10%	0.099	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	149.1	-177.1	-166.8	175.1	-164.3	0	0	110.1	I188 L192 K193	E186-I188 HydrophobicContact CG-CD1 4.26Å; E186-I188 HydrophobicContact CG-CG1 3.88Å; E186-L192 WeakPolarHBondContact O-CA 3.46Å; E186-K193 HydrophobicContact CB-CB 3.89Å; E186-K193 PolarHBondContact O-N 2.94Å
187	N	90	Very high	91.9	Very high	40 Å²	40	19 Å²	19	21%	0.214	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	115.6	172.7	174.1	2.3	0	0	0	109.1	L159 I162 V184 G190 L192	L159-N187 PolarHBondContact O-ND2 3.13Å; I162-N187 WeakPolarHBondContact O-CB 3.4Å; I162-N187 PolarHBondContact O-ND2 3.13Å; V184-N187 HydrophobicContact CG1-CB 4.46Å; N187-G190 PolarHBondContact OD1-N 2.9Å; N187-L192 HydrophobicContact CB-CD2 3.63Å; N187-L192 VanDerWaalsContact CG-CD2 3.44Å
188	I	87.6	Confident	91.8	Very high	12 Å²	12	19.4 Å²	19.4	6%	0.062	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	91.4	-179.7	-50.4	-168.7	0	0	0	108.3	E186 G190 R191 W208 W442 N446 H448	E186-I188 HydrophobicContact CG-CD1 4.26Å; E186-I188 HydrophobicContact CG-CG1 3.88Å; I188-G190 PolarHBondContact O-N 3.42Å; I188-G190 VanDerWaalsContact O-N 3.12Å; I188-R191 PolarHBondContact N-O 3.09Å; I188-R191 WeakPolarHBondContact O-CB 3.28Å; I188-R191 PolarHBondContact O-N 2.83Å; I188-W208 HydrophobicContact CB-CZ3 4.5Å; I188-W208 HydrophobicContact CD1-CH2 3.63Å; I188-W208 HydrophobicContact CD1-CZ3 4.12Å; I188-W208 HydrophobicContact CG1-CH2 4.03Å; I188-W208 HydrophobicContact CG1-CZ3 4.11Å; I188-W442 HydrophobicContact CB-CH2 4.47Å; I188-W442 HydrophobicContact CG2-CH2 3.75Å; I188-W442 HydrophobicContact CG2-CZ3 4.25Å; I188-W442 WeakPolarHBondContact O-CH2 3.46Å; I188-W442 VanDerWaalsContact O-CZ2 3.3Å; I188-W442 WeakPolarHBondContact O-CZ2 3.33Å; I188-N446 HydrophobicContact CG2-CB 4.21Å; I188-H448 WeakPolarHBondContact CD1-ND1 3.32Å; I188-H448 HydrophobicContact CG2-CB 3.67Å
189	G	78.1	Confident	91.8	Very high	9 Å²	9	18.8 Å²	18.8	9%	0.093	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	25.4	175.3	0	0	0	0	0	115	Y210 N446	G189-Y210 PolarHBondContact O-OH 3.28Å; G189-N446 VanDerWaalsContact CA-OD1 3.23Å; G189-N446 WeakPolarHBondContact CA-OD1 3.46Å
190	G	86.9	Confident	91.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.7	-12.5	-175.7	0	0	0	0	0	114.5	N187 I188 L192 Y210 Y211	N187-G190 PolarHBondContact OD1-N 2.9Å; I188-G190 PolarHBondContact O-N 3.42Å; I188-G190 VanDerWaalsContact O-N 3.12Å; G190-L192 PolarHBondContact O-N 3.09Å; G190-Y210 WeakPolarHBondContact O-CA 3.3Å; G190-Y210 WeakPolarHBondContact O-CD2 3.4Å; G190-Y211 PolarHBondContact O-N 3.37Å
191	R	92.3	Very high	90.3	Very high	3 Å²	3	29.1 Å²	29.1	1%	0.011	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	118.3	163.6	-56.7	-172.4	82.1	-128.5	-7.5	108.1	I188 W208 Y210 V393 P398 D436 F438 W442	I188-R191 PolarHBondContact N-O 3.09Å; I188-R191 WeakPolarHBondContact O-CB 3.28Å; I188-R191 PolarHBondContact O-N 2.83Å; R191-W208 HydrophobicContact CB-CE3 3.99Å; R191-W208 HydrophobicContact CB-CZ3 4.13Å; R191-Y210 HydrophobicContact CG-CD2 4.08Å; R191-Y210 HydrophobicContact CG-CE2 4.43Å; R191-V393 VanDerWaalsContact NH2-CG1 3.35Å; R191-V393 VanDerWaalsContact NH2-CG2 3.28Å; R191-P398 PolarHBondContact NH1-O 2.93Å; R191-P398 PolarHBondContact NH2-O 2.88Å; R191-D436 IonicContact CZ-OD1 2.68Å; R191-D436 IonicContact NE-OD1 2.85Å; R191-D436 PolarHBondContact NE-OD1 2.98Å; R191-D436 IonicContact NH2-OD1 2.64Å; R191-D436 PolarHBondContact NH2-OD1 3.5Å; R191-F438 VanDerWaalsContact CD-CZ 3.47Å; R191-F438 HydrophobicContact CG-CE2 4.49Å; R191-F438 HydrophobicContact CG-CZ 3.8Å; R191-W442 HydrophobicContact CG-CH2 3.94Å; R191-W442 HydrophobicContact CG-CZ2 3.95Å
192	L	94.4	Very high	89.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.3	-178.1	-53.8	-177.6	0	0	0	109.5	I162 L168 V184 E186 N187 G190 L194 W208 L209 L216	I162-L192 HydrophobicContact CG2-CD1 3.96Å; I162-L192 HydrophobicContact CG2-CD2 3.73Å; L168-L192 HydrophobicContact CD1-CD1 4.05Å; V184-L192 HydrophobicContact CG1-CD2 4.47Å; V184-L192 HydrophobicContact CG2-CD1 4.38Å; E186-L192 WeakPolarHBondContact O-CA 3.46Å; N187-L192 HydrophobicContact CB-CD2 3.63Å; N187-L192 VanDerWaalsContact CG-CD2 3.44Å; G190-L192 PolarHBondContact O-N 3.09Å; L192-L194 HydrophobicContact CB-CD2 3.9Å; L192-L194 HydrophobicContact CB-CG 4.13Å; L192-L194 HydrophobicContact CD1-CD2 4.5Å; L192-W208 WeakPolarHBondContact O-CA 3.39Å; L192-L209 PolarHBondContact N-O 3.44Å; L192-L209 PolarHBondContact O-N 2.87Å; L192-L209 VanDerWaalsContact O-N 3.17Å; L192-L216 HydrophobicContact CD1-CD2 3.88Å
193	K	94.9	Very high	88.5	Confident	24 Å²	24	34.9 Å²	34.9	10%	0.104	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	117.3	165	-159	-177.2	-153.1	-161.6	0	107.8	V185 E186 E206 W208 E399	V185-K193 HydrophobicContact CB-CB 4.26Å; V185-K193 HydrophobicContact CB-CD 4.46Å; V185-K193 HydrophobicContact CB-CG 4.45Å; V185-K193 HydrophobicContact CG1-CD 4.39Å; V185-K193 PolarHBondContact N-O 2.8Å; E186-K193 HydrophobicContact CB-CB 3.89Å; E186-K193 PolarHBondContact O-N 2.94Å; K193-E206 WeakPolarHBondContact CE-OE2 3.2Å; K193-E206 IonicContact NZ-OE2 3.27Å; K193-E206 PolarHBondContact NZ-OE2 2.98Å; K193-W208 HydrophobicContact CB-CD2 4.11Å; K193-W208 HydrophobicContact CB-CE3 4.07Å; K193-W208 HydrophobicContact CB-CH2 3.73Å; K193-W208 HydrophobicContact CB-CZ2 3.77Å; K193-W208 HydrophobicContact CB-CZ3 3.88Å; K193-W208 HydrophobicContact CD-CH2 4.38Å; K193-W208 HydrophobicContact CD-CZ2 3.74Å; K193-W208 HydrophobicContact CG-CD2 4.18Å; K193-W208 HydrophobicContact CG-CH2 4.25Å; K193-W208 HydrophobicContact CG-CZ2 3.75Å; K193-E399 VanDerWaalsContact CE-OE1 3.27Å; K193-E399 WeakPolarHBondContact CE-OE1 3.09Å; K193-E399 IonicContact NZ-OE1 2.74Å; K193-E399 PolarHBondContact NZ-OE1 3.27Å
194	L	94.8	Very high	87.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.5	-172	-60.6	174.8	0	0	0	110.4	V182 V184 L192 E206 H207 L209 L216	V182-L194 HydrophobicContact CB-CB 4.38Å; V182-L194 HydrophobicContact CG2-CD1 4.31Å; V182-L194 HydrophobicContact CG2-CD2 4.1Å; V184-L194 HydrophobicContact CG2-CD2 3.93Å; L192-L194 HydrophobicContact CB-CD2 3.9Å; L192-L194 HydrophobicContact CB-CG 4.13Å; L192-L194 HydrophobicContact CD1-CD2 4.5Å; L194-E206 WeakPolarHBondContact O-CA 3.47Å; L194-H207 PolarHBondContact N-O 3.08Å; L194-H207 PolarHBondContact O-N 3.12Å; L194-H207 PolarHBondContact O-ND1 3.45Å; L194-L209 HydrophobicContact CD1-CB 4.01Å; L194-L209 HydrophobicContact CD1-CD1 3.92Å; L194-L209 HydrophobicContact CD1-CG 4.15Å; L194-L216 HydrophobicContact CD1-CD1 3.87Å; L194-L216 HydrophobicContact CD1-CD2 4.05Å
195	R	94.1	Very high	87.1	Confident	49 Å²	49	44.3 Å²	44.3	19%	0.185	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.4	169.4	-165.6	-173.8	-53.9	134.4	1.8	108.8	V182 T183 V185 L199 S201 E206	V182-R195 CarbonylContact C-O 3.14Å; V182-R195 VanDerWaalsContact CA-O 3.3Å; V182-R195 WeakPolarHBondContact CA-O 3.19Å; T183-R195 PolarHBondContact N-O 2.87Å; T183-R195 PolarHBondContact O-N 2.94Å; T183-R195 VanDerWaalsContact O-N 3.1Å; V185-R195 HydrophobicContact CG2-CB 3.68Å; R195-L199 VanDerWaalsContact CD-O 3.27Å; R195-L199 WeakPolarHBondContact CD-O 3.29Å; R195-L199 HydrophobicContact CG-CB 4.32Å; R195-S201 PolarHBondContact NH2-OG 2.87Å; R195-E206 HydrophobicContact CB-CG 4.41Å; R195-E206 HydrophobicContact CG-CG 4.3Å; R195-E206 IonicContact CZ-OE1 2.91Å; R195-E206 IonicContact NE-OE1 3.24Å; R195-E206 PolarHBondContact NE-OE1 3.02Å; R195-E206 IonicContact NH2-OE1 2.71Å; R195-E206 PolarHBondContact NH2-OE1 3.41Å
196	Y	93.4	Very high	86.9	Confident	19 Å²	19	44.8 Å²	44.8	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.5	174.6	-65.9	-75.4	0	0	0	111.3	W180 V182 G198 L199 H207 P232 I235	W180-Y196 HydrophobicContact CB-CD1 4.44Å; V182-Y196 HydrophobicContact CG1-CD1 3.55Å; V182-Y196 HydrophobicContact CG1-CE1 3.84Å; V182-Y196 HydrophobicContact CG1-CG 4.31Å; Y196-G198 PolarHBondContact O-N 2.85Å; Y196-L199 WeakPolarHBondContact O-CB 3.17Å; Y196-L199 PolarHBondContact O-N 3.45Å; Y196-H207 AromaticContact CE2-CE1 3.69Å; Y196-H207 AromaticContact CE2-ND1 3.91Å; Y196-H207 AromaticContact CZ-CE1 3.6Å; Y196-P232 HydrophobicContact CD1-CG 4.38Å; Y196-P232 HydrophobicContact CE1-CG 3.75Å; Y196-I235 HydrophobicContact CD1-CD1 4.17Å; Y196-I235 HydrophobicContact CD2-CD1 4.01Å; Y196-I235 HydrophobicContact CD2-CG2 3.99Å; Y196-I235 HydrophobicContact CE2-CG2 4.35Å; Y196-I235 HydrophobicContact CG-CD1 3.64Å
197	E	92.1	Very high	86.8	Confident	30 Å²	30	42.1 Å²	42.1	14%	0.14	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	133.6	-174.6	-170.3	69.4	159.3	0	0	111.5	R167 W180 I181 T183 I247 V251	R167-E197 IonicContact CZ-OE1 3.7Å; R167-E197 VanDerWaalsContact CZ-OE1 3.24Å; R167-E197 IonicContact NE-OE1 3.37Å; R167-E197 PolarHBondContact NE-OE1 3.43Å; R167-E197 IonicContact NH2-OE1 2.59Å; R167-E197 PolarHBondContact NH2-OE1 2.81Å; W180-E197 PolarHBondContact NE1-O 3.13Å; W180-E197 VanDerWaalsContact NE1-O 3.1Å; I181-E197 HydrophobicContact CB-CB 3.88Å; I181-E197 HydrophobicContact CB-CG 4.47Å; I181-E197 HydrophobicContact CG2-CB 3.97Å; I181-E197 HydrophobicContact CG2-CG 4.26Å; I181-E197 WeakPolarHBondContact O-CB 3.38Å; I181-E197 PolarHBondContact O-N 3.41Å; T183-E197 PolarHBondContact OG1-OE2 3.26Å; E197-I247 HydrophobicContact CG-CG2 4.04Å; E197-V251 HydrophobicContact CG-CG2 3.83Å
198	G	88.2	Confident	87	Confident	27 Å²	27	41.7 Å²	41.7	28%	0.278	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	-0.8	-172.3	0	0	0	0	0	115.6	Y196 K239	Y196-G198 PolarHBondContact O-N 2.85Å; G198-K239 WeakPolarHBondContact O-CE 3.37Å; G198-K239 PolarHBondContact O-NZ 2.77Å
199	L	89.3	Confident	87.3	Confident	14 Å²	14	41.9 Å²	41.9	7%	0.073	22%	0.222	C	C	.	.			trans	-97.7	144.5	171.4	-59.9	-173.3	0	0	0	112.1	R195 Y196 D203 Y205 I235 L238 W244	R195-L199 VanDerWaalsContact CD-O 3.27Å; R195-L199 WeakPolarHBondContact CD-O 3.29Å; R195-L199 HydrophobicContact CG-CB 4.32Å; Y196-L199 WeakPolarHBondContact O-CB 3.17Å; Y196-L199 PolarHBondContact O-N 3.45Å; L199-D203 WeakPolarHBondContact CA-OD2 3.27Å; L199-D203 HydrophobicContact CB-CB 4.36Å; L199-Y205 HydrophobicContact CD1-CD2 4.09Å; L199-Y205 HydrophobicContact CD1-CG 4.16Å; L199-I235 HydrophobicContact CD1-CB 4.25Å; L199-I235 HydrophobicContact CD1-CD1 4.28Å; L199-I235 HydrophobicContact CD1-CG2 3.86Å; L199-L238 HydrophobicContact CD1-CD1 4.36Å; L199-L238 HydrophobicContact CD2-CD1 3.91Å; L199-W244 HydrophobicContact CD2-CH2 4.01Å
200	E	83.9	Confident	88	Confident	137 Å²	137	41.8 Å²	41.8	64%	0.64	22%	0.219	S	C	*	.			trans	-89.7	161	176.5	-70.3	-173.9	-146.9	0	0	111.3	S202 D203	E200-S202 WeakPolarHBondContact CB-OG 3.07Å; E200-S202 PolarHBondContact O-N 2.81Å; E200-D203 PolarHBondContact N-OD2 3.23Å; E200-D203 WeakPolarHBondContact O-CB 3.19Å; E200-D203 PolarHBondContact O-N 2.71Å
201	S	74.8	Confident	88.2	Confident	80 Å²	80	42.1 Å²	42.1	56%	0.559	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-19.1	177.1	-48	0	0	0	0	113.3	R195 D203	R195-S201 PolarHBondContact NH2-OG 2.87Å; S201-D203 VanDerWaalsContact C-N 3.28Å
202	S	74.3	Confident	88.2	Confident	76 Å²	76	42.3 Å²	42.3	53%	0.531	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.5	173.3	47.9	0	0	0	0	114.2	E200 N204	E200-S202 WeakPolarHBondContact CB-OG 3.07Å; E200-S202 PolarHBondContact O-N 2.81Å; S202-N204 VanDerWaalsContact C-N 3.31Å; S202-N204 PolarHBondContact O-N 3.11Å; S202-N204 PolarHBondContact O-ND2 2.99Å
203	D	76	Confident	88.1	Confident	54 Å²	54	43.7 Å²	43.7	29%	0.289	23%	0.229	S	C	.	.	S	Bend	trans	-83.6	-14.4	-166.1	-56.5	-15.3	0	0	0	111.6	L199 E200 S201 Y205	L199-D203 WeakPolarHBondContact CA-OD2 3.27Å; L199-D203 HydrophobicContact CB-CB 4.36Å; E200-D203 PolarHBondContact N-OD2 3.23Å; E200-D203 WeakPolarHBondContact O-CB 3.19Å; E200-D203 PolarHBondContact O-N 2.71Å; S201-D203 VanDerWaalsContact C-N 3.28Å; D203-Y205 HydrophobicContact CB-CD2 4.06Å; D203-Y205 WeakPolarHBondContact O-CD2 3.15Å; D203-Y205 WeakPolarHBondContact O-CE2 3.45Å; D203-Y205 PolarHBondContact O-N 3.4Å; D203-Y205 VanDerWaalsContact O-N 3.12Å
204	N	77.3	Confident	87.9	Confident	138 Å²	138	43.2 Å²	43.2	74%	0.738	23%	0.228	S	C	*	.			trans	60.3	10.9	176.2	-60	-79.4	0	0	0	116.4	S202 E206	S202-N204 VanDerWaalsContact C-N 3.31Å; S202-N204 PolarHBondContact O-N 3.11Å; S202-N204 PolarHBondContact O-ND2 2.99Å; N204-E206 PolarHBondContact O-N 3.33Å
205	Y	82.3	Confident	87.8	Confident	85 Å²	85	44 Å²	44	33%	0.333	23%	0.231	S	C	.	.			trans	-81.4	49	173.1	-66.3	-84.5	0	0	0	112.6	L199 D203 I235 L238	L199-Y205 HydrophobicContact CD1-CD2 4.09Å; L199-Y205 HydrophobicContact CD1-CG 4.16Å; D203-Y205 HydrophobicContact CB-CD2 4.06Å; D203-Y205 WeakPolarHBondContact O-CD2 3.15Å; D203-Y205 WeakPolarHBondContact O-CE2 3.45Å; D203-Y205 PolarHBondContact O-N 3.4Å; D203-Y205 VanDerWaalsContact O-N 3.12Å; Y205-I235 HydrophobicContact CD1-CG2 3.83Å; Y205-I235 HydrophobicContact CD2-CG2 4.45Å; Y205-I235 HydrophobicContact CE1-CG2 4.32Å; Y205-I235 HydrophobicContact CG-CG2 3.91Å; Y205-L238 HydrophobicContact CD2-CD1 3.86Å; Y205-L238 HydrophobicContact CE2-CD1 3.5Å; Y205-L238 HydrophobicContact CE2-CD2 4.27Å; Y205-L238 HydrophobicContact CE2-CG 4.47Å
206	E	88.9	Confident	87.8	Confident	55 Å²	55	41.6 Å²	41.6	26%	0.257	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.2	174.6	-59.2	-169.2	157.3	0	0	110.2	K193 L194 R195 N204	K193-E206 WeakPolarHBondContact CE-OE2 3.2Å; K193-E206 IonicContact NZ-OE2 3.27Å; K193-E206 PolarHBondContact NZ-OE2 2.98Å; L194-E206 WeakPolarHBondContact O-CA 3.47Å; R195-E206 HydrophobicContact CB-CG 4.41Å; R195-E206 HydrophobicContact CG-CG 4.3Å; R195-E206 IonicContact CZ-OE1 2.91Å; R195-E206 IonicContact NE-OE1 3.24Å; R195-E206 PolarHBondContact NE-OE1 3.02Å; R195-E206 IonicContact NH2-OE1 2.71Å; R195-E206 PolarHBondContact NH2-OE1 3.41Å; N204-E206 PolarHBondContact O-N 3.33Å
207	H	89.9	Confident	87.7	Confident	32 Å²	32	41.4 Å²	41.4	15%	0.148	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	160.8	179.4	59.9	-72	0	0	0	110.7	L194 Y196	L194-H207 PolarHBondContact N-O 3.08Å; L194-H207 PolarHBondContact O-N 3.12Å; L194-H207 PolarHBondContact O-ND1 3.45Å; Y196-H207 AromaticContact CE2-CE1 3.69Å; Y196-H207 AromaticContact CE2-ND1 3.91Å; Y196-H207 AromaticContact CZ-CE1 3.6Å
208	W	93.6	Very high	87.6	Confident	31 Å²	31	41.5 Å²	41.5	12%	0.117	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.4	178.3	-69.5	84	0	0	0	109.7	I188 R191 L192 K193 P398 E399	I188-W208 HydrophobicContact CB-CZ3 4.5Å; I188-W208 HydrophobicContact CD1-CH2 3.63Å; I188-W208 HydrophobicContact CD1-CZ3 4.12Å; I188-W208 HydrophobicContact CG1-CH2 4.03Å; I188-W208 HydrophobicContact CG1-CZ3 4.11Å; R191-W208 HydrophobicContact CB-CE3 3.99Å; R191-W208 HydrophobicContact CB-CZ3 4.13Å; L192-W208 WeakPolarHBondContact O-CA 3.39Å; K193-W208 HydrophobicContact CB-CD2 4.11Å; K193-W208 HydrophobicContact CB-CE3 4.07Å; K193-W208 HydrophobicContact CB-CH2 3.73Å; K193-W208 HydrophobicContact CB-CZ2 3.77Å; K193-W208 HydrophobicContact CB-CZ3 3.88Å; K193-W208 HydrophobicContact CD-CH2 4.38Å; K193-W208 HydrophobicContact CD-CZ2 3.74Å; K193-W208 HydrophobicContact CG-CD2 4.18Å; K193-W208 HydrophobicContact CG-CH2 4.25Å; K193-W208 HydrophobicContact CG-CZ2 3.75Å; W208-P398 HydrophobicContact CB-CB 4.32Å; W208-P398 HydrophobicContact CG-CB 4.23Å; W208-E399 HydrophobicContact CZ2-CG 4.28Å
209	L	93.9	Very high	87.7	Confident	17 Å²	17	42.5 Å²	42.5	9%	0.089	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	157.2	167.4	-66.1	178	0	0	0	108.7	F173 L192 L194 D213 L216	F173-L209 HydrophobicContact CE1-CD1 4.37Å; F173-L209 HydrophobicContact CE1-CD2 4.18Å; F173-L209 HydrophobicContact CZ-CD2 4.3Å; L192-L209 PolarHBondContact N-O 3.44Å; L192-L209 PolarHBondContact O-N 2.87Å; L192-L209 VanDerWaalsContact O-N 3.17Å; L194-L209 HydrophobicContact CD1-CB 4.01Å; L194-L209 HydrophobicContact CD1-CD1 3.92Å; L194-L209 HydrophobicContact CD1-CG 4.15Å; L209-D213 HydrophobicContact CB-CB 4.18Å; L209-L216 HydrophobicContact CD1-CB 4.38Å
210	Y	93.3	Very high	87.7	Confident	6 Å²	6	42.9 Å²	42.9	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	150.8	167.8	-159.2	-110.4	0	0	0	110.1	H41 G189 G190 R191 L212 D213 M435	H41-Y210 HydrophobicContact CB-CD1 4.39Å; H41-Y210 HydrophobicContact CB-CE1 3.93Å; H41-Y210 AromaticContact CD2-CE1 3.97Å; H41-Y210 AromaticContact CD2-CZ 3.81Å; H41-Y210 PolarHBondContact O-OH 2.89Å; G189-Y210 PolarHBondContact O-OH 3.28Å; G190-Y210 WeakPolarHBondContact O-CA 3.3Å; G190-Y210 WeakPolarHBondContact O-CD2 3.4Å; R191-Y210 HydrophobicContact CG-CD2 4.08Å; R191-Y210 HydrophobicContact CG-CE2 4.43Å; Y210-L212 HydrophobicContact CD1-CB 4.24Å; Y210-L212 HydrophobicContact CE1-CD1 4.49Å; Y210-L212 PolarHBondContact O-N 2.89Å; Y210-D213 WeakPolarHBondContact O-CB 3.33Å; Y210-D213 PolarHBondContact O-N 3.36Å; Y210-M435 HydrophobicContact CD1-CB 4.14Å; Y210-M435 HydrophobicContact CD1-CG 4.24Å; Y210-M435 HydrophobicContact CD1-SD 3.66Å; Y210-M435 HydrophobicContact CD2-CB 4.48Å; Y210-M435 HydrophobicContact CG-CB 3.83Å; Y210-M435 HydrophobicContact CG-CG 4.4Å; Y210-M435 HydrophobicContact CG-SD 4.03Å
211	Y	91	Very high	88.1	Confident	8 Å²	8	38.1 Å²	38.1	3%	0.031	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.7	-174.9	82.6	-75.9	0	0	0	114.9	L159 I162 G190 L263 F264	L159-Y211 HydrophobicContact CD2-CD1 3.55Å; L159-Y211 HydrophobicContact CD2-CD2 4Å; L159-Y211 HydrophobicContact CD2-CE1 3.61Å; L159-Y211 HydrophobicContact CD2-CE2 4.06Å; L159-Y211 HydrophobicContact CD2-CG 3.74Å; I162-Y211 HydrophobicContact CD1-CD2 4.1Å; I162-Y211 HydrophobicContact CD1-CG 4.28Å; G190-Y211 PolarHBondContact O-N 3.37Å; Y211-L263 WeakPolarHBondContact CE2-O 3.18Å; Y211-F264 WeakPolarHBondContact O-CD1 3.42Å; Y211-F264 VanDerWaalsContact O-CE1 3.22Å; Y211-F264 WeakPolarHBondContact O-CE1 3.48Å
212	L	90.8	Very high	88.8	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.037	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	10.5	175.1	-62.1	178	0	0	0	113.7	T44 Y210 D266 K267 M435	T44-L212 HydrophobicContact CG2-CD1 4.02Å; Y210-L212 HydrophobicContact CD1-CB 4.24Å; Y210-L212 HydrophobicContact CE1-CD1 4.49Å; Y210-L212 PolarHBondContact O-N 2.89Å; L212-D266 HydrophobicContact CD1-CB 4.39Å; L212-D266 HydrophobicContact CD2-CB 4.48Å; L212-K267 HydrophobicContact CD2-CB 4.42Å; L212-M435 HydrophobicContact CB-CE 4.26Å; L212-M435 HydrophobicContact CB-SD 4.32Å
213	D	92.7	Very high	89.6	Confident	29 Å²	29	34.5 Å²	34.5	16%	0.155	19%	0.186	C	C	.	.			trans	-58.3	137.1	-176.8	-176.4	-84.5	0	0	0	112.6	L209 Y210 F215 L216 K267	L209-D213 HydrophobicContact CB-CB 4.18Å; Y210-D213 WeakPolarHBondContact O-CB 3.33Å; Y210-D213 PolarHBondContact O-N 3.36Å; D213-F215 PolarHBondContact O-N 2.87Å; D213-F215 WeakPolarHBondContact OD1-CB 3.22Å; D213-F215 PolarHBondContact OD1-N 2.94Å; D213-L216 HydrophobicContact CB-CB 4.28Å; D213-L216 PolarHBondContact O-N 2.9Å; D213-L216 VanDerWaalsContact O-N 3.1Å; D213-K267 WeakPolarHBondContact O-CE 3.46Å; D213-K267 PolarHBondContact O-NZ 3.07Å
214	P	91.3	Very high	90.2	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.091	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.5	-35.5	176.7	-34.1	38.8	0	0	0	115.8	H217 K267 I270	P214-H217 PolarHBondContact O-CE1 3.11Å; P214-H217 VanDerWaalsContact O-CE1 3.29Å; P214-K267 VanDerWaalsContact C-NZ 3.28Å; P214-K267 VanDerWaalsContact CA-CE 3.47Å; P214-K267 WeakPolarHBondContact O-CE 3.44Å; P214-K267 PolarHBondContact O-NZ 3.22Å; P214-I270 HydrophobicContact CB-CD1 4.21Å
215	F	92.2	Very high	90.7	Very high	15 Å²	15	36.5 Å²	36.5	7%	0.066	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-6.9	-173.9	-58.4	-77.7	0	0	0	114.5	Q171 F173 L177 D213 H217 Y305 V324	Q171-F215 HydrophobicContact CB-CB 4.18Å; Q171-F215 HydrophobicContact CB-CD1 4.14Å; Q171-F215 PolarHBondContact N-O 3.26Å; F173-F215 HydrophobicContact CB-CB 4.41Å; F173-F215 HydrophobicContact CB-CD1 3.89Å; F173-F215 HydrophobicContact CB-CD2 3.62Å; F173-F215 HydrophobicContact CB-CE1 4Å; F173-F215 HydrophobicContact CB-CE2 3.74Å; F173-F215 HydrophobicContact CB-CG 3.69Å; F173-F215 HydrophobicContact CB-CZ 3.93Å; F173-F215 HydrophobicContact CD1-CB 4.49Å; F173-F215 HydrophobicContact CG-CD2 4.24Å; F173-F215 HydrophobicContact CG-CG 4.48Å; L177-F215 HydrophobicContact CD2-CE1 4.32Å; D213-F215 PolarHBondContact O-N 2.87Å; D213-F215 WeakPolarHBondContact OD1-CB 3.22Å; D213-F215 PolarHBondContact OD1-N 2.94Å; F215-H217 PolarHBondContact O-CD2 2.94Å; F215-H217 VanDerWaalsContact O-CD2 3.25Å; F215-H217 PolarHBondContact O-NE2 3.16Å; F215-Y305 HydrophobicContact CD1-CE1 4.41Å; F215-Y305 HydrophobicContact CE1-CD1 4.12Å; F215-Y305 AromaticContact CE1-CE1 3.69Å; F215-Y305 HydrophobicContact CE1-CE1 3.69Å; F215-Y305 HydrophobicContact CZ-CE1 4.27Å; F215-V324 HydrophobicContact CE1-CB 4.18Å; F215-V324 HydrophobicContact CE1-CG1 3.88Å; F215-V324 HydrophobicContact CZ-CB 4.13Å; F215-V324 HydrophobicContact CZ-CG1 4.06Å
216	L	93.7	Very high	91	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.5	-178.7	-171.2	67	0	0	0	112.7	L168 C170 V182 L192 L194 L209 D213 K267	L168-L216 HydrophobicContact CB-CD1 3.99Å; L168-L216 HydrophobicContact CD1-CD1 4.08Å; L168-L216 HydrophobicContact CD1-CD2 3.93Å; L168-L216 HydrophobicContact CD1-CG 4.08Å; C170-L216 HydrophobicContact CB-CD1 4Å; V182-L216 HydrophobicContact CG2-CD1 3.83Å; L192-L216 HydrophobicContact CD1-CD2 3.88Å; L194-L216 HydrophobicContact CD1-CD1 3.87Å; L194-L216 HydrophobicContact CD1-CD2 4.05Å; L209-L216 HydrophobicContact CD1-CB 4.38Å; D213-L216 HydrophobicContact CB-CB 4.28Å; D213-L216 PolarHBondContact O-N 2.9Å; D213-L216 VanDerWaalsContact O-N 3.1Å; L216-K267 PolarHBondContact O-NZ 3.26Å
217	H	91.8	Very high	91	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.065	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	166.6	-169.9	-49.1	-84.7	0	0	0	112.9	L168 E169 Q171 P214 F215 W221 K267	L168-H217 WeakPolarHBondContact CD2-O 3.35Å; E169-H217 PolarHBondContact N-O 3.21Å; E169-H217 PolarHBondContact O-N 3.11Å; Q171-H217 PolarHBondContact OE1-NE2 2.87Å; P214-H217 PolarHBondContact O-CE1 3.11Å; P214-H217 VanDerWaalsContact O-CE1 3.29Å; F215-H217 PolarHBondContact O-CD2 2.94Å; F215-H217 VanDerWaalsContact O-CD2 3.25Å; F215-H217 PolarHBondContact O-NE2 3.16Å; H217-W221 HydrophobicContact CB-CB 3.75Å; H217-W221 HydrophobicContact CB-CD2 3.78Å; H217-W221 HydrophobicContact CB-CE3 4.09Å; H217-W221 HydrophobicContact CB-CG 3.62Å; H217-W221 AromaticContact CD2-CD2 3.79Å; H217-W221 AromaticContact CD2-CE3 3.54Å; H217-W221 AromaticContact CD2-CH2 3.97Å; H217-W221 AromaticContact CD2-CZ3 3.65Å; H217-W221 AromaticContact CE1-CE2 3.54Å; H217-W221 AromaticContact CE1-CH2 3.76Å; H217-W221 AromaticContact CE1-CZ2 3.39Å; H217-W221 WeakPolarHBondContact CE1-CZ2 3.36Å; H217-W221 AromaticContact CG-CD2 3.52Å; H217-W221 AromaticContact CG-CE2 3.81Å; H217-W221 AromaticContact CG-CE3 3.75Å; H217-W221 AromaticContact CG-CG 3.86Å; H217-W221 AromaticContact ND1-CD2 3.74Å; H217-W221 AromaticContact ND1-CE2 3.5Å; H217-W221 AromaticContact ND1-CZ2 3.87Å; H217-W221 AromaticContact ND1-NE1 3.68Å; H217-W221 AromaticContact NE2-CE2 3.93Å; H217-W221 AromaticContact NE2-CE3 3.92Å; H217-W221 AromaticContact NE2-CH2 3.47Å; H217-W221 WeakPolarHBondContact NE2-CH2 3.46Å; H217-W221 AromaticContact NE2-CZ2 3.63Å; H217-W221 AromaticContact NE2-CZ3 3.63Å; H217-K267 PolarHBondContact CE1-NZ 3.08Å; H217-K267 PolarHBondContact ND1-NZ 2.69Å
218	H	90.6	Very high	90.9	Very high	32 Å²	32	42.4 Å²	42.4	15%	0.148	24%	0.235	C	C	.	.			trans	-72.7	152.6	174.4	72.1	-82.1	0	0	0	111.8	G220 W221 Q224 F264	H218-G220 PolarHBondContact O-N 3.29Å; H218-W221 WeakPolarHBondContact O-CB 3.36Å; H218-W221 PolarHBondContact O-N 2.96Å; H218-W221 VanDerWaalsContact O-N 3.12Å; H218-Q224 PolarHBondContact NE2-NE2 3.16Å; H218-Q224 VanDerWaalsContact NE2-NE2 3.2Å; H218-F264 HydrophobicContact CB-CD2 4.07Å; H218-F264 HydrophobicContact CB-CE2 3.95Å
219	V	90.3	Very high	90.9	Very high	49 Å²	49	42.7 Å²	42.7	30%	0.297	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	132.5	178.1	-179.8	0	0	0	0	110.9	R167 P258	R167-V219 HydrophobicContact CB-CG2 4.13Å; R167-V219 WeakPolarHBondContact O-CG2 3.41Å; V219-P258 HydrophobicContact CB-CB 4.34Å
220	G	88.6	Confident	90.8	Very high	22 Å²	22	44 Å²	44	23%	0.227	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	-6.2	-173.4	0	0	0	0	0	114.6	E169 H218 A223 Q224	E169-G220 VanDerWaalsContact CD-N 3.31Å; E169-G220 PolarHBondContact OE1-N 3.2Å; E169-G220 PolarHBondContact OE2-N 2.96Å; H218-G220 PolarHBondContact O-N 3.29Å; G220-A223 PolarHBondContact O-N 3.22Å; G220-Q224 VanDerWaalsContact O-CG 3.28Å; G220-Q224 WeakPolarHBondContact O-CG 3.44Å; G220-Q224 PolarHBondContact O-N 2.69Å; G220-Q224 VanDerWaalsContact O-N 3.09Å; G220-Q224 PolarHBondContact O-NE2 2.83Å
221	W	91.9	Very high	90.7	Very high	37 Å²	37	43.8 Å²	43.8	14%	0.14	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-43.6	177	175.4	88.2	0	0	0	112.1	E169 Q171 H217 H218 A223 Q224 Q225 Y227	E169-W221 PolarHBondContact OE2-N 3.48Å; E169-W221 VanDerWaalsContact OE2-N 3.09Å; Q171-W221 VanDerWaalsContact CD-CH2 3.49Å; Q171-W221 HydrophobicContact CG-CH2 4.27Å; Q171-W221 HydrophobicContact CG-CZ3 3.91Å; Q171-W221 VanDerWaalsContact OE1-CH2 3.28Å; H217-W221 HydrophobicContact CB-CB 3.75Å; H217-W221 HydrophobicContact CB-CD2 3.78Å; H217-W221 HydrophobicContact CB-CE3 4.09Å; H217-W221 HydrophobicContact CB-CG 3.62Å; H217-W221 AromaticContact CD2-CD2 3.79Å; H217-W221 AromaticContact CD2-CE3 3.54Å; H217-W221 AromaticContact CD2-CH2 3.97Å; H217-W221 AromaticContact CD2-CZ3 3.65Å; H217-W221 AromaticContact CE1-CE2 3.54Å; H217-W221 AromaticContact CE1-CH2 3.76Å; H217-W221 AromaticContact CE1-CZ2 3.39Å; H217-W221 WeakPolarHBondContact CE1-CZ2 3.36Å; H217-W221 AromaticContact CG-CD2 3.52Å; H217-W221 AromaticContact CG-CE2 3.81Å; H217-W221 AromaticContact CG-CE3 3.75Å; H217-W221 AromaticContact CG-CG 3.86Å; H217-W221 AromaticContact ND1-CD2 3.74Å; H217-W221 AromaticContact ND1-CE2 3.5Å; H217-W221 AromaticContact ND1-CZ2 3.87Å; H217-W221 AromaticContact ND1-NE1 3.68Å; H217-W221 AromaticContact NE2-CE2 3.93Å; H217-W221 AromaticContact NE2-CE3 3.92Å; H217-W221 AromaticContact NE2-CH2 3.47Å; H217-W221 WeakPolarHBondContact NE2-CH2 3.46Å; H217-W221 AromaticContact NE2-CZ2 3.63Å; H217-W221 AromaticContact NE2-CZ3 3.63Å; H218-W221 WeakPolarHBondContact O-CB 3.36Å; H218-W221 PolarHBondContact O-N 2.96Å; H218-W221 VanDerWaalsContact O-N 3.12Å; W221-A223 VanDerWaalsContact C-N 3.33Å; W221-A223 PolarHBondContact O-N 2.88Å; W221-Q224 WeakPolarHBondContact O-CB 3.46Å; W221-Q224 PolarHBondContact O-N 3.09Å; W221-Q224 VanDerWaalsContact O-N 3.11Å; W221-Q225 HydrophobicContact CD2-CG 4.03Å; W221-Q225 HydrophobicContact CH2-CG 4.23Å; W221-Q225 HydrophobicContact CZ2-CG 3.68Å; W221-Q225 WeakPolarHBondContact O-CG 3.46Å; W221-Q225 PolarHBondContact O-N 3.35Å; W221-Y227 AromaticContact CH2-CD2 3.85Å; W221-Y227 HydrophobicContact CH2-CD2 3.85Å; W221-Y227 AromaticContact CH2-CE2 3.55Å; W221-Y227 HydrophobicContact CH2-CE2 3.55Å; W221-Y227 HydrophobicContact CZ2-CE2 4.41Å; W221-Y227 AromaticContact CZ3-CD2 3.67Å; W221-Y227 HydrophobicContact CZ3-CD2 3.67Å; W221-Y227 AromaticContact CZ3-CE2 3.89Å; W221-Y227 HydrophobicContact CZ3-CE2 3.89Å
222	A	91.1	Very high	90.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.7	-49.7	178.1	0	0	0	0	0	110.7	E169 T179 Q224 Q225 G226 Y227 L229	E169-A222 VanDerWaalsContact OE2-CB 3.25Å; E169-A222 WeakPolarHBondContact OE2-CB 3.49Å; E169-A222 PolarHBondContact OE2-N 3.05Å; T179-A222 HydrophobicContact CG2-CB 3.97Å; A222-Q224 VanDerWaalsContact C-N 3.34Å; A222-Q224 PolarHBondContact O-N 3.11Å; A222-Q225 CarbonylContact O-C 3.57Å; A222-Q225 PolarHBondContact O-N 2.77Å; A222-Q225 VanDerWaalsContact O-N 3.16Å; A222-G226 PolarHBondContact O-N 2.65Å; A222-Y227 CarbonylContact C-O 3.56Å; A222-Y227 PolarHBondContact O-N 3.37Å; A222-L229 HydrophobicContact CB-CD2 3.95Å
223	A	89.8	Confident	90.5	Very high	80 Å²	80	46.1 Å²	46.1	66%	0.661	26%	0.262	S	S	*	.	H	α-helix	trans	-63.5	-35.5	177.7	0	0	0	0	0	112.9	G220 W221 G226	G220-A223 PolarHBondContact O-N 3.22Å; W221-A223 VanDerWaalsContact C-N 3.33Å; W221-A223 PolarHBondContact O-N 2.88Å; A223-G226 PolarHBondContact O-N 2.98Å
224	Q	90	Very high	90	Very high	124 Å²	124	46.5 Å²	46.5	58%	0.579	27%	0.269	S	S	*	.	H	α-helix	trans	-67.5	-33.4	174.5	-69.8	164.9	33.3	0	0	112.8	H218 G220 W221 A222	H218-Q224 PolarHBondContact NE2-NE2 3.16Å; H218-Q224 VanDerWaalsContact NE2-NE2 3.2Å; G220-Q224 VanDerWaalsContact O-CG 3.28Å; G220-Q224 WeakPolarHBondContact O-CG 3.44Å; G220-Q224 PolarHBondContact O-N 2.69Å; G220-Q224 VanDerWaalsContact O-N 3.09Å; G220-Q224 PolarHBondContact O-NE2 2.83Å; W221-Q224 WeakPolarHBondContact O-CB 3.46Å; W221-Q224 PolarHBondContact O-N 3.09Å; W221-Q224 VanDerWaalsContact O-N 3.11Å; A222-Q224 VanDerWaalsContact C-N 3.34Å; A222-Q224 PolarHBondContact O-N 3.11Å
225	Q	87.6	Confident	89.9	Confident	109 Å²	109	45.8 Å²	45.8	51%	0.509	27%	0.265	S	S	.	.	H	α-helix	trans	-90.6	-6.3	177.6	-59.7	-52.8	-76	0	0	113.7	W221 A222 Y227	W221-Q225 HydrophobicContact CD2-CG 4.03Å; W221-Q225 HydrophobicContact CH2-CG 4.23Å; W221-Q225 HydrophobicContact CZ2-CG 3.68Å; W221-Q225 WeakPolarHBondContact O-CG 3.46Å; W221-Q225 PolarHBondContact O-N 3.35Å; A222-Q225 CarbonylContact O-C 3.57Å; A222-Q225 PolarHBondContact O-N 2.77Å; A222-Q225 VanDerWaalsContact O-N 3.16Å; Q225-Y227 HydrophobicContact CB-CD2 3.66Å; Q225-Y227 HydrophobicContact CB-CE2 3.76Å; Q225-Y227 HydrophobicContact CG-CE2 4.47Å
226	G	87.9	Confident	89.7	Confident	66 Å²	66	50 Å²	50	68%	0.68	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	14.8	-177.5	0	0	0	0	0	115.3	A222 A223	A222-G226 PolarHBondContact O-N 2.65Å; A223-G226 PolarHBondContact O-N 2.98Å
227	Y	88.2	Confident	89.6	Confident	71 Å²	71	56.2 Å²	56.2	28%	0.278	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-80.6	134.8	170.3	-64.4	-68.8	0	0	0	111	W221 A222 Q225	W221-Y227 AromaticContact CH2-CD2 3.85Å; W221-Y227 HydrophobicContact CH2-CD2 3.85Å; W221-Y227 AromaticContact CH2-CE2 3.55Å; W221-Y227 HydrophobicContact CH2-CE2 3.55Å; W221-Y227 HydrophobicContact CZ2-CE2 4.41Å; W221-Y227 AromaticContact CZ3-CD2 3.67Å; W221-Y227 HydrophobicContact CZ3-CD2 3.67Å; W221-Y227 AromaticContact CZ3-CE2 3.89Å; W221-Y227 HydrophobicContact CZ3-CE2 3.89Å; A222-Y227 CarbonylContact C-O 3.56Å; A222-Y227 PolarHBondContact O-N 3.37Å; Q225-Y227 HydrophobicContact CB-CD2 3.66Å; Q225-Y227 HydrophobicContact CB-CE2 3.76Å; Q225-Y227 HydrophobicContact CG-CE2 4.47Å
228	E	89.1	Confident	89.5	Confident	160 Å²	160	58.8 Å²	58.8	75%	0.748	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-81.4	141.8	169	-64.8	-175.3	163	0	0	110.9	Q230	E228-Q230 PolarHBondContact O-N 3.14Å
229	L	93.1	Very high	89.5	Confident	37 Å²	37	59.9 Å²	59.9	19%	0.194	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-72.4	117.2	173.5	-66.2	175.7	0	0	0	109.8	E169 T179 W180 I181 A222 L248	E169-L229 HydrophobicContact CG-CD2 4.25Å; T179-L229 HydrophobicContact CG2-CD2 4.16Å; T179-L229 CarbonylContact O-C 3.5Å; T179-L229 VanDerWaalsContact O-CA 3.28Å; T179-L229 WeakPolarHBondContact O-CA 3.5Å; W180-L229 HydrophobicContact CE3-CB 4.22Å; W180-L229 HydrophobicContact CZ3-CB 4.29Å; I181-L229 HydrophobicContact CD1-CD1 4.08Å; I181-L229 HydrophobicContact CG1-CD1 4.06Å; A222-L229 HydrophobicContact CB-CD2 3.95Å; L229-L248 HydrophobicContact CB-CD1 4.28Å; L229-L248 HydrophobicContact CB-CD2 4.21Å; L229-L248 HydrophobicContact CD1-CD2 3.97Å
230	Q	92.1	Very high	89.6	Confident	43 Å²	43	61.7 Å²	61.7	20%	0.201	34%	0.335	C	S	.	.			trans	-141.6	132.8	-177.9	-74.7	-69.4	-80.3	0	0	110.6	T179 E228 R236	T179-Q230 PolarHBondContact O-N 3.49Å; T179-Q230 VanDerWaalsContact O-O 3.14Å; E228-Q230 PolarHBondContact O-N 3.14Å; Q230-R236 VanDerWaalsContact OE1-NH1 3.13Å
231	P	91.1	Very high	89.7	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.013	34%	0.341	C	S	.	.			trans	-67.7	135.8	-177.7	28.1	-34.8	0	0	0	110.8	W180 I235 R236 W244	W180-P231 HydrophobicContact CD2-CB 4.17Å; W180-P231 HydrophobicContact CE3-CB 4.32Å; W180-P231 VanDerWaalsContact CE3-N 3.33Å; P231-I235 HydrophobicContact CB-CD1 4.22Å; P231-I235 HydrophobicContact CB-CG1 4.15Å; P231-R236 HydrophobicContact CG-CB 4.27Å; P231-R236 HydrophobicContact CG-CG 4.06Å; P231-W244 HydrophobicContact CB-CD2 4.06Å; P231-W244 HydrophobicContact CB-CE3 4.3Å; P231-W244 HydrophobicContact CB-CZ2 4.3Å; P231-W244 HydrophobicContact CG-CD2 3.92Å; P231-W244 HydrophobicContact CG-CG 3.88Å
232	P	90.1	Very high	89.7	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.026	36%	0.361	C	S	.	.			trans	-59	150.6	179.6	-27.6	36.5	0	0	0	113.1	A172 W180 Y196 A234 I235 R236	A172-P232 HydrophobicContact CB-CB 4.14Å; A172-P232 HydrophobicContact CB-CG 4.21Å; W180-P232 HydrophobicContact CB-CG 4.48Å; Y196-P232 HydrophobicContact CD1-CG 4.38Å; Y196-P232 HydrophobicContact CE1-CG 3.75Å; P232-A234 PolarHBondContact O-N 3.34Å; P232-A234 VanDerWaalsContact O-N 3.12Å; P232-I235 WeakPolarHBondContact O-CG1 3.23Å; P232-I235 PolarHBondContact O-N 3.27Å; P232-R236 WeakPolarHBondContact O-CB 3.4Å; P232-R236 PolarHBondContact O-N 2.95Å
233	S	86.9	Confident	89.8	Confident	60 Å²	60	69.7 Å²	69.7	42%	0.42	38%	0.38	S	S	.	.	H	α-helix	trans	-48.2	-41.7	179.7	56.9	0	0	0	0	113.7	D175 I235 R236	D175-S233 PolarHBondContact OD1-OG 2.96Å; D175-S233 WeakPolarHBondContact OD2-CB 3.07Å; D175-S233 PolarHBondContact OD2-OG 3.17Å; S233-I235 PolarHBondContact O-N 3.48Å; S233-I235 VanDerWaalsContact O-N 3.17Å; S233-R236 PolarHBondContact O-N 2.69Å
234	A	83.3	Confident	90	Very high	37 Å²	37	66 Å²	66	31%	0.306	35%	0.348	S	S	.	.	H	α-helix	trans	-54.8	-30.4	177.5	0	0	0	0	0	113.9	P232 H237	P232-A234 PolarHBondContact O-N 3.34Å; P232-A234 VanDerWaalsContact O-N 3.12Å; A234-H237 PolarHBondContact O-CE1 2.83Å; A234-H237 PolarHBondContact O-ND1 3.4Å
235	I	89	Confident	90.1	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-116.6	-19.5	-178.5	70.5	167.6	0	0	0	113.4	Y196 L199 Y205 P231 P232 S233 H237 L238 W244	Y196-I235 HydrophobicContact CD1-CD1 4.17Å; Y196-I235 HydrophobicContact CD2-CD1 4.01Å; Y196-I235 HydrophobicContact CD2-CG2 3.99Å; Y196-I235 HydrophobicContact CE2-CG2 4.35Å; Y196-I235 HydrophobicContact CG-CD1 3.64Å; L199-I235 HydrophobicContact CD1-CB 4.25Å; L199-I235 HydrophobicContact CD1-CD1 4.28Å; L199-I235 HydrophobicContact CD1-CG2 3.86Å; Y205-I235 HydrophobicContact CD1-CG2 3.83Å; Y205-I235 HydrophobicContact CD2-CG2 4.45Å; Y205-I235 HydrophobicContact CE1-CG2 4.32Å; Y205-I235 HydrophobicContact CG-CG2 3.91Å; P231-I235 HydrophobicContact CB-CD1 4.22Å; P231-I235 HydrophobicContact CB-CG1 4.15Å; P232-I235 WeakPolarHBondContact O-CG1 3.23Å; P232-I235 PolarHBondContact O-N 3.27Å; S233-I235 PolarHBondContact O-N 3.48Å; S233-I235 VanDerWaalsContact O-N 3.17Å; I235-H237 PolarHBondContact O-N 3.46Å; I235-L238 HydrophobicContact CB-CD1 3.95Å; I235-L238 HydrophobicContact CG2-CD1 4.29Å; I235-L238 VanDerWaalsContact O-CB 3.26Å; I235-L238 WeakPolarHBondContact O-CB 2.88Å; I235-L238 VanDerWaalsContact O-CG 3.29Å; I235-L238 WeakPolarHBondContact O-CG 3.43Å; I235-L238 PolarHBondContact O-N 3.06Å; I235-W244 HydrophobicContact CD1-CH2 3.97Å; I235-W244 HydrophobicContact CD1-CZ3 4.47Å; I235-W244 HydrophobicContact CG1-CH2 4.34Å; I235-W244 WeakPolarHBondContact O-CZ2 3.15Å
236	R	88.6	Confident	90.3	Very high	103 Å²	103	64 Å²	64	39%	0.389	34%	0.339	S	S	.	.	H	α-helix	trans	-55.6	-28	-173.4	-175.6	168.6	-164.9	149.9	15.2	113.5	Q230 P231 P232 S233 L238 K239 E241 W244	Q230-R236 VanDerWaalsContact OE1-NH1 3.13Å; P231-R236 HydrophobicContact CG-CB 4.27Å; P231-R236 HydrophobicContact CG-CG 4.06Å; P232-R236 WeakPolarHBondContact O-CB 3.4Å; P232-R236 PolarHBondContact O-N 2.95Å; S233-R236 PolarHBondContact O-N 2.69Å; R236-L238 VanDerWaalsContact C-N 3.31Å; R236-L238 PolarHBondContact O-N 3.42Å; R236-K239 VanDerWaalsContact O-O 3.04Å; R236-E241 IonicContact CZ-OE2 3.93Å; R236-E241 IonicContact NE-OE2 3.95Å; R236-E241 IonicContact NH2-OE2 2.68Å; R236-E241 PolarHBondContact NH2-OE2 3.36Å; R236-W244 PolarHBondContact O-NE1 2.94Å
237	H	89.9	Confident	90.5	Very high	131 Å²	131	61.9 Å²	61.9	61%	0.606	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-10.5	179.1	73.4	-88.8	0	0	0	114.6	A234 I235	A234-H237 PolarHBondContact O-CE1 2.83Å; A234-H237 PolarHBondContact O-ND1 3.4Å; I235-H237 PolarHBondContact O-N 3.46Å
238	L	90	Very high	90.6	Very high	67 Å²	67	59 Å²	59	35%	0.351	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-22.8	-174.9	-60.2	171.7	0	0	0	113.8	L199 Y205 I235 R236	L199-L238 HydrophobicContact CD1-CD1 4.36Å; L199-L238 HydrophobicContact CD2-CD1 3.91Å; Y205-L238 HydrophobicContact CD2-CD1 3.86Å; Y205-L238 HydrophobicContact CE2-CD1 3.5Å; Y205-L238 HydrophobicContact CE2-CD2 4.27Å; Y205-L238 HydrophobicContact CE2-CG 4.47Å; I235-L238 HydrophobicContact CB-CD1 3.95Å; I235-L238 HydrophobicContact CG2-CD1 4.29Å; I235-L238 VanDerWaalsContact O-CB 3.26Å; I235-L238 WeakPolarHBondContact O-CB 2.88Å; I235-L238 VanDerWaalsContact O-CG 3.29Å; I235-L238 WeakPolarHBondContact O-CG 3.43Å; I235-L238 PolarHBondContact O-N 3.06Å; R236-L238 VanDerWaalsContact C-N 3.31Å; R236-L238 PolarHBondContact O-N 3.42Å
239	K	91.4	Very high	90.7	Very high	55 Å²	55	53.4 Å²	53.4	24%	0.239	28%	0.283	C	S	.	.	S	Bend	trans	-142.8	158.2	178.5	-48.9	-170.9	-161.8	-66.2	0	110.2	G198 R236 E243 W244 I247	G198-K239 WeakPolarHBondContact O-CE 3.37Å; G198-K239 PolarHBondContact O-NZ 2.77Å; R236-K239 VanDerWaalsContact O-O 3.04Å; K239-E243 WeakPolarHBondContact CA-OE2 3.29Å; K239-E243 HydrophobicContact CB-CB 3.97Å; K239-E243 WeakPolarHBondContact CB-OE2 3.48Å; K239-E243 HydrophobicContact CD-CB 4.3Å; K239-W244 HydrophobicContact CB-CD2 4.24Å; K239-W244 HydrophobicContact CB-CZ2 3.84Å; K239-W244 HydrophobicContact CD-CE3 4.42Å; K239-W244 HydrophobicContact CD-CH2 4.12Å; K239-W244 HydrophobicContact CD-CZ2 4.24Å; K239-W244 HydrophobicContact CD-CZ3 4.21Å; K239-W244 HydrophobicContact CG-CH2 4.16Å; K239-W244 HydrophobicContact CG-CZ2 3.87Å; K239-W244 PolarHBondContact O-NE1 3.21Å; K239-I247 HydrophobicContact CD-CD1 3.96Å
240	N	92.8	Very high	90.5	Very high	87 Å²	87	56.1 Å²	56.1	47%	0.465	29%	0.293	S	S	.	.			trans	-82.3	163.8	176.5	82.7	79.4	0	0	0	112.1	A242 E243 W244	N240-A242 VanDerWaalsContact C-N 3.28Å; N240-A242 PolarHBondContact O-N 3.28Å; N240-A242 WeakPolarHBondContact OD1-CB 3.3Å; N240-A242 PolarHBondContact OD1-N 3.46Å; N240-E243 PolarHBondContact N-OE2 2.86Å; N240-E243 WeakPolarHBondContact ND2-CG 3.22Å; N240-E243 PolarHBondContact ND2-OE2 3.5Å; N240-E243 WeakPolarHBondContact O-CB 3.43Å; N240-E243 PolarHBondContact O-N 3.45Å; N240-E243 VanDerWaalsContact O-N 3.09Å; N240-W244 VanDerWaalsContact O-CD1 3.23Å; N240-W244 PolarHBondContact O-N 3.23Å; N240-W244 VanDerWaalsContact O-N 3.15Å
241	E	90.2	Very high	90.3	Very high	76 Å²	76	55.2 Å²	55.2	36%	0.355	29%	0.29	S	S	.	.	H	α-helix	trans	-58.4	-36	-175	-168.1	65.1	-136.9	0	0	112.9	R236 E243 W244 Q245	R236-E241 IonicContact CZ-OE2 3.93Å; R236-E241 IonicContact NE-OE2 3.95Å; R236-E241 IonicContact NH2-OE2 2.68Å; R236-E241 PolarHBondContact NH2-OE2 3.36Å; E241-E243 PolarHBondContact O-N 2.9Å; E241-W244 PolarHBondContact O-N 2.96Å; E241-Q245 VanDerWaalsContact O-CG 3.31Å; E241-Q245 WeakPolarHBondContact O-CG 3.31Å; E241-Q245 PolarHBondContact O-N 3.44Å; E241-Q245 PolarHBondContact OE1-NE2 2.68Å
242	A	92.6	Very high	89.9	Confident	67 Å²	67	62.5 Å²	62.5	55%	0.554	32%	0.322	S	S	*	.	H	α-helix	trans	-67.7	-35.3	178.3	0	0	0	0	0	112.5	N240 Q245 E246	N240-A242 VanDerWaalsContact C-N 3.28Å; N240-A242 PolarHBondContact O-N 3.28Å; N240-A242 WeakPolarHBondContact OD1-CB 3.3Å; N240-A242 PolarHBondContact OD1-N 3.46Å; A242-Q245 PolarHBondContact O-N 2.95Å; A242-E246 WeakPolarHBondContact O-CB 3.33Å; A242-E246 PolarHBondContact O-N 3.01Å
243	E	93.4	Very high	89.6	Confident	85 Å²	85	69.7 Å²	69.7	40%	0.397	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-40.7	174	-69.4	166.6	137.2	0	0	111	K239 N240 E241 E246 I247	K239-E243 WeakPolarHBondContact CA-OE2 3.29Å; K239-E243 HydrophobicContact CB-CB 3.97Å; K239-E243 WeakPolarHBondContact CB-OE2 3.48Å; K239-E243 HydrophobicContact CD-CB 4.3Å; N240-E243 PolarHBondContact N-OE2 2.86Å; N240-E243 WeakPolarHBondContact ND2-CG 3.22Å; N240-E243 PolarHBondContact ND2-OE2 3.5Å; N240-E243 WeakPolarHBondContact O-CB 3.43Å; N240-E243 PolarHBondContact O-N 3.45Å; N240-E243 VanDerWaalsContact O-N 3.09Å; E241-E243 PolarHBondContact O-N 2.9Å; E243-E246 PolarHBondContact O-N 3.4Å; E243-I247 WeakPolarHBondContact O-CD1 3.46Å; E243-I247 WeakPolarHBondContact O-CG1 3.28Å; E243-I247 PolarHBondContact O-N 2.87Å
244	W	92.9	Very high	89.3	Confident	1 Å²	1	71.5 Å²	71.5	0%	0.004	36%	0.357	C	S	.	.	H	α-helix	trans	-64.6	-38.9	174.5	-66.9	122.7	0	0	0	112.7	W180 L199 P231 I235 R236 K239 N240 E241 I247 L248	W180-W244 HydrophobicContact CH2-CB 4.16Å; W180-W244 HydrophobicContact CH2-CE3 4.26Å; W180-W244 HydrophobicContact CZ2-CD2 4.43Å; W180-W244 AromaticContact CZ2-CE3 3.6Å; W180-W244 HydrophobicContact CZ2-CE3 3.6Å; W180-W244 HydrophobicContact CZ2-CZ3 4.2Å; L199-W244 HydrophobicContact CD2-CH2 4.01Å; P231-W244 HydrophobicContact CB-CD2 4.06Å; P231-W244 HydrophobicContact CB-CE3 4.3Å; P231-W244 HydrophobicContact CB-CZ2 4.3Å; P231-W244 HydrophobicContact CG-CD2 3.92Å; P231-W244 HydrophobicContact CG-CG 3.88Å; I235-W244 HydrophobicContact CD1-CH2 3.97Å; I235-W244 HydrophobicContact CD1-CZ3 4.47Å; I235-W244 HydrophobicContact CG1-CH2 4.34Å; I235-W244 WeakPolarHBondContact O-CZ2 3.15Å; R236-W244 PolarHBondContact O-NE1 2.94Å; K239-W244 HydrophobicContact CB-CD2 4.24Å; K239-W244 HydrophobicContact CB-CZ2 3.84Å; K239-W244 HydrophobicContact CD-CE3 4.42Å; K239-W244 HydrophobicContact CD-CH2 4.12Å; K239-W244 HydrophobicContact CD-CZ2 4.24Å; K239-W244 HydrophobicContact CD-CZ3 4.21Å; K239-W244 HydrophobicContact CG-CH2 4.16Å; K239-W244 HydrophobicContact CG-CZ2 3.87Å; K239-W244 PolarHBondContact O-NE1 3.21Å; N240-W244 VanDerWaalsContact O-CD1 3.23Å; N240-W244 PolarHBondContact O-N 3.23Å; N240-W244 VanDerWaalsContact O-N 3.15Å; E241-W244 PolarHBondContact O-N 2.96Å; W244-I247 HydrophobicContact CE3-CD1 3.62Å; W244-I247 HydrophobicContact CZ3-CD1 3.91Å; W244-I247 PolarHBondContact O-N 3.48Å; W244-L248 PolarHBondContact O-N 2.81Å; W244-L248 VanDerWaalsContact O-N 3.14Å
245	Q	91.6	Very high	88.4	Confident	86 Å²	86	79.1 Å²	79.1	40%	0.402	39%	0.386	S	S	.	.	H	α-helix	trans	-70.3	-33	174.4	-62.1	-58.1	-35.2	0	0	112.4	E241 A242 L248 A249	E241-Q245 VanDerWaalsContact O-CG 3.31Å; E241-Q245 WeakPolarHBondContact O-CG 3.31Å; E241-Q245 PolarHBondContact O-N 3.44Å; E241-Q245 PolarHBondContact OE1-NE2 2.68Å; A242-Q245 PolarHBondContact O-N 2.95Å; Q245-L248 PolarHBondContact O-N 2.75Å; Q245-A249 PolarHBondContact O-N 2.68Å
246	E	92.8	Very high	87.4	Confident	106 Å²	106	84.2 Å²	84.2	50%	0.495	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-38.3	173.1	-167.8	-171.6	141.2	0	0	111.8	A242 E243 A249 K250	A242-E246 WeakPolarHBondContact O-CB 3.33Å; A242-E246 PolarHBondContact O-N 3.01Å; E243-E246 PolarHBondContact O-N 3.4Å; E246-A249 WeakPolarHBondContact O-CB 3.28Å; E246-A249 PolarHBondContact O-N 3.19Å; E246-K250 WeakPolarHBondContact O-CG 3.46Å; E246-K250 PolarHBondContact O-N 3.05Å; E246-K250 VanDerWaalsContact O-N 3.1Å; E246-K250 VanDerWaalsContact OE1-CE 3.24Å; E246-K250 WeakPolarHBondContact OE1-CE 3.26Å; E246-K250 IonicContact OE1-NZ 3.89Å; E246-K250 PolarHBondContact OE1-NZ 3.34Å
247	I	91.8	Very high	86.5	Confident	22 Å²	22	86.4 Å²	86.4	11%	0.113	42%	0.424	C	S	.	.	H	α-helix	trans	-61.5	-48.3	172.4	-68.5	154.9	0	0	0	110.4	W180 E197 K239 E243 W244 A249 K250 V251	W180-I247 HydrophobicContact CZ2-CG2 4.4Å; E197-I247 HydrophobicContact CG-CG2 4.04Å; K239-I247 HydrophobicContact CD-CD1 3.96Å; E243-I247 WeakPolarHBondContact O-CD1 3.46Å; E243-I247 WeakPolarHBondContact O-CG1 3.28Å; E243-I247 PolarHBondContact O-N 2.87Å; W244-I247 HydrophobicContact CE3-CD1 3.62Å; W244-I247 HydrophobicContact CZ3-CD1 3.91Å; W244-I247 PolarHBondContact O-N 3.48Å; I247-A249 PolarHBondContact O-N 2.74Å; I247-K250 PolarHBondContact O-N 3.07Å; I247-V251 WeakPolarHBondContact O-CG2 3.34Å; I247-V251 PolarHBondContact O-N 2.88Å; I247-V251 VanDerWaalsContact O-N 3.12Å
248	L	90.6	Very high	85.9	Confident	10 Å²	10	84 Å²	84	5%	0.052	42%	0.421	C	S	.	.	H	α-helix	trans	-64.8	-22.5	176.5	-70.4	179.6	0	0	0	114.1	W180 I181 L229 W244 Q245 K252	W180-L248 HydrophobicContact CH2-CD1 3.8Å; W180-L248 HydrophobicContact CH2-CD2 3.76Å; W180-L248 HydrophobicContact CH2-CG 3.55Å; W180-L248 HydrophobicContact CZ2-CD2 4.29Å; W180-L248 HydrophobicContact CZ2-CG 4.34Å; W180-L248 HydrophobicContact CZ3-CD1 3.75Å; W180-L248 HydrophobicContact CZ3-CD2 3.89Å; W180-L248 HydrophobicContact CZ3-CG 3.92Å; I181-L248 HydrophobicContact CD1-CD2 4Å; L229-L248 HydrophobicContact CB-CD1 4.28Å; L229-L248 HydrophobicContact CB-CD2 4.21Å; L229-L248 HydrophobicContact CD1-CD2 3.97Å; W244-L248 PolarHBondContact O-N 2.81Å; W244-L248 VanDerWaalsContact O-N 3.14Å; Q245-L248 PolarHBondContact O-N 2.75Å; L248-K252 VanDerWaalsContact O-CD 3.22Å; L248-K252 WeakPolarHBondContact O-CD 3.25Å; L248-K252 WeakPolarHBondContact O-CE 3.42Å; L248-K252 VanDerWaalsContact O-CG 3.26Å; L248-K252 WeakPolarHBondContact O-CG 3.24Å
249	A	90.3	Very high	85.6	Confident	43 Å²	43	81.3 Å²	81.3	36%	0.355	41%	0.407	S	S	.	.	H	α-helix	trans	-73.2	-49.9	172.1	0	0	0	0	0	110.8	Q245 E246 I247 V251 K252 E253	Q245-A249 PolarHBondContact O-N 2.68Å; E246-A249 WeakPolarHBondContact O-CB 3.28Å; E246-A249 PolarHBondContact O-N 3.19Å; I247-A249 PolarHBondContact O-N 2.74Å; A249-V251 PolarHBondContact O-N 3.11Å; A249-K252 WeakPolarHBondContact O-CA 3.49Å; A249-K252 WeakPolarHBondContact O-CB 2.94Å; A249-K252 PolarHBondContact O-N 3.02Å; A249-E253 PolarHBondContact O-N 3.16Å; A249-E253 VanDerWaalsContact O-N 3.09Å
250	K	89.6	Confident	84.8	Confident	94 Å²	94	79.7 Å²	79.7	41%	0.409	40%	0.402	S	S	.	.	H	α-helix	trans	-57.8	-45.2	179.4	-69.8	168.1	-174.9	166.3	0	112.6	E246 I247 K252 E253 E254	E246-K250 WeakPolarHBondContact O-CG 3.46Å; E246-K250 PolarHBondContact O-N 3.05Å; E246-K250 VanDerWaalsContact O-N 3.1Å; E246-K250 VanDerWaalsContact OE1-CE 3.24Å; E246-K250 WeakPolarHBondContact OE1-CE 3.26Å; E246-K250 IonicContact OE1-NZ 3.89Å; E246-K250 PolarHBondContact OE1-NZ 3.34Å; I247-K250 PolarHBondContact O-N 3.07Å; K250-K252 PolarHBondContact O-N 2.95Å; K250-K252 VanDerWaalsContact O-N 3.12Å; K250-E253 PolarHBondContact O-N 3.07Å; K250-E254 WeakPolarHBondContact O-CG 3.27Å; K250-E254 PolarHBondContact O-N 3.27Å
251	V	86.8	Confident	84.2	Confident	24 Å²	24	79.1 Å²	79.1	15%	0.145	40%	0.404	C	S	.	.	H	α-helix	trans	-64.7	-16.9	177.8	-176.3	0	0	0	0	112.8	I181 E197 I247 A249	I181-V251 HydrophobicContact CD1-CB 4.27Å; I181-V251 HydrophobicContact CD1-CG1 3.67Å; E197-V251 HydrophobicContact CG-CG2 3.83Å; I247-V251 WeakPolarHBondContact O-CG2 3.34Å; I247-V251 PolarHBondContact O-N 2.88Å; I247-V251 VanDerWaalsContact O-N 3.12Å; A249-V251 PolarHBondContact O-N 3.11Å
252	K	84.4	Confident	83.4	Confident	155 Å²	155	77 Å²	77	67%	0.674	39%	0.393	S	S	*	.	H	α-helix	trans	-94.2	-18.5	173.2	-67.8	169.2	-170.6	166.9	0	113.6	L248 A249 K250	L248-K252 VanDerWaalsContact O-CD 3.22Å; L248-K252 WeakPolarHBondContact O-CD 3.25Å; L248-K252 WeakPolarHBondContact O-CE 3.42Å; L248-K252 VanDerWaalsContact O-CG 3.26Å; L248-K252 WeakPolarHBondContact O-CG 3.24Å; A249-K252 WeakPolarHBondContact O-CA 3.49Å; A249-K252 WeakPolarHBondContact O-CB 2.94Å; A249-K252 PolarHBondContact O-N 3.02Å; K250-K252 PolarHBondContact O-N 2.95Å; K250-K252 VanDerWaalsContact O-N 3.12Å
253	E	83.8	Confident	82.7	Confident	155 Å²	155	74.1 Å²	74.1	72%	0.724	37%	0.368	S	S	*	.	H	α-helix	trans	-86.2	-26.8	173.1	-69	178.8	175	0	0	111.6	A249 K250 E255	A249-E253 PolarHBondContact O-N 3.16Å; A249-E253 VanDerWaalsContact O-N 3.09Å; K250-E253 PolarHBondContact O-N 3.07Å; E253-E255 PolarHBondContact O-N 3.29Å
254	E	80	Confident	82.2	Confident	97 Å²	97	70.9 Å²	70.9	45%	0.453	35%	0.353	S	S	.	.	S	Bend	trans	-80.5	94.3	173.3	-69.5	172.8	-166.2	0	0	110.8	R167 K250 E256	R167-E254 IonicContact CZ-OE2 3.22Å; R167-E254 IonicContact NH1-OE2 2.73Å; R167-E254 PolarHBondContact NH1-OE2 3.09Å; R167-E254 IonicContact NH2-OE2 2.9Å; R167-E254 PolarHBondContact NH2-OE2 3.01Å; K250-E254 WeakPolarHBondContact O-CG 3.27Å; K250-E254 PolarHBondContact O-N 3.27Å; E254-E256 PolarHBondContact O-N 2.86Å
255	E	63.3	Low	81.5	Confident	197 Å²	197	75.4 Å²	75.4	92%	0.921	37%	0.373	S	S	*	.			trans	-68.9	62.6	177.1	-65.4	-171.1	139.2	0	0	113.4	E253	E253-E255 PolarHBondContact O-N 3.29Å
256	E	69.1	Low	80.9	Confident	108 Å²	108	74.2 Å²	74.2	51%	0.505	37%	0.369	S	S	.	.			trans	-79.1	133.8	169.4	-68.2	-167.9	124.5	0	0	111.7	R167 E254 P258	R167-E256 IonicContact CZ-OE2 3.83Å; R167-E256 IonicContact NE-OE2 2.62Å; R167-E256 IonicContact NH1-OE2 2.7Å; R167-E256 PolarHBondContact NH1-OE2 3.18Å; E254-E256 PolarHBondContact O-N 2.86Å; E256-P258 VanDerWaalsContact O-CD 3.27Å; E256-P258 WeakPolarHBondContact O-CD 3.39Å
257	E	70.2	Confident	80.5	Confident	148 Å²	148	70.8 Å²	70.8	69%	0.692	35%	0.353	S	S	*	.			trans	-64.2	113.9	172.8	-74.1	-173.8	154.9	0	0	110.8	R153	R153-E257 IonicContact CZ-OE2 3.53Å; R153-E257 IonicContact NE-OE2 2.85Å; R153-E257 VanDerWaalsContact NH2-CB 3.33Å; R153-E257 IonicContact NH2-OE2 2.7Å; R153-E257 PolarHBondContact NH2-OE2 2.96Å
258	P	77.3	Confident	80	Confident	82 Å²	82	73.8 Å²	73.8	53%	0.532	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-63.2	155.5	-176.8	26.4	-35.2	0	0	0	112.3	V219 E256	V219-P258 HydrophobicContact CB-CB 4.34Å; E256-P258 VanDerWaalsContact O-CD 3.27Å; E256-P258 WeakPolarHBondContact O-CD 3.39Å
259	L	81.9	Confident	79.8	Confident	10 Å²	10	79.8 Å²	79.8	5%	0.052	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-61.9	127.3	174.4	-77.9	175.1	0	0	0	110.5	L161 I162 L168 S261 L263	L161-L259 VanDerWaalsContact O-CD2 3.29Å; L161-L259 WeakPolarHBondContact O-CD2 3.48Å; I162-L259 HydrophobicContact CB-CD1 4.38Å; I162-L259 HydrophobicContact CG1-CD1 4.1Å; I162-L259 HydrophobicContact CG1-CD2 4.32Å; I162-L259 HydrophobicContact CG2-CD1 4.06Å; L168-L259 HydrophobicContact CD1-CD1 4.37Å; L168-L259 HydrophobicContact CD2-CB 4.23Å; L168-L259 HydrophobicContact CD2-CD1 3.62Å; L168-L259 HydrophobicContact CG-CD1 3.99Å; L259-S261 PolarHBondContact O-N 3.11Å; L259-L263 HydrophobicContact CB-CD1 4.17Å; L259-L263 HydrophobicContact CD2-CD1 3.99Å
260	P	76.1	Confident	79.7	Confident	21 Å²	21	79 Å²	79	14%	0.136	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-59.1	132.1	-175.5	-26.8	34.5	0	0	0	112.7	P147 Y262 L263	P147-P260 HydrophobicContact CB-CG 4.17Å; P147-P260 HydrophobicContact CG-CG 4.24Å; P260-Y262 HydrophobicContact CB-CD1 3.45Å; P260-Y262 VanDerWaalsContact CB-CD1 3.45Å; P260-Y262 HydrophobicContact CB-CE1 3.27Å; P260-Y262 HydrophobicContact CB-CG 4.33Å; P260-Y262 HydrophobicContact CG-CE1 3.86Å; P260-Y262 PolarHBondContact O-N 3.04Å; P260-L263 VanDerWaalsContact O-CB 3.3Å; P260-L263 WeakPolarHBondContact O-CB 3.39Å; P260-L263 WeakPolarHBondContact O-CG 3.21Å; P260-L263 PolarHBondContact O-N 3.11Å
261	S	78.9	Confident	79.6	Confident	74 Å²	74	75.7 Å²	75.7	52%	0.517	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-58.4	-25.3	-178	55.6	0	0	0	0	114	L259 L263 F264	L259-S261 PolarHBondContact O-N 3.11Å; S261-L263 PolarHBondContact O-N 3.29Å; S261-L263 VanDerWaalsContact O-N 3.17Å; S261-F264 PolarHBondContact O-N 2.99Å
262	Y	75.3	Confident	80	Confident	33 Å²	33	80.1 Å²	80.1	13%	0.129	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-62.9	-18.6	175.2	77.4	-105.8	0	0	0	113.7	P145 P147 L148 L161 P260 F264 K265	P145-Y262 HydrophobicContact CB-CD1 3.57Å; P145-Y262 HydrophobicContact CB-CE1 3.76Å; P145-Y262 HydrophobicContact CB-CG 4.1Å; P145-Y262 HydrophobicContact CG-CD1 3.96Å; P145-Y262 HydrophobicContact CG-CD2 4.44Å; P145-Y262 HydrophobicContact CG-CE1 4.47Å; P145-Y262 HydrophobicContact CG-CG 3.96Å; P147-Y262 HydrophobicContact CB-CE1 4.05Å; P147-Y262 HydrophobicContact CG-CE1 4.04Å; L148-Y262 HydrophobicContact CD1-CE2 4.33Å; L148-Y262 HydrophobicContact CD2-CE2 3.76Å; L148-Y262 VanDerWaalsContact CD2-OH 3.29Å; L148-Y262 WeakPolarHBondContact CD2-OH 3.35Å; L148-Y262 HydrophobicContact CG-CE2 3.95Å; L161-Y262 WeakPolarHBondContact CD1-OH 3.38Å; P260-Y262 HydrophobicContact CB-CD1 3.45Å; P260-Y262 VanDerWaalsContact CB-CD1 3.45Å; P260-Y262 HydrophobicContact CB-CE1 3.27Å; P260-Y262 HydrophobicContact CB-CG 4.33Å; P260-Y262 HydrophobicContact CG-CE1 3.86Å; P260-Y262 PolarHBondContact O-N 3.04Å; Y262-F264 PolarHBondContact O-N 2.85Å; Y262-K265 VanDerWaalsContact O-CB 3.31Å; Y262-K265 WeakPolarHBondContact O-CB 3.41Å; Y262-K265 VanDerWaalsContact O-CG 3.23Å; Y262-K265 WeakPolarHBondContact O-CG 3.33Å; Y262-K265 PolarHBondContact O-N 3.11Å
263	L	77.7	Confident	80.5	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-61.9	-24.2	173.3	-68.3	177.3	0	0	0	112.5	P158 L161 I162 Y211 L259 P260 S261	P158-L263 HydrophobicContact CB-CD2 3.6Å; P158-L263 WeakPolarHBondContact O-CD2 3.11Å; L161-L263 HydrophobicContact CB-CD1 4.32Å; L161-L263 HydrophobicContact CD1-CD2 4.27Å; I162-L263 HydrophobicContact CD1-CD1 4.46Å; I162-L263 HydrophobicContact CG1-CD1 4.03Å; Y211-L263 WeakPolarHBondContact CE2-O 3.18Å; L259-L263 HydrophobicContact CB-CD1 4.17Å; L259-L263 HydrophobicContact CD2-CD1 3.99Å; P260-L263 VanDerWaalsContact O-CB 3.3Å; P260-L263 WeakPolarHBondContact O-CB 3.39Å; P260-L263 WeakPolarHBondContact O-CG 3.21Å; P260-L263 PolarHBondContact O-N 3.11Å; S261-L263 PolarHBondContact O-N 3.29Å; S261-L263 VanDerWaalsContact O-N 3.17Å
264	F	82.9	Confident	81	Confident	18 Å²	18	69.7 Å²	69.7	8%	0.079	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-104	12	-178.9	-53.6	-86	0	0	0	112.1	L168 Y211 H218 S261 Y262 D266 K267	L168-F264 HydrophobicContact CD1-CZ 4.28Å; L168-F264 HydrophobicContact CD2-CE2 4.11Å; L168-F264 HydrophobicContact CD2-CZ 3.55Å; Y211-F264 WeakPolarHBondContact O-CD1 3.42Å; Y211-F264 VanDerWaalsContact O-CE1 3.22Å; Y211-F264 WeakPolarHBondContact O-CE1 3.48Å; H218-F264 HydrophobicContact CB-CD2 4.07Å; H218-F264 HydrophobicContact CB-CE2 3.95Å; S261-F264 PolarHBondContact O-N 2.99Å; Y262-F264 PolarHBondContact O-N 2.85Å; F264-D266 PolarHBondContact O-N 3.33Å; F264-K267 WeakPolarHBondContact O-CB 3.24Å; F264-K267 PolarHBondContact O-N 3.18Å
265	K	76.8	Confident	81.9	Confident	96 Å²	96	65.4 Å²	65.4	42%	0.417	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-31.2	-176.9	74.5	179.7	-177.8	149.4	0	113.1	G49 Y262 K267	G49-K265 PolarHBondContact O-NZ 3.18Å; Y262-K265 VanDerWaalsContact O-CB 3.31Å; Y262-K265 WeakPolarHBondContact O-CB 3.41Å; Y262-K265 VanDerWaalsContact O-CG 3.23Å; Y262-K265 WeakPolarHBondContact O-CG 3.33Å; Y262-K265 PolarHBondContact O-N 3.11Å; K265-K267 VanDerWaalsContact C-N 3.32Å
266	D	78.8	Confident	83.5	Confident	61 Å²	61	58.9 Å²	58.9	33%	0.326	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	10	-175.3	-48.9	-64.7	0	0	0	112.3	T44 L212 F264	T44-D266 HydrophobicContact CG2-CB 3.51Å; L212-D266 HydrophobicContact CD1-CB 4.39Å; L212-D266 HydrophobicContact CD2-CB 4.48Å; F264-D266 PolarHBondContact O-N 3.33Å
267	K	84.7	Confident	84.8	Confident	34 Å²	34	57.8 Å²	57.8	15%	0.148	32%	0.322	C	S	.	.	S	Bend	trans	-68.6	140.5	176.1	179.7	167.7	177.2	169.6	0	110.5	L212 D213 P214 L216 H217 F264 K265 V269	L212-K267 HydrophobicContact CD2-CB 4.42Å; D213-K267 WeakPolarHBondContact O-CE 3.46Å; D213-K267 PolarHBondContact O-NZ 3.07Å; P214-K267 VanDerWaalsContact C-NZ 3.28Å; P214-K267 VanDerWaalsContact CA-CE 3.47Å; P214-K267 WeakPolarHBondContact O-CE 3.44Å; P214-K267 PolarHBondContact O-NZ 3.22Å; L216-K267 PolarHBondContact O-NZ 3.26Å; H217-K267 PolarHBondContact CE1-NZ 3.08Å; H217-K267 PolarHBondContact ND1-NZ 2.69Å; F264-K267 WeakPolarHBondContact O-CB 3.24Å; F264-K267 PolarHBondContact O-N 3.18Å; K265-K267 VanDerWaalsContact C-N 3.32Å; K267-V269 PolarHBondContact O-N 2.97Å
268	Q	81.6	Confident	86.1	Confident	85 Å²	85	54.7 Å²	54.7	40%	0.397	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-62.1	128.4	-179	-172.7	175.2	10.6	0	0	111.3	I270	Q268-I270 PolarHBondContact O-N 2.79Å
269	V	85.4	Confident	87	Confident	136 Å²	136	51.8 Å²	51.8	82%	0.824	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-76.1	117.8	172	-179.3	0	0	0	0	108.6	K267	K267-V269 PolarHBondContact O-N 2.97Å
270	I	89.6	Confident	87.8	Confident	25 Å²	25	51.7 Å²	51.7	13%	0.128	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-73.1	126.9	-177.1	-65.7	170.8	0	0	0	111	P214 Q268 K304 Y305 H326	P214-I270 HydrophobicContact CB-CD1 4.21Å; Q268-I270 PolarHBondContact O-N 2.79Å; I270-K304 HydrophobicContact CG2-CB 3.96Å; I270-K304 HydrophobicContact CG2-CG 4.31Å; I270-Y305 HydrophobicContact CD1-CE1 3.78Å; I270-Y305 VanDerWaalsContact CD1-OH 3.25Å; I270-Y305 WeakPolarHBondContact CD1-OH 3.26Å; I270-H326 HydrophobicContact CG2-CB 3.49Å; I270-H326 VanDerWaalsContact CG2-CB 3.49Å
271	G	87.9	Confident	88.8	Confident	26 Å²	26	50.7 Å²	50.7	27%	0.268	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-74	158.9	175.7	0	0	0	0	0	114.5	D328	G271-D328 PolarHBondContact N-OD2 2.82Å; G271-D328 VanDerWaalsContact N-OD2 3.09Å
272	I	93.7	Very high	89.7	Confident	116 Å²	116	47.3 Å²	47.3	60%	0.595	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-75.1	133.9	170.4	-65.7	172.7	0	0	0	109.2	E303	I272-E303 WeakPolarHBondContact CA-O 3.44Å; I272-E303 HydrophobicContact CG1-CG 4.16Å; I272-E303 HydrophobicContact CG2-CB 4.25Å
273	H	95.3	Very high	90.8	Very high	18 Å²	18	45.7 Å²	45.7	8%	0.083	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-101.5	165.6	-178.8	70.2	47.9	0	0	0	114	F275 D302 E303 K304 Y305 F306 A327	H273-F275 HydrophobicContact CB-CD2 4.07Å; H273-D302 PolarHBondContact CE1-O 2.81Å; H273-E303 PolarHBondContact N-O 3.46Å; H273-K304 PolarHBondContact CD2-O 2.85Å; H273-Y305 PolarHBondContact NE2-O 3.04Å; H273-F306 HydrophobicContact CB-CE1 4.4Å; H273-F306 AromaticContact CD2-CD1 3.27Å; H273-F306 WeakPolarHBondContact CD2-CD1 3.43Å; H273-F306 AromaticContact CD2-CE1 3.81Å; H273-F306 AromaticContact NE2-CD1 3.58Å; H273-A327 HydrophobicContact CB-CB 3.99Å
274	T	95.7	Very high	91.6	Very high	73 Å²	73	46 Å²	46	45%	0.448	25%	0.254	S	S	.	.			trans	-120.9	21.1	172.4	64	0	0	0	0	114.3	C374	T274-C374 PolarHBondContact O-SG 3.49Å; T274-C374 VanDerWaalsContact O-SG 3.41Å; T274-C374 PolarHBondContact OG1-SG 2.86Å
275	F	97.1	Very high	92.1	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.035	25%	0.254	C	S	.	.			trans	-67.6	159.7	172.3	-70.9	-80.7	0	0	0	112	H273 M279 L281 V297 F306 I332 A370 C374 F375	H273-F275 HydrophobicContact CB-CD2 4.07Å; F275-M279 HydrophobicContact CD1-SD 4.4Å; F275-L281 HydrophobicContact CD1-CD2 4.3Å; F275-L281 HydrophobicContact CE1-CD2 3.82Å; F275-V297 HydrophobicContact CB-CG2 4.36Å; F275-V297 HydrophobicContact CD1-CG2 3.96Å; F275-V297 HydrophobicContact CG-CG2 4.43Å; F275-F306 HydrophobicContact CB-CD2 4.24Å; F275-F306 HydrophobicContact CB-CE2 4.33Å; F275-F306 HydrophobicContact CB-CG 4.34Å; F275-F306 HydrophobicContact CD1-CE2 4.21Å; F275-F306 HydrophobicContact CD1-CZ 4.45Å; F275-F306 HydrophobicContact CD2-CD1 4.13Å; F275-F306 HydrophobicContact CD2-CD2 4.35Å; F275-F306 AromaticContact CD2-CE1 3.45Å; F275-F306 HydrophobicContact CD2-CE1 3.45Å; F275-F306 VanDerWaalsContact CD2-CE1 3.45Å; F275-F306 AromaticContact CD2-CE2 3.7Å; F275-F306 HydrophobicContact CD2-CE2 3.7Å; F275-F306 AromaticContact CD2-CZ 3.2Å; F275-F306 HydrophobicContact CD2-CZ 3.2Å; F275-F306 HydrophobicContact CE1-CE2 4.47Å; F275-F306 AromaticContact CE2-CE1 3.85Å; F275-F306 HydrophobicContact CE2-CE1 3.85Å; F275-F306 HydrophobicContact CE2-CE2 4.01Å; F275-F306 AromaticContact CE2-CZ 3.32Å; F275-F306 HydrophobicContact CE2-CZ 3.32Å; F275-F306 HydrophobicContact CG-CD2 4.23Å; F275-F306 HydrophobicContact CG-CE1 4.24Å; F275-F306 AromaticContact CG-CE2 3.83Å; F275-F306 HydrophobicContact CG-CE2 3.83Å; F275-F306 AromaticContact CG-CZ 3.83Å; F275-F306 HydrophobicContact CG-CZ 3.83Å; F275-F306 HydrophobicContact CZ-CE2 4.38Å; F275-F306 HydrophobicContact CZ-CZ 4.01Å; F275-I332 HydrophobicContact CE2-CD1 4.25Å; F275-I332 HydrophobicContact CZ-CD1 4.06Å; F275-A370 HydrophobicContact CD1-CB 4.22Å; F275-A370 HydrophobicContact CE1-CB 3.86Å; F275-C374 HydrophobicContact CD1-CB 4Å; F275-C374 HydrophobicContact CD2-CB 4.16Å; F275-C374 HydrophobicContact CE1-CB 3.72Å; F275-C374 HydrophobicContact CE2-CB 3.88Å; F275-C374 WeakPolarHBondContact CE2-O 3.43Å; F275-C374 HydrophobicContact CG-CB 4.21Å; F275-C374 HydrophobicContact CZ-CB 3.65Å; F275-C374 WeakPolarHBondContact CZ-O 3.46Å; F275-F375 AromaticContact CE1-CE1 3.95Å; F275-F375 HydrophobicContact CE1-CE1 3.95Å; F275-F375 HydrophobicContact CE1-CE2 4.01Å; F275-F375 AromaticContact CE1-CZ 3.6Å; F275-F375 HydrophobicContact CE1-CZ 3.6Å; F275-F375 AromaticContact CZ-CD1 3.94Å; F275-F375 HydrophobicContact CZ-CD1 3.94Å; F275-F375 HydrophobicContact CZ-CD2 4.4Å; F275-F375 AromaticContact CZ-CE1 3.62Å; F275-F375 HydrophobicContact CZ-CE1 3.62Å; F275-F375 HydrophobicContact CZ-CE2 4.11Å; F275-F375 HydrophobicContact CZ-CG 4.32Å; F275-F375 AromaticContact CZ-CZ 3.71Å; F275-F375 HydrophobicContact CZ-CZ 3.71Å
276	S	96.8	Very high	92.7	Very high	59 Å²	59	44.3 Å²	44.3	41%	0.413	25%	0.254	S	S	.	.			trans	-144.2	154.7	176.7	-59.9	0	0	0	0	110	M279 V297	S276-M279 PolarHBondContact N-SD 3.12Å; S276-M279 VanDerWaalsContact N-SD 3.41Å; S276-M279 VanDerWaalsContact O-CB 3.31Å; S276-M279 WeakPolarHBondContact O-CB 3.41Å; S276-M279 WeakPolarHBondContact O-CG 3.47Å; S276-M279 PolarHBondContact O-N 3.1Å; S276-M279 VanDerWaalsContact O-N 3.17Å; S276-V297 WeakPolarHBondContact O-CB 3.27Å; S276-V297 WeakPolarHBondContact O-CG1 3.46Å
277	V	97.3	Very high	93.1	Very high	86 Å²	86	45.8 Å²	45.8	52%	0.521	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	142.7	178.1	-178.3	0	0	0	0	110.6	M279 V297 V300	V277-M279 VanDerWaalsContact C-N 3.26Å; V277-M279 PolarHBondContact O-N 2.8Å; V277-V297 CarbonylContact C-O 3.06Å; V277-V297 WeakPolarHBondContact CA-O 3.26Å; V277-V300 HydrophobicContact CG2-CG2 4.13Å
278	N	96.6	Very high	93.4	Very high	82 Å²	82	46.1 Å²	46.1	44%	0.439	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	12	-173.6	-160.8	48.8	0	0	0	115.4	V297	N278-V297 PolarHBondContact N-O 3.29Å
279	M	97.8	Very high	94	Very high	22 Å²	22	42.5 Å²	42.5	11%	0.108	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.7	163.6	-74.6	-173.3	172.4	0	0	110.8	F275 S276 V277 V297 E368 A370 P371	F275-M279 HydrophobicContact CD1-SD 4.4Å; S276-M279 PolarHBondContact N-SD 3.12Å; S276-M279 VanDerWaalsContact N-SD 3.41Å; S276-M279 VanDerWaalsContact O-CB 3.31Å; S276-M279 WeakPolarHBondContact O-CB 3.41Å; S276-M279 WeakPolarHBondContact O-CG 3.47Å; S276-M279 PolarHBondContact O-N 3.1Å; S276-M279 VanDerWaalsContact O-N 3.17Å; V277-M279 VanDerWaalsContact C-N 3.26Å; V277-M279 PolarHBondContact O-N 2.8Å; M279-V297 HydrophobicContact CB-CB 4.43Å; M279-V297 HydrophobicContact CB-CG2 4.24Å; M279-V297 PolarHBondContact O-N 3.39Å; M279-E368 CarbonylContact C-O 3.59Å; M279-E368 WeakPolarHBondContact CA-O 3Å; M279-A370 HydrophobicContact CB-CB 4.22Å; M279-A370 HydrophobicContact SD-CB 4.41Å; M279-P371 HydrophobicContact CE-CG 4.43Å
280	K	98.1	Very high	94.4	Very high	8 Å²	8	39 Å²	39	4%	0.035	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	138.3	173.8	-73.7	-70.4	-169.5	-178.8	0	111.5	A295 T296 D311 V335 W358 Y361 L362 A367 E368 A370	K280-A295 WeakPolarHBondContact CA-O 3.39Å; K280-T296 WeakPolarHBondContact CD-OG1 3.27Å; K280-T296 WeakPolarHBondContact CE-OG1 3.28Å; K280-T296 PolarHBondContact NZ-OG1 3.48Å; K280-D311 IonicContact NZ-OD1 2.83Å; K280-D311 PolarHBondContact NZ-OD1 3.46Å; K280-D311 IonicContact NZ-OD2 2.69Å; K280-D311 PolarHBondContact NZ-OD2 3.14Å; K280-V335 WeakPolarHBondContact O-CG2 3.43Å; K280-W358 HydrophobicContact CB-CH2 4.26Å; K280-W358 HydrophobicContact CB-CZ3 3.93Å; K280-W358 HydrophobicContact CG-CZ3 4.42Å; K280-Y361 HydrophobicContact CD-CE1 4.26Å; K280-Y361 PolarHBondContact NZ-OH 2.81Å; K280-L362 HydrophobicContact CB-CD2 3.71Å; K280-L362 HydrophobicContact CG-CD2 3.82Å; K280-A367 HydrophobicContact CG-CB 3.75Å; K280-E368 PolarHBondContact N-O 2.98Å; K280-A370 WeakPolarHBondContact O-CB 3.47Å; K280-A370 PolarHBondContact O-N 2.94Å
281	L	97.9	Very high	94.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	171.4	178.6	58	83.5	0	0	0	111.2	F275 A283 A295 V297 V308 I332 F333 W358 A370 F375	F275-L281 HydrophobicContact CD1-CD2 4.3Å; F275-L281 HydrophobicContact CE1-CD2 3.82Å; L281-A283 HydrophobicContact CD1-CB 3.88Å; L281-A295 HydrophobicContact CD1-CB 3.92Å; L281-A295 PolarHBondContact N-O 2.85Å; L281-A295 PolarHBondContact O-N 3.31Å; L281-V297 HydrophobicContact CD2-CG2 3.77Å; L281-V308 HydrophobicContact CD1-CG1 4.09Å; L281-V308 HydrophobicContact CD2-CG2 4.22Å; L281-I332 HydrophobicContact CD1-CB 4.26Å; L281-I332 HydrophobicContact CD1-CG2 4.08Å; L281-F333 WeakPolarHBondContact CB-O 3.35Å; L281-W358 WeakPolarHBondContact O-CH2 3.28Å; L281-A370 HydrophobicContact CB-CB 4.07Å; L281-F375 HydrophobicContact CB-CZ 4Å; L281-F375 HydrophobicContact CD2-CZ 4.49Å
282	E	97.5	Very high	95	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	141.1	168.8	-74.6	179.6	-159.2	0	0	109	I292 F333 Q336 W337 S338 I345 W358	E282-I292 HydrophobicContact CB-CG2 3.78Å; E282-I292 HydrophobicContact CG-CG2 4.42Å; E282-F333 HydrophobicContact CB-CB 4.11Å; E282-F333 HydrophobicContact CB-CD2 4.16Å; E282-F333 PolarHBondContact N-O 2.61Å; E282-F333 WeakPolarHBondContact O-CD2 3.49Å; E282-F333 PolarHBondContact O-N 3.46Å; E282-Q336 WeakPolarHBondContact OE1-CA 3.46Å; E282-Q336 PolarHBondContact OE1-N 3.44Å; E282-W337 PolarHBondContact OE1-N 3.36Å; E282-W337 PolarHBondContact OE2-N 3.3Å; E282-S338 VanDerWaalsContact OE2-CB 3.23Å; E282-S338 WeakPolarHBondContact OE2-CB 3.47Å; E282-S338 PolarHBondContact OE2-N 3.05Å; E282-S338 PolarHBondContact OE2-OG 2.8Å; E282-I345 HydrophobicContact CG-CD1 3.75Å; E282-W358 HydrophobicContact CG-CZ2 3.57Å; E282-W358 PolarHBondContact OE1-NE1 2.56Å
283	A	97.2	Very high	95.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	151	178.9	0	0	0	0	0	114.4	L281 I292 S293 A295 M310 F323 G331 I332	L281-A283 HydrophobicContact CD1-CB 3.88Å; A283-I292 CarbonylContact O-C 3.56Å; A283-I292 WeakPolarHBondContact O-CA 3.21Å; A283-S293 PolarHBondContact N-O 3.32Å; A283-S293 PolarHBondContact O-N 3.09Å; A283-A295 HydrophobicContact CB-CB 3.83Å; A283-M310 HydrophobicContact CB-CE 4.19Å; A283-M310 HydrophobicContact CB-SD 3.9Å; A283-F323 HydrophobicContact CB-CZ 4.17Å; A283-G331 CarbonylContact C-O 3.53Å; A283-G331 WeakPolarHBondContact CA-O 3.44Å; A283-I332 HydrophobicContact CB-CG2 4.3Å
284	V	95.8	Very high	95.2	Very high	11 Å²	11	32.6 Å²	32.6	7%	0.067	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.5	160.3	-179.5	0	0	0	0	108.5	P286 P289 I292 G331 F333 I429	V284-P286 WeakPolarHBondContact O-CD 3.46Å; V284-P289 VanDerWaalsContact CG1-CA 3.47Å; V284-P289 HydrophobicContact CG1-CB 3.57Å; V284-I292 HydrophobicContact CG2-CG1 3.89Å; V284-G331 PolarHBondContact N-O 2.78Å; V284-F333 HydrophobicContact CG2-CE2 3.95Å; V284-F333 HydrophobicContact CG2-CZ 4.12Å; V284-I429 HydrophobicContact CG1-CB 4.47Å; V284-I429 HydrophobicContact CG2-CB 4.05Å; V284-I429 HydrophobicContact CG2-CD1 4.11Å; V284-I429 HydrophobicContact CG2-CG2 3.91Å
285	D	92.5	Very high	95.3	Very high	15 Å²	15	29.1 Å²	29.1	8%	0.08	17%	0.166	C	C	.	.			trans	-76.1	117.9	171.9	177.5	-16.3	0	0	0	110.2	W287 S288 P289 M310 R321	D285-W287 PolarHBondContact O-N 3.44Å; D285-W287 VanDerWaalsContact O-N 3.14Å; D285-W287 PolarHBondContact OD1-N 2.92Å; D285-S288 CarbonylContact O-C 3.58Å; D285-S288 PolarHBondContact O-N 3.16Å; D285-S288 PolarHBondContact OD1-N 2.84Å; D285-S288 WeakPolarHBondContact OD2-CB 3.26Å; D285-P289 WeakPolarHBondContact O-CA 3.14Å; D285-P289 VanDerWaalsContact O-N 3.09Å; D285-M310 HydrophobicContact CB-CE 4.38Å; D285-M310 HydrophobicContact CB-CG 4.32Å; D285-M310 HydrophobicContact CB-SD 4.42Å; D285-R321 WeakPolarHBondContact OD2-CD 3.48Å; D285-R321 IonicContact OD2-CZ 3.35Å; D285-R321 IonicContact OD2-NE 2.69Å; D285-R321 IonicContact OD2-NH1 2.7Å; D285-R321 PolarHBondContact OD2-NH1 3.28Å
286	P	90.3	Very high	95.3	Very high	64 Å²	64	29.3 Å²	29.3	42%	0.416	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.8	-177.6	-26.3	35.6	0	0	0	114.6	V284 F323	V284-P286 WeakPolarHBondContact O-CD 3.46Å; P286-F323 HydrophobicContact CG-CB 4.26Å; P286-F323 HydrophobicContact CG-CD1 3.87Å; P286-F323 HydrophobicContact CG-CD2 4Å; P286-F323 HydrophobicContact CG-CE1 4.17Å; P286-F323 HydrophobicContact CG-CE2 4.27Å; P286-F323 HydrophobicContact CG-CG 3.79Å; P286-F323 HydrophobicContact CG-CZ 4.35Å
287	W	87.1	Confident	95.3	Very high	92 Å²	92	26.5 Å²	26.5	35%	0.348	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-1.4	178.8	-58.7	-82.7	0	0	0	113.2	F173 Q174 D285 S322 F323	F173-W287 HydrophobicContact CE2-CZ2 4.47Å; Q174-W287 HydrophobicContact CB-CH2 4.39Å; Q174-W287 HydrophobicContact CB-CZ2 4.49Å; Q174-W287 HydrophobicContact CG-CH2 4.21Å; Q174-W287 HydrophobicContact CG-CZ2 3.86Å; D285-W287 PolarHBondContact O-N 3.44Å; D285-W287 VanDerWaalsContact O-N 3.14Å; D285-W287 PolarHBondContact OD1-N 2.92Å; W287-S322 VanDerWaalsContact CH2-O 3.26Å; W287-S322 WeakPolarHBondContact CH2-O 3.44Å; W287-S322 VanDerWaalsContact CZ3-O 3.24Å; W287-S322 WeakPolarHBondContact CZ3-O 3.26Å; W287-F323 HydrophobicContact CH2-CB 3.9Å; W287-F323 HydrophobicContact CZ3-CB 3.99Å; W287-F323 HydrophobicContact CZ3-CD1 4.2Å
288	S	90.6	Very high	95.3	Very high	40 Å²	40	24.9 Å²	24.9	28%	0.28	14%	0.139	S	C	.	.	S	Bend	trans	-149.6	58	177.7	-177.8	0	0	0	0	111.6	D285 F290 R321	D285-S288 CarbonylContact O-C 3.58Å; D285-S288 PolarHBondContact O-N 3.16Å; D285-S288 PolarHBondContact OD1-N 2.84Å; D285-S288 WeakPolarHBondContact OD2-CB 3.26Å; S288-F290 PolarHBondContact O-N 3.09Å; S288-R321 VanDerWaalsContact CB-NH1 3.3Å
289	P	94.4	Very high	95.2	Very high	9 Å²	9	25.5 Å²	25.5	6%	0.058	14%	0.138	C	C	.	.			trans	-74.8	30.1	-165.3	30	-36.6	0	0	0	115.7	V284 D285 P395 Y428 I429	V284-P289 VanDerWaalsContact CG1-CA 3.47Å; V284-P289 HydrophobicContact CG1-CB 3.57Å; D285-P289 WeakPolarHBondContact O-CA 3.14Å; D285-P289 VanDerWaalsContact O-N 3.09Å; P289-P395 HydrophobicContact CG-CB 3.7Å; P289-P395 HydrophobicContact CG-CG 3.86Å; P289-Y428 HydrophobicContact CB-CD2 4.48Å; P289-Y428 HydrophobicContact CG-CD2 4.05Å; P289-Y428 HydrophobicContact CG-CG 4.45Å; P289-Y428 CarbonylContact O-C 3.5Å; P289-Y428 WeakPolarHBondContact O-CA 3.45Å; P289-Y428 WeakPolarHBondContact O-CB 3.4Å; P289-I429 PolarHBondContact O-N 2.78Å
290	F	94.2	Very high	95.2	Very high	62 Å²	62	26.8 Å²	26.8	27%	0.272	15%	0.147	S	C	.	.	S	Bend	trans	-90.4	6.1	-173.8	-47.1	-62.8	0	0	0	114	S288 L396 I425 P426	S288-F290 PolarHBondContact O-N 3.09Å; F290-L396 HydrophobicContact CE2-CD1 4.32Å; F290-L396 HydrophobicContact CE2-CD2 4.14Å; F290-L396 HydrophobicContact CE2-CG 4.48Å; F290-L396 HydrophobicContact CZ-CD1 3.91Å; F290-L396 HydrophobicContact CZ-CD2 3.96Å; F290-L396 HydrophobicContact CZ-CG 3.9Å; F290-I425 HydrophobicContact CE1-CB 4.17Å; F290-I425 HydrophobicContact CE1-CD1 4.23Å; F290-I425 HydrophobicContact CZ-CB 4.48Å; F290-P426 HydrophobicContact CB-CB 4.26Å; F290-P426 HydrophobicContact CB-CG 4.41Å; F290-P426 HydrophobicContact CD1-CB 3.78Å; F290-P426 HydrophobicContact CD1-CG 3.91Å; F290-P426 HydrophobicContact CE1-CB 4.49Å; F290-P426 HydrophobicContact CE1-CG 4.39Å; F290-P426 HydrophobicContact CG-CB 4.16Å; F290-P426 HydrophobicContact CG-CG 4.04Å
291	G	93.7	Very high	95	Very high	20 Å²	20	28.9 Å²	28.9	21%	0.206	16%	0.156	C	C	.	.	S	Bend	trans	-179.6	170	-177.5	0	0	0	0	0	112.6
292	I	95.9	Very high	94.7	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.5	176.8	-57.7	170.8	0	0	0	108	E282 A283 V284 F333 W337 S338 L343 I345 S346 I429	E282-I292 HydrophobicContact CB-CG2 3.78Å; E282-I292 HydrophobicContact CG-CG2 4.42Å; A283-I292 CarbonylContact O-C 3.56Å; A283-I292 WeakPolarHBondContact O-CA 3.21Å; V284-I292 HydrophobicContact CG2-CG1 3.89Å; I292-F333 HydrophobicContact CD1-CD2 4.45Å; I292-F333 HydrophobicContact CD1-CE2 3.83Å; I292-F333 HydrophobicContact CD1-CZ 3.93Å; I292-F333 HydrophobicContact CG1-CE2 4Å; I292-F333 HydrophobicContact CG1-CZ 4.42Å; I292-F333 HydrophobicContact CG2-CD2 4.15Å; I292-F333 HydrophobicContact CG2-CE2 4.11Å; I292-W337 HydrophobicContact CD1-CE3 3.95Å; I292-W337 HydrophobicContact CD1-CZ3 3.59Å; I292-S338 WeakPolarHBondContact CG2-OG 3.22Å; I292-L343 HydrophobicContact CD1-CD1 4.33Å; I292-I345 WeakPolarHBondContact O-CG1 3.05Å; I292-S346 PolarHBondContact O-N 2.99Å; I292-I429 HydrophobicContact CD1-CD1 4.26Å; I292-I429 HydrophobicContact CG1-CD1 3.76Å
293	S	95.6	Very high	94.6	Very high	27 Å²	27	36.7 Å²	36.7	19%	0.189	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	164.9	179.5	-53.3	0	0	0	0	110.9	A283 S346	A283-S293 PolarHBondContact N-O 3.32Å; A283-S293 PolarHBondContact O-N 3.09Å; S293-S346 WeakPolarHBondContact OG-CB 3.21Å
294	P	96.8	Very high	94.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	143.7	166	-27.6	39.1	0	0	0	112.9	D311 I345 S346 P348 F356 W358 Y361	P294-D311 HydrophobicContact CB-CB 4.15Å; P294-D311 WeakPolarHBondContact CB-OD2 3.47Å; P294-D311 WeakPolarHBondContact O-CB 3.39Å; P294-D311 PolarHBondContact O-N 3.44Å; P294-I345 HydrophobicContact CG-CD1 3.94Å; P294-S346 WeakPolarHBondContact CD-O 3.36Å; P294-P348 HydrophobicContact CG-CG 4.39Å; P294-F356 HydrophobicContact CB-CZ 4.37Å; P294-F356 HydrophobicContact CG-CE1 3.87Å; P294-F356 HydrophobicContact CG-CE2 3.77Å; P294-F356 HydrophobicContact CG-CZ 3.34Å; P294-W358 HydrophobicContact CB-CH2 3.61Å; P294-W358 HydrophobicContact CB-CZ2 3.98Å; P294-W358 HydrophobicContact CB-CZ3 4.34Å; P294-W358 HydrophobicContact CG-CH2 4Å; P294-W358 HydrophobicContact CG-CZ2 3.95Å; P294-Y361 HydrophobicContact CB-CE1 4Å; P294-Y361 HydrophobicContact CG-CE1 4.5Å
295	A	97.4	Very high	94.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	160.4	173.7	0	0	0	0	0	111	K280 L281 A283 V308 E309 M310 D311	K280-A295 WeakPolarHBondContact CA-O 3.39Å; L281-A295 HydrophobicContact CD1-CB 3.92Å; L281-A295 PolarHBondContact N-O 2.85Å; L281-A295 PolarHBondContact O-N 3.31Å; A283-A295 HydrophobicContact CB-CB 3.83Å; A295-V308 HydrophobicContact CB-CG1 3.65Å; A295-E309 CarbonylContact C-O 3.54Å; A295-E309 VanDerWaalsContact CA-O 3.27Å; A295-E309 WeakPolarHBondContact CA-O 3.16Å; A295-E309 VanDerWaalsContact CB-O 3.31Å; A295-E309 WeakPolarHBondContact CB-O 3.47Å; A295-M310 HydrophobicContact CB-CE 4.4Å; A295-M310 HydrophobicContact CB-SD 3.95Å; A295-D311 PolarHBondContact N-OD2 3.1Å
296	T	97.4	Very high	94.5	Very high	13 Å²	13	39.6 Å²	39.6	8%	0.08	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.2	-177.3	-56.2	0	0	0	0	111.1	K280 V298 V308 E309 D311	K280-T296 WeakPolarHBondContact CD-OG1 3.27Å; K280-T296 WeakPolarHBondContact CE-OG1 3.28Å; K280-T296 PolarHBondContact NZ-OG1 3.48Å; T296-V298 HydrophobicContact CG2-CG1 4.15Å; T296-V298 PolarHBondContact O-N 2.89Å; T296-V298 VanDerWaalsContact O-N 3.12Å; T296-V308 WeakPolarHBondContact O-CA 3.47Å; T296-E309 PolarHBondContact N-O 3.37Å; T296-E309 PolarHBondContact O-N 3.47Å; T296-D311 PolarHBondContact OG1-OD1 3.15Å
297	V	97.7	Very high	94.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	100.3	163.8	-179.4	0	0	0	0	108.2	F275 S276 V277 N278 M279 L281 V300 F306 L307 V308	F275-V297 HydrophobicContact CB-CG2 4.36Å; F275-V297 HydrophobicContact CD1-CG2 3.96Å; F275-V297 HydrophobicContact CG-CG2 4.43Å; S276-V297 WeakPolarHBondContact O-CB 3.27Å; S276-V297 WeakPolarHBondContact O-CG1 3.46Å; V277-V297 CarbonylContact C-O 3.06Å; V277-V297 WeakPolarHBondContact CA-O 3.26Å; N278-V297 PolarHBondContact N-O 3.29Å; M279-V297 HydrophobicContact CB-CB 4.43Å; M279-V297 HydrophobicContact CB-CG2 4.24Å; M279-V297 PolarHBondContact O-N 3.39Å; L281-V297 HydrophobicContact CD2-CG2 3.77Å; V297-V300 HydrophobicContact CG1-CG2 4.27Å; V297-F306 HydrophobicContact CG1-CB 4.24Å; V297-F306 HydrophobicContact CG1-CD2 4Å; V297-F306 HydrophobicContact CG2-CD2 3.96Å; V297-F306 HydrophobicContact CG2-CE2 4.19Å; V297-L307 CarbonylContact C-O 3.54Å; V297-L307 WeakPolarHBondContact CA-O 3.47Å; V297-V308 HydrophobicContact CG2-CG2 4.49Å
298	V	96.1	Very high	95.3	Very high	51 Å²	51	32.9 Å²	32.9	31%	0.309	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-19.2	-175.6	-70.1	0	0	0	0	113.3	T296 L307 E309	T296-V298 HydrophobicContact CG2-CG1 4.15Å; T296-V298 PolarHBondContact O-N 2.89Å; T296-V298 VanDerWaalsContact O-N 3.12Å; V298-L307 HydrophobicContact CG2-CB 4.06Å; V298-L307 HydrophobicContact CG2-CD2 3.83Å; V298-L307 HydrophobicContact CG2-CG 3.92Å; V298-L307 PolarHBondContact N-O 2.99Å; V298-E309 HydrophobicContact CB-CB 4.33Å; V298-E309 HydrophobicContact CG1-CB 3.6Å; V298-E309 HydrophobicContact CG1-CG 4.4Å; V298-E309 HydrophobicContact CG2-CB 3.76Å
299	K	96.1	Very high	95.6	Very high	95 Å²	95	32.4 Å²	32.4	41%	0.413	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	148.5	178.2	-174.1	177.9	175.2	-175.3	0	110.4	F301 F306 L307	K299-F301 HydrophobicContact CD-CD1 4.29Å; K299-F301 HydrophobicContact CD-CE1 3.94Å; K299-F301 HydrophobicContact CD-CE2 4.44Å; K299-F301 HydrophobicContact CD-CZ 4.01Å; K299-F306 CarbonylContact O-C 3.43Å; K299-F306 WeakPolarHBondContact O-CA 3.2Å; K299-F306 WeakPolarHBondContact O-CB 3.49Å; K299-L307 HydrophobicContact CB-CB 3.84Å; K299-L307 PolarHBondContact O-N 2.84Å
300	V	97	Very high	95.6	Very high	49 Å²	49	33 Å²	33	30%	0.297	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.5	161.2	174.6	0	0	0	0	106.5	V277 V297 D302 F306	V277-V300 HydrophobicContact CG2-CG2 4.13Å; V297-V300 HydrophobicContact CG1-CG2 4.27Å; V300-D302 WeakPolarHBondContact CG1-O 3.46Å; V300-F306 HydrophobicContact CG2-CB 4.17Å
301	F	93.4	Very high	95.6	Very high	53 Å²	53	30.7 Å²	30.7	23%	0.232	16%	0.159	C	C	.	.			trans	-94.5	-49.7	178.9	-64.6	-94.2	0	0	0	110.9	L177 K299 Y305 L307 V324	L177-F301 HydrophobicContact CD1-CB 3.63Å; L177-F301 HydrophobicContact CD1-CD1 3.76Å; L177-F301 HydrophobicContact CD1-CD2 4.02Å; L177-F301 HydrophobicContact CD1-CE1 4.36Å; L177-F301 HydrophobicContact CD1-CG 3.57Å; L177-F301 HydrophobicContact CG-CD1 4.05Å; L177-F301 HydrophobicContact CG-CD2 4.38Å; L177-F301 HydrophobicContact CG-CE1 4.14Å; L177-F301 HydrophobicContact CG-CE2 4.48Å; L177-F301 HydrophobicContact CG-CG 4.18Å; L177-F301 HydrophobicContact CG-CZ 4.37Å; K299-F301 HydrophobicContact CD-CD1 4.29Å; K299-F301 HydrophobicContact CD-CE1 3.94Å; K299-F301 HydrophobicContact CD-CE2 4.44Å; K299-F301 HydrophobicContact CD-CZ 4.01Å; F301-Y305 WeakPolarHBondContact CB-O 3.49Å; F301-Y305 PolarHBondContact N-O 3.41Å; F301-L307 HydrophobicContact CE2-CB 3.85Å; F301-L307 HydrophobicContact CE2-CD1 4.49Å; F301-L307 HydrophobicContact CZ-CB 4.34Å; F301-V324 HydrophobicContact CE2-CG1 4.34Å; F301-V324 HydrophobicContact CE2-CG2 4.07Å; F301-V324 HydrophobicContact CZ-CG2 4.27Å
302	D	92.6	Very high	95.5	Very high	58 Å²	58	31.6 Å²	31.6	31%	0.31	16%	0.159	S	C	.	.	S	Bend	trans	-152.1	-151.9	-177.7	55.2	44.8	0	0	0	110.4	H273 V300 K304 Y305	H273-D302 PolarHBondContact CE1-O 2.81Å; V300-D302 WeakPolarHBondContact CG1-O 3.46Å; D302-K304 WeakPolarHBondContact OD1-CA 3.5Å; D302-K304 WeakPolarHBondContact OD1-CB 3.18Å; D302-K304 PolarHBondContact OD1-N 2.89Å; D302-Y305 PolarHBondContact N-O 3.07Å; D302-Y305 PolarHBondContact OD1-N 3.35Å
303	E	94	Very high	95.2	Very high	108 Å²	108	34.5 Å²	34.5	51%	0.505	17%	0.174	S	C	.	.	S	Bend	trans	-82.7	-12.6	178.4	72.9	-174.6	178.8	0	0	114	I272 H273	I272-E303 WeakPolarHBondContact CA-O 3.44Å; I272-E303 HydrophobicContact CG1-CG 4.16Å; I272-E303 HydrophobicContact CG2-CB 4.25Å; H273-E303 PolarHBondContact N-O 3.46Å
304	K	93.1	Very high	94.9	Very high	77 Å²	77	38.5 Å²	38.5	34%	0.335	19%	0.185	S	C	.	.	S	Bend	trans	-111.8	-33.3	-174.2	-64.3	174.9	-172.4	166.7	0	112.6	I270 H273 D302 H326	I270-K304 HydrophobicContact CG2-CB 3.96Å; I270-K304 HydrophobicContact CG2-CG 4.31Å; H273-K304 PolarHBondContact CD2-O 2.85Å; D302-K304 WeakPolarHBondContact OD1-CA 3.5Å; D302-K304 WeakPolarHBondContact OD1-CB 3.18Å; D302-K304 PolarHBondContact OD1-N 2.89Å; K304-H326 WeakPolarHBondContact O-CA 3.4Å; K304-H326 WeakPolarHBondContact O-CB 3.42Å
305	Y	95.2	Very high	93.8	Very high	10 Å²	10	44.9 Å²	44.9	4%	0.039	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.2	-170.2	-61.5	-70.1	0	0	0	114.7	Q171 L177 F215 I270 H273 F301 D302 V324 C325 H326	Q171-Y305 PolarHBondContact OE1-OH 2.64Å; L177-Y305 HydrophobicContact CD1-CD2 3.84Å; L177-Y305 HydrophobicContact CD1-CG 3.99Å; L177-Y305 HydrophobicContact CD2-CD1 4.42Å; L177-Y305 HydrophobicContact CD2-CD2 4.34Å; L177-Y305 HydrophobicContact CD2-CG 4.21Å; F215-Y305 HydrophobicContact CD1-CE1 4.41Å; F215-Y305 HydrophobicContact CE1-CD1 4.12Å; F215-Y305 AromaticContact CE1-CE1 3.69Å; F215-Y305 HydrophobicContact CE1-CE1 3.69Å; F215-Y305 HydrophobicContact CZ-CE1 4.27Å; I270-Y305 HydrophobicContact CD1-CE1 3.78Å; I270-Y305 VanDerWaalsContact CD1-OH 3.25Å; I270-Y305 WeakPolarHBondContact CD1-OH 3.26Å; H273-Y305 PolarHBondContact NE2-O 3.04Å; F301-Y305 WeakPolarHBondContact CB-O 3.49Å; F301-Y305 PolarHBondContact N-O 3.41Å; D302-Y305 PolarHBondContact N-O 3.07Å; D302-Y305 PolarHBondContact OD1-N 3.35Å; Y305-V324 HydrophobicContact CD1-CG1 4Å; Y305-V324 HydrophobicContact CG-CG1 4.44Å; Y305-C325 WeakPolarHBondContact CA-O 3.18Å; Y305-H326 HydrophobicContact CD1-CB 4.16Å; Y305-H326 HydrophobicContact CE1-CB 4.36Å
306	F	96.7	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	158.5	176	60.4	-75	0	0	0	111.2	H273 F275 V297 K299 V300 V308 V324 C325 I332	H273-F306 HydrophobicContact CB-CE1 4.4Å; H273-F306 AromaticContact CD2-CD1 3.27Å; H273-F306 WeakPolarHBondContact CD2-CD1 3.43Å; H273-F306 AromaticContact CD2-CE1 3.81Å; H273-F306 AromaticContact NE2-CD1 3.58Å; F275-F306 HydrophobicContact CB-CD2 4.24Å; F275-F306 HydrophobicContact CB-CE2 4.33Å; F275-F306 HydrophobicContact CB-CG 4.34Å; F275-F306 HydrophobicContact CD1-CE2 4.21Å; F275-F306 HydrophobicContact CD1-CZ 4.45Å; F275-F306 HydrophobicContact CD2-CD1 4.13Å; F275-F306 HydrophobicContact CD2-CD2 4.35Å; F275-F306 AromaticContact CD2-CE1 3.45Å; F275-F306 HydrophobicContact CD2-CE1 3.45Å; F275-F306 VanDerWaalsContact CD2-CE1 3.45Å; F275-F306 AromaticContact CD2-CE2 3.7Å; F275-F306 HydrophobicContact CD2-CE2 3.7Å; F275-F306 AromaticContact CD2-CZ 3.2Å; F275-F306 HydrophobicContact CD2-CZ 3.2Å; F275-F306 HydrophobicContact CE1-CE2 4.47Å; F275-F306 AromaticContact CE2-CE1 3.85Å; F275-F306 HydrophobicContact CE2-CE1 3.85Å; F275-F306 HydrophobicContact CE2-CE2 4.01Å; F275-F306 AromaticContact CE2-CZ 3.32Å; F275-F306 HydrophobicContact CE2-CZ 3.32Å; F275-F306 HydrophobicContact CG-CD2 4.23Å; F275-F306 HydrophobicContact CG-CE1 4.24Å; F275-F306 AromaticContact CG-CE2 3.83Å; F275-F306 HydrophobicContact CG-CE2 3.83Å; F275-F306 AromaticContact CG-CZ 3.83Å; F275-F306 HydrophobicContact CG-CZ 3.83Å; F275-F306 HydrophobicContact CZ-CE2 4.38Å; F275-F306 HydrophobicContact CZ-CZ 4.01Å; V297-F306 HydrophobicContact CG1-CB 4.24Å; V297-F306 HydrophobicContact CG1-CD2 4Å; V297-F306 HydrophobicContact CG2-CD2 3.96Å; V297-F306 HydrophobicContact CG2-CE2 4.19Å; K299-F306 CarbonylContact O-C 3.43Å; K299-F306 WeakPolarHBondContact O-CA 3.2Å; K299-F306 WeakPolarHBondContact O-CB 3.49Å; V300-F306 HydrophobicContact CG2-CB 4.17Å; F306-V308 HydrophobicContact CD2-CG2 3.79Å; F306-V308 HydrophobicContact CE2-CG2 3.57Å; F306-V324 CarbonylContact O-C 3.58Å; F306-V324 WeakPolarHBondContact O-CA 3.4Å; F306-C325 HydrophobicContact CD1-CB 4.15Å; F306-C325 VanDerWaalsContact CD1-O 3.29Å; F306-C325 WeakPolarHBondContact CD1-O 3.44Å; F306-C325 HydrophobicContact CD2-CB 4.03Å; F306-C325 HydrophobicContact CE1-CB 3.7Å; F306-C325 HydrophobicContact CE2-CB 3.55Å; F306-C325 HydrophobicContact CG-CB 4.32Å; F306-C325 HydrophobicContact CZ-CB 3.37Å; F306-C325 PolarHBondContact N-O 3.06Å; F306-C325 PolarHBondContact O-N 3.48Å; F306-I332 HydrophobicContact CE2-CD1 4.24Å; F306-I332 HydrophobicContact CZ-CD1 3.69Å
307	L	96.8	Very high	90.8	Very high	14 Å²	14	59 Å²	59	7%	0.073	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.6	177.8	-166.2	68.2	0	0	0	109.8	Q174 V297 V298 K299 F301 V324	Q174-L307 WeakPolarHBondContact O-CD1 3.4Å; V297-L307 CarbonylContact C-O 3.54Å; V297-L307 WeakPolarHBondContact CA-O 3.47Å; V298-L307 HydrophobicContact CG2-CB 4.06Å; V298-L307 HydrophobicContact CG2-CD2 3.83Å; V298-L307 HydrophobicContact CG2-CG 3.92Å; V298-L307 PolarHBondContact N-O 2.99Å; K299-L307 HydrophobicContact CB-CB 3.84Å; K299-L307 PolarHBondContact O-N 2.84Å; F301-L307 HydrophobicContact CE2-CB 3.85Å; F301-L307 HydrophobicContact CE2-CD1 4.49Å; F301-L307 HydrophobicContact CZ-CB 4.34Å; L307-V324 HydrophobicContact CD1-CG2 3.83Å
308	V	97.3	Very high	89.3	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136	170.9	175	0	0	0	0	108.5	L281 A295 T296 V297 F306 S322 F323 C325 I332	L281-V308 HydrophobicContact CD1-CG1 4.09Å; L281-V308 HydrophobicContact CD2-CG2 4.22Å; A295-V308 HydrophobicContact CB-CG1 3.65Å; T296-V308 WeakPolarHBondContact O-CA 3.47Å; V297-V308 HydrophobicContact CG2-CG2 4.49Å; F306-V308 HydrophobicContact CD2-CG2 3.79Å; F306-V308 HydrophobicContact CE2-CG2 3.57Å; V308-S322 CarbonylContact O-C 3.6Å; V308-S322 WeakPolarHBondContact O-CA 3.34Å; V308-S322 WeakPolarHBondContact O-CB 3.39Å; V308-F323 HydrophobicContact CB-CE2 4.28Å; V308-F323 HydrophobicContact CB-CZ 4.26Å; V308-F323 HydrophobicContact CG1-CE1 4.23Å; V308-F323 HydrophobicContact CG1-CE2 4.38Å; V308-F323 HydrophobicContact CG1-CZ 3.91Å; V308-F323 PolarHBondContact N-O 2.96Å; V308-F323 PolarHBondContact O-N 2.8Å; V308-C325 HydrophobicContact CG2-CB 4.21Å; V308-C325 VanDerWaalsContact CG2-SG 3.59Å; V308-I332 HydrophobicContact CG2-CG2 4.49Å
309	E	95.8	Very high	87.9	Confident	31 Å²	31	66.2 Å²	66.2	15%	0.145	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.4	174.7	-176.2	173.7	88.7	0	0	109.5	A295 T296 V298 R320	A295-E309 CarbonylContact C-O 3.54Å; A295-E309 VanDerWaalsContact CA-O 3.27Å; A295-E309 WeakPolarHBondContact CA-O 3.16Å; A295-E309 VanDerWaalsContact CB-O 3.31Å; A295-E309 WeakPolarHBondContact CB-O 3.47Å; T296-E309 PolarHBondContact N-O 3.37Å; T296-E309 PolarHBondContact O-N 3.47Å; V298-E309 HydrophobicContact CB-CB 4.33Å; V298-E309 HydrophobicContact CG1-CB 3.6Å; V298-E309 HydrophobicContact CG1-CG 4.4Å; V298-E309 HydrophobicContact CG2-CB 3.76Å; E309-R320 HydrophobicContact CG-CB 4.07Å; E309-R320 WeakPolarHBondContact OE1-CD 3.27Å; E309-R320 IonicContact OE1-CZ 2.66Å; E309-R320 IonicContact OE1-NE 3.13Å; E309-R320 IonicContact OE1-NH1 3.84Å; E309-R320 PolarHBondContact OE1-NH1 3Å; E309-R320 WeakPolarHBondContact OE2-CB 3.42Å; E309-R320 WeakPolarHBondContact OE2-CD 3.42Å
310	M	95.5	Very high	87.1	Confident	20 Å²	20	68.9 Å²	68.9	10%	0.099	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	130.7	176	-60.1	-53.9	-61.2	0	0	109.9	A283 D285 A295 D312 R321 F323	A283-M310 HydrophobicContact CB-CE 4.19Å; A283-M310 HydrophobicContact CB-SD 3.9Å; D285-M310 HydrophobicContact CB-CE 4.38Å; D285-M310 HydrophobicContact CB-CG 4.32Å; D285-M310 HydrophobicContact CB-SD 4.42Å; A295-M310 HydrophobicContact CB-CE 4.4Å; A295-M310 HydrophobicContact CB-SD 3.95Å; M310-D312 PolarHBondContact O-N 2.88Å; M310-R321 HydrophobicContact CB-CB 4.46Å; M310-R321 HydrophobicContact CG-CB 4.21Å; M310-R321 PolarHBondContact N-O 3.22Å; M310-F323 HydrophobicContact CG-CE1 4.27Å; M310-F323 HydrophobicContact SD-CE1 3.75Å; M310-F323 HydrophobicContact SD-CZ 4.27Å
311	D	94.3	Very high	86.7	Confident	15 Å²	15	72.3 Å²	72.3	8%	0.08	35%	0.351	C	S	.	.			trans	-69.7	122.8	-173.9	-73.4	-29.6	0	0	0	111.6	K280 P294 A295 T296 P348 P349 Y361	K280-D311 IonicContact NZ-OD1 2.83Å; K280-D311 PolarHBondContact NZ-OD1 3.46Å; K280-D311 IonicContact NZ-OD2 2.69Å; K280-D311 PolarHBondContact NZ-OD2 3.14Å; P294-D311 HydrophobicContact CB-CB 4.15Å; P294-D311 WeakPolarHBondContact CB-OD2 3.47Å; P294-D311 WeakPolarHBondContact O-CB 3.39Å; P294-D311 PolarHBondContact O-N 3.44Å; A295-D311 PolarHBondContact N-OD2 3.1Å; T296-D311 PolarHBondContact OG1-OD1 3.15Å; D311-P348 HydrophobicContact CB-CB 3.75Å; D311-P348 WeakPolarHBondContact O-CB 3.16Å; D311-P349 VanDerWaalsContact O-CD 3.32Å; D311-P349 WeakPolarHBondContact O-CD 3.31Å; D311-Y361 PolarHBondContact OD2-OH 3.2Å
312	D	91.8	Very high	86.6	Confident	38 Å²	38	70.7 Å²	70.7	20%	0.203	35%	0.347	C	S	.	.			trans	-129.4	125.7	172.8	-164.9	-20.6	0	0	0	109.3	M310 R314 H318	M310-D312 PolarHBondContact O-N 2.88Å; D312-R314 VanDerWaalsContact OD1-CB 3.28Å; D312-R314 WeakPolarHBondContact OD1-CB 3.21Å; D312-R314 VanDerWaalsContact OD1-CG 3.3Å; D312-R314 WeakPolarHBondContact OD1-CG 3.37Å; D312-R314 IonicContact OD1-CZ 3.71Å; D312-R314 PolarHBondContact OD1-N 2.76Å; D312-R314 IonicContact OD1-NE 3.26Å; D312-R314 PolarHBondContact OD1-NE 2.91Å; D312-R314 IonicContact OD1-NH2 2.7Å; D312-R314 IonicContact OD2-CZ 2.73Å; D312-R314 VanDerWaalsContact OD2-CZ 3.26Å; D312-R314 IonicContact OD2-NE 3.75Å; D312-R314 PolarHBondContact OD2-NE 2.81Å; D312-R314 VanDerWaalsContact OD2-NE 3.13Å; D312-R314 IonicContact OD2-NH2 2.65Å; D312-R314 PolarHBondContact OD2-NH2 3.2Å; D312-H318 IonicContact OD2-CD2 3.71Å
313	L	89.7	Confident	86.7	Confident	66 Å²	66	68.6 Å²	68.6	35%	0.346	34%	0.335	S	S	.	.			trans	-102	1.4	-177.1	-57.5	176.5	0	0	0	112.4	P348 P349 Y351 Y361	L313-P348 HydrophobicContact CD1-CG 3.98Å; L313-P348 HydrophobicContact CG-CB 4.47Å; L313-P348 HydrophobicContact CG-CG 4.37Å; L313-P349 WeakPolarHBondContact CA-O 3.42Å; L313-P349 WeakPolarHBondContact CB-O 3.23Å; L313-P349 PolarHBondContact N-O 3.44Å; L313-Y351 HydrophobicContact CD1-CD2 3.85Å; L313-Y351 HydrophobicContact CD1-CG 4.47Å; L313-Y361 HydrophobicContact CD1-CE2 4.04Å; L313-Y361 HydrophobicContact CD2-CE2 4.3Å
314	R	88.5	Confident	86.8	Confident	111 Å²	111	63.8 Å²	63.8	42%	0.419	31%	0.313	S	S	.	.			trans	-70.6	141.1	179.5	-66.3	175.7	-72.4	173.2	-6.2	110.9	D312 E316 H318 P349	D312-R314 VanDerWaalsContact OD1-CB 3.28Å; D312-R314 WeakPolarHBondContact OD1-CB 3.21Å; D312-R314 VanDerWaalsContact OD1-CG 3.3Å; D312-R314 WeakPolarHBondContact OD1-CG 3.37Å; D312-R314 IonicContact OD1-CZ 3.71Å; D312-R314 PolarHBondContact OD1-N 2.76Å; D312-R314 IonicContact OD1-NE 3.26Å; D312-R314 PolarHBondContact OD1-NE 2.91Å; D312-R314 IonicContact OD1-NH2 2.7Å; D312-R314 IonicContact OD2-CZ 2.73Å; D312-R314 VanDerWaalsContact OD2-CZ 3.26Å; D312-R314 IonicContact OD2-NE 3.75Å; D312-R314 PolarHBondContact OD2-NE 2.81Å; D312-R314 VanDerWaalsContact OD2-NE 3.13Å; D312-R314 IonicContact OD2-NH2 2.65Å; D312-R314 PolarHBondContact OD2-NH2 3.2Å; R314-E316 PolarHBondContact O-N 3.48Å; R314-H318 VanDerWaalsContact CZ-NE2 3.33Å; R314-H318 PolarHBondContact NE-CD2 2.92Å; R314-H318 VanDerWaalsContact NE-CD2 3.26Å; R314-H318 PolarHBondContact NE-NE2 2.68Å; R314-H318 PolarHBondContact NH1-CD2 3.26Å; R314-H318 PolarHBondContact NH1-NE2 3.3Å; R314-H318 VanDerWaalsContact NH1-NE2 3.13Å; R314-P349 HydrophobicContact CG-CB 4.4Å
315	P	73.6	Confident	86.9	Confident	134 Å²	134	60.2 Å²	60.2	87%	0.87	30%	0.298	S	S	*	.	S	Bend	trans	-81.3	7.1	-176.1	34.5	-37.9	0	0	0	114.4
316	E	73.9	Confident	86.8	Confident	135 Å²	135	60 Å²	60	63%	0.631	30%	0.297	S	S	*	.	S	Bend	trans	-93.9	156.5	-179.5	-67.8	-173.3	-165	0	0	112	R314 H318	R314-E316 PolarHBondContact O-N 3.48Å; E316-H318 PolarHBondContact O-N 2.85Å; E316-H318 IonicContact OE2-CE1 3.64Å; E316-H318 PolarHBondContact OE2-CE1 2.99Å; E316-H318 IonicContact OE2-ND1 2.71Å; E316-H318 IonicContact OE2-NE2 3.8Å
317	N	57.4	Low	86.5	Confident	175 Å²	175	60.5 Å²	60.5	94%	0.936	30%	0.301	S	S	*	.			trans	-73.4	60.3	171.7	-74.6	-8.2	0	0	0	111.5
318	H	66.5	Low	86.1	Confident	63 Å²	63	62.4 Å²	62.4	29%	0.292	31%	0.312	S	S	.	.			trans	-69.6	145.6	165.7	-60.6	-33.4	0	0	0	109.9	D312 R314 E316 R320	D312-H318 IonicContact OD2-CD2 3.71Å; R314-H318 VanDerWaalsContact CZ-NE2 3.33Å; R314-H318 PolarHBondContact NE-CD2 2.92Å; R314-H318 VanDerWaalsContact NE-CD2 3.26Å; R314-H318 PolarHBondContact NE-NE2 2.68Å; R314-H318 PolarHBondContact NH1-CD2 3.26Å; R314-H318 PolarHBondContact NH1-NE2 3.3Å; R314-H318 VanDerWaalsContact NH1-NE2 3.13Å; E316-H318 PolarHBondContact O-N 2.85Å; E316-H318 IonicContact OE2-CE1 3.64Å; E316-H318 PolarHBondContact OE2-CE1 2.99Å; E316-H318 IonicContact OE2-ND1 2.71Å; E316-H318 IonicContact OE2-NE2 3.8Å; H318-R320 PolarHBondContact O-N 2.98Å
319	V	67.4	Low	85.8	Confident	139 Å²	139	63 Å²	63	84%	0.842	32%	0.315	S	S	*	.			trans	-66.7	108.5	171.8	-179.7	0	0	0	0	107.8	R321	V319-R321 PolarHBondContact O-N 3.22Å
320	R	77.6	Confident	85.5	Confident	151 Å²	151	65.1 Å²	65.1	57%	0.57	33%	0.332	S	S	*	.			trans	-66.1	130.7	176.3	-61.2	-165.1	-178.1	-175.9	-1.6	109.3	E309 H318 S322	E309-R320 HydrophobicContact CG-CB 4.07Å; E309-R320 WeakPolarHBondContact OE1-CD 3.27Å; E309-R320 IonicContact OE1-CZ 2.66Å; E309-R320 IonicContact OE1-NE 3.13Å; E309-R320 IonicContact OE1-NH1 3.84Å; E309-R320 PolarHBondContact OE1-NH1 3Å; E309-R320 WeakPolarHBondContact OE2-CB 3.42Å; E309-R320 WeakPolarHBondContact OE2-CD 3.42Å; H318-R320 PolarHBondContact O-N 2.98Å; R320-S322 PolarHBondContact O-N 3.36Å
321	R	88.6	Confident	85.3	Confident	120 Å²	120	64.6 Å²	64.6	45%	0.453	33%	0.332	S	S	.	.			trans	-85.6	114.5	178.2	-66	-178.4	-177.8	169.9	-2.4	108.3	D285 S288 M310 V319	D285-R321 WeakPolarHBondContact OD2-CD 3.48Å; D285-R321 IonicContact OD2-CZ 3.35Å; D285-R321 IonicContact OD2-NE 2.69Å; D285-R321 IonicContact OD2-NH1 2.7Å; D285-R321 PolarHBondContact OD2-NH1 3.28Å; S288-R321 VanDerWaalsContact CB-NH1 3.3Å; M310-R321 HydrophobicContact CB-CB 4.46Å; M310-R321 HydrophobicContact CG-CB 4.21Å; M310-R321 PolarHBondContact N-O 3.22Å; V319-R321 PolarHBondContact O-N 3.22Å
322	S	92.4	Very high	85.4	Confident	20 Å²	20	64.2 Å²	64.2	14%	0.14	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	157.5	173.4	50.7	0	0	0	0	110.3	Q174 W287 V308 R320	Q174-S322 CarbonylContact O-C 3.58Å; W287-S322 VanDerWaalsContact CH2-O 3.26Å; W287-S322 WeakPolarHBondContact CH2-O 3.44Å; W287-S322 VanDerWaalsContact CZ3-O 3.24Å; W287-S322 WeakPolarHBondContact CZ3-O 3.26Å; V308-S322 CarbonylContact O-C 3.6Å; V308-S322 WeakPolarHBondContact O-CA 3.34Å; V308-S322 WeakPolarHBondContact O-CB 3.39Å; R320-S322 PolarHBondContact O-N 3.36Å
323	F	94.6	Very high	85.6	Confident	14 Å²	14	62.6 Å²	62.6	6%	0.061	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	146.1	177.1	51.3	-80.6	0	0	0	109.9	Q174 A283 P286 W287 V308 M310 C325 I332	Q174-F323 VanDerWaalsContact O-CA 3.27Å; Q174-F323 WeakPolarHBondContact O-CA 3.45Å; Q174-F323 PolarHBondContact O-N 2.85Å; A283-F323 HydrophobicContact CB-CZ 4.17Å; P286-F323 HydrophobicContact CG-CB 4.26Å; P286-F323 HydrophobicContact CG-CD1 3.87Å; P286-F323 HydrophobicContact CG-CD2 4Å; P286-F323 HydrophobicContact CG-CE1 4.17Å; P286-F323 HydrophobicContact CG-CE2 4.27Å; P286-F323 HydrophobicContact CG-CG 3.79Å; P286-F323 HydrophobicContact CG-CZ 4.35Å; W287-F323 HydrophobicContact CH2-CB 3.9Å; W287-F323 HydrophobicContact CZ3-CB 3.99Å; W287-F323 HydrophobicContact CZ3-CD1 4.2Å; V308-F323 HydrophobicContact CB-CE2 4.28Å; V308-F323 HydrophobicContact CB-CZ 4.26Å; V308-F323 HydrophobicContact CG1-CE1 4.23Å; V308-F323 HydrophobicContact CG1-CE2 4.38Å; V308-F323 HydrophobicContact CG1-CZ 3.91Å; V308-F323 PolarHBondContact N-O 2.96Å; V308-F323 PolarHBondContact O-N 2.8Å; M310-F323 HydrophobicContact CG-CE1 4.27Å; M310-F323 HydrophobicContact SD-CE1 3.75Å; M310-F323 HydrophobicContact SD-CZ 4.27Å; F323-C325 VanDerWaalsContact CD2-SG 3.5Å; F323-C325 WeakPolarHBondContact CE2-SG 3.38Å; F323-I332 HydrophobicContact CE2-CG2 4.2Å
324	V	95.1	Very high	85.8	Confident	7 Å²	7	59.9 Å²	59.9	4%	0.042	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	129.3	178.1	-178.4	0	0	0	0	109	F173 S176 L177 F215 F301 Y305 F306 L307	F173-V324 PolarHBondContact O-N 3.09Å; S176-V324 WeakPolarHBondContact O-CG2 3.31Å; L177-V324 HydrophobicContact CD2-CG1 3.94Å; F215-V324 HydrophobicContact CE1-CB 4.18Å; F215-V324 HydrophobicContact CE1-CG1 3.88Å; F215-V324 HydrophobicContact CZ-CB 4.13Å; F215-V324 HydrophobicContact CZ-CG1 4.06Å; F301-V324 HydrophobicContact CE2-CG1 4.34Å; F301-V324 HydrophobicContact CE2-CG2 4.07Å; F301-V324 HydrophobicContact CZ-CG2 4.27Å; Y305-V324 HydrophobicContact CD1-CG1 4Å; Y305-V324 HydrophobicContact CG-CG1 4.44Å; F306-V324 CarbonylContact O-C 3.58Å; F306-V324 WeakPolarHBondContact O-CA 3.4Å; L307-V324 HydrophobicContact CD1-CG2 3.83Å
325	C	95.3	Very high	86.2	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.007	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	157.1	175.9	-65.4	0	0	0	0	110.5	Y305 F306 V308 F323 S329 I332	Y305-C325 WeakPolarHBondContact CA-O 3.18Å; F306-C325 HydrophobicContact CD1-CB 4.15Å; F306-C325 VanDerWaalsContact CD1-O 3.29Å; F306-C325 WeakPolarHBondContact CD1-O 3.44Å; F306-C325 HydrophobicContact CD2-CB 4.03Å; F306-C325 HydrophobicContact CE1-CB 3.7Å; F306-C325 HydrophobicContact CE2-CB 3.55Å; F306-C325 HydrophobicContact CG-CB 4.32Å; F306-C325 HydrophobicContact CZ-CB 3.37Å; F306-C325 PolarHBondContact N-O 3.06Å; F306-C325 PolarHBondContact O-N 3.48Å; V308-C325 HydrophobicContact CG2-CB 4.21Å; V308-C325 VanDerWaalsContact CG2-SG 3.59Å; F323-C325 VanDerWaalsContact CD2-SG 3.5Å; F323-C325 WeakPolarHBondContact CE2-SG 3.38Å; C325-S329 WeakPolarHBondContact CA-OG 3.08Å; C325-I332 HydrophobicContact CB-CD1 4.38Å
326	H	93.9	Very high	87.2	Confident	5 Å²	5	52.8 Å²	52.8	2%	0.023	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	176.9	163.3	58.6	90.2	0	0	0	110	I270 K304 Y305 D328 S329	I270-H326 HydrophobicContact CG2-CB 3.49Å; I270-H326 VanDerWaalsContact CG2-CB 3.49Å; K304-H326 WeakPolarHBondContact O-CA 3.4Å; K304-H326 WeakPolarHBondContact O-CB 3.42Å; Y305-H326 HydrophobicContact CD1-CB 4.16Å; Y305-H326 HydrophobicContact CE1-CB 4.36Å; H326-D328 PolarHBondContact ND1-N 2.81Å; H326-D328 IonicContact ND1-OD2 2.76Å; H326-D328 PolarHBondContact O-N 3.36Å; H326-S329 PolarHBondContact CD2-OG 2.85Å; H326-S329 PolarHBondContact CE1-N 3.28Å; H326-S329 PolarHBondContact N-OG 3.31Å; H326-S329 PolarHBondContact NE2-OG 3.37Å; H326-S329 VanDerWaalsContact NE2-OG 3.09Å; H326-S329 PolarHBondContact O-N 3.05Å; H326-S329 VanDerWaalsContact O-N 3.13Å; H326-S329 PolarHBondContact O-OG 3.48Å
327	A	90.5	Very high	88.1	Confident	12 Å²	12	47 Å²	47	10%	0.099	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-44.1	-175.4	0	0	0	0	0	113	H273 P376	H273-A327 HydrophobicContact CB-CB 3.99Å; A327-P376 WeakPolarHBondContact O-CD 3.19Å
328	D	88.5	Confident	89.8	Confident	54 Å²	54	38.7 Å²	38.7	29%	0.289	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	10.4	-174.5	-39.8	-85.8	0	0	0	114.2	G271 H326	G271-D328 PolarHBondContact N-OD2 2.82Å; G271-D328 VanDerWaalsContact N-OD2 3.09Å; H326-D328 PolarHBondContact ND1-N 2.81Å; H326-D328 IonicContact ND1-OD2 2.76Å; H326-D328 PolarHBondContact O-N 3.36Å
329	S	91	Very high	91	Very high	11 Å²	11	41.9 Å²	41.9	8%	0.077	22%	0.215	C	C	.	.			trans	-63.4	133.2	-176.2	-70.7	0	0	0	0	112.5	C325 H326 I332	C325-S329 WeakPolarHBondContact CA-OG 3.08Å; H326-S329 PolarHBondContact CD2-OG 2.85Å; H326-S329 PolarHBondContact CE1-N 3.28Å; H326-S329 PolarHBondContact N-OG 3.31Å; H326-S329 PolarHBondContact NE2-OG 3.37Å; H326-S329 VanDerWaalsContact NE2-OG 3.09Å; H326-S329 PolarHBondContact O-N 3.05Å; H326-S329 VanDerWaalsContact O-N 3.13Å; H326-S329 PolarHBondContact O-OG 3.48Å; S329-I332 WeakPolarHBondContact O-CG1 3.38Å
330	P	89.6	Confident	92.2	Very high	76 Å²	76	41.4 Å²	41.4	49%	0.494	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	154.2	174	31	-35.1	0	0	0	111.2
331	G	91.8	Very high	92.8	Very high	9 Å²	9	36.4 Å²	36.4	9%	0.093	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	0.2	173.5	0	0	0	0	0	115.3	A283 V284 F333 Y413	A283-G331 CarbonylContact C-O 3.53Å; A283-G331 WeakPolarHBondContact CA-O 3.44Å; V284-G331 PolarHBondContact N-O 2.78Å; G331-F333 WeakPolarHBondContact O-CE2 3.47Å; G331-Y413 PolarHBondContact N-OH 2.69Å
332	I	95.5	Very high	93	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142.4	170.3	59.1	169.5	0	0	0	111.6	F275 L281 A283 F306 V308 F323 C325 S329 F375	F275-I332 HydrophobicContact CE2-CD1 4.25Å; F275-I332 HydrophobicContact CZ-CD1 4.06Å; L281-I332 HydrophobicContact CD1-CB 4.26Å; L281-I332 HydrophobicContact CD1-CG2 4.08Å; A283-I332 HydrophobicContact CB-CG2 4.3Å; F306-I332 HydrophobicContact CE2-CD1 4.24Å; F306-I332 HydrophobicContact CZ-CD1 3.69Å; V308-I332 HydrophobicContact CG2-CG2 4.49Å; F323-I332 HydrophobicContact CE2-CG2 4.2Å; C325-I332 HydrophobicContact CB-CD1 4.38Å; S329-I332 WeakPolarHBondContact O-CG1 3.38Å; I332-F375 HydrophobicContact CB-CE1 4.28Å; I332-F375 HydrophobicContact CD1-CE1 4.4Å; I332-F375 HydrophobicContact CG1-CD1 4.43Å; I332-F375 HydrophobicContact CG1-CE1 4.3Å
333	F	95.3	Very high	92.9	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.013	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	153.3	-174.8	-35.9	-100.3	0	0	0	112.5	L281 E282 V284 I292 G331 W337 F375 Y413	L281-F333 WeakPolarHBondContact CB-O 3.35Å; E282-F333 HydrophobicContact CB-CB 4.11Å; E282-F333 HydrophobicContact CB-CD2 4.16Å; E282-F333 PolarHBondContact N-O 2.61Å; E282-F333 WeakPolarHBondContact O-CD2 3.49Å; E282-F333 PolarHBondContact O-N 3.46Å; V284-F333 HydrophobicContact CG2-CE2 3.95Å; V284-F333 HydrophobicContact CG2-CZ 4.12Å; I292-F333 HydrophobicContact CD1-CD2 4.45Å; I292-F333 HydrophobicContact CD1-CE2 3.83Å; I292-F333 HydrophobicContact CD1-CZ 3.93Å; I292-F333 HydrophobicContact CG1-CE2 4Å; I292-F333 HydrophobicContact CG1-CZ 4.42Å; I292-F333 HydrophobicContact CG2-CD2 4.15Å; I292-F333 HydrophobicContact CG2-CE2 4.11Å; G331-F333 WeakPolarHBondContact O-CE2 3.47Å; F333-W337 HydrophobicContact CB-CB 3.55Å; F333-W337 HydrophobicContact CB-CD2 4.03Å; F333-W337 HydrophobicContact CB-CE3 4.43Å; F333-W337 HydrophobicContact CB-CG 3.64Å; F333-W337 AromaticContact CD1-CD2 3.37Å; F333-W337 HydrophobicContact CD1-CD2 3.37Å; F333-W337 AromaticContact CD1-CE2 3.53Å; F333-W337 AromaticContact CD1-CE3 3.56Å; F333-W337 HydrophobicContact CD1-CE3 3.56Å; F333-W337 AromaticContact CD1-CG 3.85Å; F333-W337 HydrophobicContact CD1-CG 3.85Å; F333-W337 HydrophobicContact CD1-CH2 4.11Å; F333-W337 AromaticContact CD1-CZ2 3.92Å; F333-W337 HydrophobicContact CD1-CZ2 3.92Å; F333-W337 AromaticContact CD1-CZ3 3.93Å; F333-W337 HydrophobicContact CD1-CZ3 3.93Å; F333-W337 AromaticContact CD1-NE1 4Å; F333-W337 HydrophobicContact CD2-CE3 4.48Å; F333-W337 AromaticContact CE1-CD2 3.96Å; F333-W337 HydrophobicContact CE1-CD2 3.96Å; F333-W337 AromaticContact CE1-CE2 3.95Å; F333-W337 AromaticContact CE1-CE3 3.78Å; F333-W337 HydrophobicContact CE1-CE3 3.78Å; F333-W337 AromaticContact CE1-CH2 3.68Å; F333-W337 HydrophobicContact CE1-CH2 3.68Å; F333-W337 AromaticContact CE1-CZ2 3.83Å; F333-W337 HydrophobicContact CE1-CZ2 3.83Å; F333-W337 AromaticContact CE1-CZ3 3.64Å; F333-W337 HydrophobicContact CE1-CZ3 3.64Å; F333-W337 HydrophobicContact CG-CB 4.32Å; F333-W337 AromaticContact CG-CD2 3.87Å; F333-W337 HydrophobicContact CG-CD2 3.87Å; F333-W337 AromaticContact CG-CE3 3.94Å; F333-W337 HydrophobicContact CG-CE3 3.94Å; F333-W337 HydrophobicContact CG-CG 4.04Å; F333-W337 HydrophobicContact CZ-CE3 4.38Å; F333-W337 HydrophobicContact CZ-CH2 4.45Å; F333-W337 HydrophobicContact CZ-CZ3 4.14Å; F333-F375 WeakPolarHBondContact O-CE1 3.21Å; F333-F375 WeakPolarHBondContact O-CZ 3.22Å; F333-Y413 HydrophobicContact CD1-CE2 4.11Å; F333-Y413 HydrophobicContact CE1-CD1 4.23Å; F333-Y413 AromaticContact CE1-CD2 3.71Å; F333-Y413 HydrophobicContact CE1-CD2 3.71Å; F333-Y413 AromaticContact CE1-CE1 3.95Å; F333-Y413 HydrophobicContact CE1-CE1 3.95Å; F333-Y413 AromaticContact CE1-CE2 3.4Å; F333-Y413 HydrophobicContact CE1-CE2 3.4Å; F333-Y413 VanDerWaalsContact CE1-CE2 3.4Å; F333-Y413 HydrophobicContact CE1-CG 4.11Å; F333-Y413 AromaticContact CE1-CZ 3.52Å; F333-Y413 HydrophobicContact CZ-CD1 4.22Å; F333-Y413 HydrophobicContact CZ-CD2 4.48Å; F333-Y413 AromaticContact CZ-CE1 3.96Å; F333-Y413 HydrophobicContact CZ-CE1 3.96Å; F333-Y413 HydrophobicContact CZ-CE2 4.25Å; F333-Y413 HydrophobicContact CZ-CG 4.47Å; F333-Y413 AromaticContact CZ-CZ 3.97Å
334	P	95.6	Very high	92.7	Very high	9 Å²	9	41.1 Å²	41.1	6%	0.058	23%	0.231	C	C	.	.			trans	-65	153.9	171.9	28.1	-35.7	0	0	0	111.4	Q336 W337 F375	P334-Q336 PolarHBondContact O-N 3.34Å; P334-W337 HydrophobicContact CG-CB 4.32Å; P334-W337 WeakPolarHBondContact O-CB 3.2Å; P334-W337 PolarHBondContact O-N 2.68Å; P334-F375 VanDerWaalsContact CA-CE2 3.47Å; P334-F375 HydrophobicContact CB-CD2 3.79Å; P334-F375 HydrophobicContact CB-CE2 3.65Å; P334-F375 HydrophobicContact CB-CZ 4.25Å; P334-F375 HydrophobicContact CG-CD2 4.22Å; P334-F375 HydrophobicContact CG-CE2 4.45Å
335	V	95.8	Very high	92.6	Very high	16 Å²	16	41.8 Å²	41.8	10%	0.097	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	138.2	175.2	164.6	0	0	0	0	111.8	K280 W337 K340 W358 A369	K280-V335 WeakPolarHBondContact O-CG2 3.43Å; V335-W337 VanDerWaalsContact C-N 3.32Å; V335-K340 PolarHBondContact O-NZ 3.46Å; V335-W358 HydrophobicContact CB-CD2 4.44Å; V335-W358 HydrophobicContact CG1-CB 4.02Å; V335-W358 HydrophobicContact CG1-CD2 3.67Å; V335-W358 HydrophobicContact CG1-CE3 4.16Å; V335-W358 HydrophobicContact CG1-CG 3.61Å; V335-W358 HydrophobicContact CG2-CD2 4.13Å; V335-W358 HydrophobicContact CG2-CE3 4.13Å; V335-W358 HydrophobicContact CG2-CH2 3.95Å; V335-W358 HydrophobicContact CG2-CZ2 3.96Å; V335-W358 HydrophobicContact CG2-CZ3 4.04Å; V335-A369 HydrophobicContact CB-CB 3.86Å; V335-A369 HydrophobicContact CG1-CB 4.22Å; V335-A369 HydrophobicContact CG2-CB 3.69Å
336	Q	94	Very high	92.5	Very high	81 Å²	81	44.1 Å²	44.1	38%	0.379	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	16.2	-171.2	-56.6	165	-16.9	0	0	115.2	E282 P334 K340	E282-Q336 WeakPolarHBondContact OE1-CA 3.46Å; E282-Q336 PolarHBondContact OE1-N 3.44Å; P334-Q336 PolarHBondContact O-N 3.34Å; Q336-K340 WeakPolarHBondContact O-CB 3.33Å; Q336-K340 WeakPolarHBondContact O-CD 3.26Å; Q336-K340 WeakPolarHBondContact O-CG 3.22Å; Q336-K340 PolarHBondContact O-N 2.93Å
337	W	93.8	Very high	92.4	Very high	13 Å²	13	45.9 Å²	45.9	5%	0.049	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-45.6	176.5	-176.7	95	0	0	0	111.8	E282 I292 F333 P334 V335 L339 K340 N341 L343 R410 Y413 W415	E282-W337 PolarHBondContact OE1-N 3.36Å; E282-W337 PolarHBondContact OE2-N 3.3Å; I292-W337 HydrophobicContact CD1-CE3 3.95Å; I292-W337 HydrophobicContact CD1-CZ3 3.59Å; F333-W337 HydrophobicContact CB-CB 3.55Å; F333-W337 HydrophobicContact CB-CD2 4.03Å; F333-W337 HydrophobicContact CB-CE3 4.43Å; F333-W337 HydrophobicContact CB-CG 3.64Å; F333-W337 AromaticContact CD1-CD2 3.37Å; F333-W337 HydrophobicContact CD1-CD2 3.37Å; F333-W337 AromaticContact CD1-CE2 3.53Å; F333-W337 AromaticContact CD1-CE3 3.56Å; F333-W337 HydrophobicContact CD1-CE3 3.56Å; F333-W337 AromaticContact CD1-CG 3.85Å; F333-W337 HydrophobicContact CD1-CG 3.85Å; F333-W337 HydrophobicContact CD1-CH2 4.11Å; F333-W337 AromaticContact CD1-CZ2 3.92Å; F333-W337 HydrophobicContact CD1-CZ2 3.92Å; F333-W337 AromaticContact CD1-CZ3 3.93Å; F333-W337 HydrophobicContact CD1-CZ3 3.93Å; F333-W337 AromaticContact CD1-NE1 4Å; F333-W337 HydrophobicContact CD2-CE3 4.48Å; F333-W337 AromaticContact CE1-CD2 3.96Å; F333-W337 HydrophobicContact CE1-CD2 3.96Å; F333-W337 AromaticContact CE1-CE2 3.95Å; F333-W337 AromaticContact CE1-CE3 3.78Å; F333-W337 HydrophobicContact CE1-CE3 3.78Å; F333-W337 AromaticContact CE1-CH2 3.68Å; F333-W337 HydrophobicContact CE1-CH2 3.68Å; F333-W337 AromaticContact CE1-CZ2 3.83Å; F333-W337 HydrophobicContact CE1-CZ2 3.83Å; F333-W337 AromaticContact CE1-CZ3 3.64Å; F333-W337 HydrophobicContact CE1-CZ3 3.64Å; F333-W337 HydrophobicContact CG-CB 4.32Å; F333-W337 AromaticContact CG-CD2 3.87Å; F333-W337 HydrophobicContact CG-CD2 3.87Å; F333-W337 AromaticContact CG-CE3 3.94Å; F333-W337 HydrophobicContact CG-CE3 3.94Å; F333-W337 HydrophobicContact CG-CG 4.04Å; F333-W337 HydrophobicContact CZ-CE3 4.38Å; F333-W337 HydrophobicContact CZ-CH2 4.45Å; F333-W337 HydrophobicContact CZ-CZ3 4.14Å; P334-W337 HydrophobicContact CG-CB 4.32Å; P334-W337 WeakPolarHBondContact O-CB 3.2Å; P334-W337 PolarHBondContact O-N 2.68Å; V335-W337 VanDerWaalsContact C-N 3.32Å; W337-L339 PolarHBondContact O-N 2.97Å; W337-K340 PolarHBondContact O-N 3.31Å; W337-N341 PolarHBondContact NE1-ND2 3.17Å; W337-N341 PolarHBondContact O-N 3.19Å; W337-N341 VanDerWaalsContact O-N 3.11Å; W337-N341 PolarHBondContact O-ND2 3.07Å; W337-L343 HydrophobicContact CE3-CD1 4.39Å; W337-L343 HydrophobicContact CH2-CD1 4.13Å; W337-L343 HydrophobicContact CZ3-CD1 3.55Å; W337-R410 HydrophobicContact CH2-CB 4.34Å; W337-Y413 HydrophobicContact CH2-CD2 4.27Å; W337-Y413 HydrophobicContact CZ2-CD2 4.13Å; W337-W415 HydrophobicContact CH2-CH2 4.35Å; W337-W415 HydrophobicContact CZ3-CH2 4.47Å
338	S	93.5	Very high	92.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.3	-50.6	178.3	-58.5	0	0	0	0	110.8	E282 I292 K340 N341 G342 L343	E282-S338 VanDerWaalsContact OE2-CB 3.23Å; E282-S338 WeakPolarHBondContact OE2-CB 3.47Å; E282-S338 PolarHBondContact OE2-N 3.05Å; E282-S338 PolarHBondContact OE2-OG 2.8Å; I292-S338 WeakPolarHBondContact CG2-OG 3.22Å; S338-K340 VanDerWaalsContact C-N 3.35Å; S338-K340 PolarHBondContact O-N 3.28Å; S338-N341 CarbonylContact O-C 3.6Å; S338-N341 PolarHBondContact O-N 3.25Å; S338-G342 PolarHBondContact O-N 3.27Å; S338-G342 VanDerWaalsContact O-N 3.15Å; S338-L343 CarbonylContact C-O 3.49Å; S338-L343 WeakPolarHBondContact O-CB 3.5Å; S338-L343 PolarHBondContact O-N 2.93Å
339	L	92.3	Very high	92.7	Very high	130 Å²	130	45.5 Å²	45.5	68%	0.681	26%	0.262	S	S	*	.	H	α-helix	trans	-59	-42.2	178.2	-177.5	62.8	0	0	0	112.4	W337 N341 G342	W337-L339 PolarHBondContact O-N 2.97Å; L339-N341 PolarHBondContact O-N 3.17Å; L339-G342 PolarHBondContact O-N 2.71Å
340	K	91.9	Very high	92.6	Very high	129 Å²	129	47.5 Å²	47.5	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-64.7	-25.5	176.7	-70.1	158.9	-167.2	154.9	0	113	V335 Q336 W337 S338	V335-K340 PolarHBondContact O-NZ 3.46Å; Q336-K340 WeakPolarHBondContact O-CB 3.33Å; Q336-K340 WeakPolarHBondContact O-CD 3.26Å; Q336-K340 WeakPolarHBondContact O-CG 3.22Å; Q336-K340 PolarHBondContact O-N 2.93Å; W337-K340 PolarHBondContact O-N 3.31Å; S338-K340 VanDerWaalsContact C-N 3.35Å; S338-K340 PolarHBondContact O-N 3.28Å
341	N	90.8	Very high	92.6	Very high	47 Å²	47	45.6 Å²	45.6	25%	0.251	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	5.1	177.6	-73.1	-88.2	0	0	0	113.5	W337 S338 L339 L343 R410	W337-N341 PolarHBondContact NE1-ND2 3.17Å; W337-N341 PolarHBondContact O-N 3.19Å; W337-N341 VanDerWaalsContact O-N 3.11Å; W337-N341 PolarHBondContact O-ND2 3.07Å; S338-N341 CarbonylContact O-C 3.6Å; S338-N341 PolarHBondContact O-N 3.25Å; L339-N341 PolarHBondContact O-N 3.17Å; N341-L343 VanDerWaalsContact C-N 3.33Å; N341-L343 HydrophobicContact CB-CD1 3.93Å; N341-L343 HydrophobicContact CB-CG 4.18Å; N341-R410 HydrophobicContact CB-CB 4.42Å
342	G	91.1	Very high	92.3	Very high	73 Å²	73	50.9 Å²	50.9	75%	0.753	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	22.9	-178.2	0	0	0	0	0	114.3	S338 L339	S338-G342 PolarHBondContact O-N 3.27Å; S338-G342 VanDerWaalsContact O-N 3.15Å; L339-G342 PolarHBondContact O-N 2.71Å
343	L	91.3	Very high	91.8	Very high	35 Å²	35	52.8 Å²	52.8	18%	0.183	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-101.6	143.9	-179.1	-59.8	166.2	0	0	0	110.8	I292 W337 S338 N341 R410 W415	I292-L343 HydrophobicContact CD1-CD1 4.33Å; W337-L343 HydrophobicContact CE3-CD1 4.39Å; W337-L343 HydrophobicContact CH2-CD1 4.13Å; W337-L343 HydrophobicContact CZ3-CD1 3.55Å; S338-L343 CarbonylContact C-O 3.49Å; S338-L343 WeakPolarHBondContact O-CB 3.5Å; S338-L343 PolarHBondContact O-N 2.93Å; N341-L343 VanDerWaalsContact C-N 3.33Å; N341-L343 HydrophobicContact CB-CD1 3.93Å; N341-L343 HydrophobicContact CB-CG 4.18Å; L343-R410 HydrophobicContact CD1-CG 4.37Å; L343-R410 HydrophobicContact CD2-CG 4.42Å; L343-W415 HydrophobicContact CD1-CH2 3.47Å; L343-W415 VanDerWaalsContact CD1-CH2 3.47Å; L343-W415 HydrophobicContact CD1-CZ2 3.56Å; L343-W415 HydrophobicContact CD2-CH2 4.22Å; L343-W415 HydrophobicContact CD2-CZ2 3.73Å; L343-W415 HydrophobicContact CG-CZ2 4.29Å
344	H	89.6	Confident	91.1	Very high	144 Å²	144	60.7 Å²	60.7	67%	0.667	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-80.7	128	172.1	-165.9	-73.5	0	0	0	110
345	I	93.3	Very high	90.7	Very high	21 Å²	21	66.7 Å²	66.7	11%	0.108	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-84.4	134.9	171.9	-170.5	178	0	0	0	109.8	E282 I292 P294 F356 W358	E282-I345 HydrophobicContact CG-CD1 3.75Å; I292-I345 WeakPolarHBondContact O-CG1 3.05Å; P294-I345 HydrophobicContact CG-CD1 3.94Å; I345-F356 HydrophobicContact CD1-CD1 4.26Å; I345-F356 HydrophobicContact CD1-CE1 4Å; I345-F356 HydrophobicContact CG2-CB 4.39Å; I345-F356 HydrophobicContact CG2-CD1 3.62Å; I345-F356 HydrophobicContact CG2-CE1 4.35Å; I345-F356 HydrophobicContact CG2-CG 4.35Å; I345-W358 HydrophobicContact CD1-CZ2 3.99Å
346	S	93.1	Very high	90.5	Very high	50 Å²	50	67.3 Å²	67.3	35%	0.35	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-74.7	125.7	173.8	-71.8	0	0	0	0	110	I292 S293 P294	I292-S346 PolarHBondContact O-N 2.99Å; S293-S346 WeakPolarHBondContact OG-CB 3.21Å; P294-S346 WeakPolarHBondContact CD-O 3.36Å
347	P	93.3	Very high	90.5	Very high	42 Å²	42	67 Å²	67	27%	0.273	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-60.5	147.4	172.5	22.4	-31	0	0	0	110.9	Y351 F356	P347-Y351 HydrophobicContact CB-CD1 4.01Å; P347-Y351 HydrophobicContact CB-CG 4.39Å; P347-F356 HydrophobicContact CB-CB 4.18Å; P347-F356 HydrophobicContact CB-CD2 4.26Å
348	P	92.5	Very high	90.5	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.006	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-65.1	139.9	176.9	26	-29.1	0	0	0	109.6	P294 D311 L313 G350 Y351 F356 Y361	P294-P348 HydrophobicContact CG-CG 4.39Å; D311-P348 HydrophobicContact CB-CB 3.75Å; D311-P348 WeakPolarHBondContact O-CB 3.16Å; L313-P348 HydrophobicContact CD1-CG 3.98Å; L313-P348 HydrophobicContact CG-CB 4.47Å; L313-P348 HydrophobicContact CG-CG 4.37Å; P348-G350 PolarHBondContact O-N 2.94Å; P348-Y351 HydrophobicContact CG-CD2 4.45Å; P348-Y351 HydrophobicContact CG-CG 4.47Å; P348-Y351 WeakPolarHBondContact O-CB 3.49Å; P348-Y351 PolarHBondContact O-N 2.88Å; P348-F356 HydrophobicContact CG-CE2 4.24Å; P348-Y361 HydrophobicContact CG-CE2 4.2Å
349	P	91.1	Very high	90.5	Very high	57 Å²	57	69.9 Å²	69.9	37%	0.37	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	132.4	-177.2	-28.1	36.4	0	0	0	112.1	D311 L313 R314	D311-P349 VanDerWaalsContact O-CD 3.32Å; D311-P349 WeakPolarHBondContact O-CD 3.31Å; L313-P349 WeakPolarHBondContact CA-O 3.42Å; L313-P349 WeakPolarHBondContact CB-O 3.23Å; L313-P349 PolarHBondContact N-O 3.44Å; R314-P349 HydrophobicContact CG-CB 4.4Å
350	G	88.9	Confident	90.5	Very high	53 Å²	53	67.9 Å²	67.9	55%	0.546	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-3	-174.2	0	0	0	0	0	115.5	P348	P348-G350 PolarHBondContact O-N 2.94Å
351	Y	90.4	Very high	90.7	Very high	37 Å²	37	61.9 Å²	61.9	15%	0.145	37%	0.373	C	S	.	.			trans	-63.3	138.9	168.2	-164.6	-110.2	0	0	0	110.6	L313 P347 P348 S353 F356 Y361	L313-Y351 HydrophobicContact CD1-CD2 3.85Å; L313-Y351 HydrophobicContact CD1-CG 4.47Å; P347-Y351 HydrophobicContact CB-CD1 4.01Å; P347-Y351 HydrophobicContact CB-CG 4.39Å; P348-Y351 HydrophobicContact CG-CD2 4.45Å; P348-Y351 HydrophobicContact CG-CG 4.47Å; P348-Y351 WeakPolarHBondContact O-CB 3.49Å; P348-Y351 PolarHBondContact O-N 2.88Å; Y351-S353 VanDerWaalsContact C-N 3.32Å; Y351-S353 WeakPolarHBondContact CD1-O 3.27Å; Y351-S353 PolarHBondContact O-N 2.95Å; Y351-F356 HydrophobicContact CD1-CD2 4Å; Y351-F356 HydrophobicContact CE1-CB 4.43Å; Y351-F356 AromaticContact CE1-CD2 3.81Å; Y351-F356 HydrophobicContact CE1-CD2 3.81Å; Y351-F356 HydrophobicContact CE2-CD2 4.38Å; Y351-F356 HydrophobicContact CE2-CE2 4.46Å; Y351-F356 HydrophobicContact CG-CD2 4.37Å; Y351-Y361 HydrophobicContact CD2-CD2 4.19Å; Y351-Y361 AromaticContact CE2-CD2 3.86Å; Y351-Y361 HydrophobicContact CE2-CD2 3.86Å
352	P	85.6	Confident	90.9	Very high	120 Å²	120	61.1 Å²	61.1	78%	0.779	37%	0.369	S	S	*	.	S	Bend	trans	-80.9	-6.9	-168.1	31.9	-37.1	0	0	0	114.9
353	S	85.3	Confident	91	Very high	47 Å²	47	65.1 Å²	65.1	33%	0.329	37%	0.366	S	S	.	.			trans	-121.9	154.2	-178.2	-177.6	0	0	0	0	110.7	Y351 D355	Y351-S353 VanDerWaalsContact C-N 3.32Å; Y351-S353 WeakPolarHBondContact CD1-O 3.27Å; Y351-S353 PolarHBondContact O-N 2.95Å; S353-D355 VanDerWaalsContact CB-O 3.28Å; S353-D355 WeakPolarHBondContact CB-O 3.29Å; S353-D355 PolarHBondContact OG-N 3.26Å; S353-D355 VanDerWaalsContact OG-N 3.12Å; S353-D355 PolarHBondContact OG-O 3.06Å
354	Q	80.6	Confident	91.1	Very high	170 Å²	170	69.2 Å²	69.2	79%	0.794	38%	0.384	S	S	*	.	S	Bend	trans	-83.7	-35.9	165.5	-69	-174.1	-11.6	0	0	111	F356	Q354-F356 PolarHBondContact O-N 3.25Å
355	D	86.6	Confident	91.2	Very high	135 Å²	135	64.8 Å²	64.8	72%	0.722	37%	0.369	S	S	*	.	S	Bend	trans	-71.9	107.8	168.3	-57	-53.5	0	0	0	108.8	S353	S353-D355 VanDerWaalsContact CB-O 3.28Å; S353-D355 WeakPolarHBondContact CB-O 3.29Å; S353-D355 PolarHBondContact OG-N 3.26Å; S353-D355 VanDerWaalsContact OG-N 3.12Å; S353-D355 PolarHBondContact OG-O 3.06Å
356	F	92.8	Very high	91.1	Very high	28 Å²	28	66.9 Å²	66.9	12%	0.123	40%	0.396	C	S	.	.			trans	-94.5	126.2	177.7	177.7	-93.1	0	0	0	111	P294 I345 P347 P348 Y351 Q354 W358 Y361	P294-F356 HydrophobicContact CB-CZ 4.37Å; P294-F356 HydrophobicContact CG-CE1 3.87Å; P294-F356 HydrophobicContact CG-CE2 3.77Å; P294-F356 HydrophobicContact CG-CZ 3.34Å; I345-F356 HydrophobicContact CD1-CD1 4.26Å; I345-F356 HydrophobicContact CD1-CE1 4Å; I345-F356 HydrophobicContact CG2-CB 4.39Å; I345-F356 HydrophobicContact CG2-CD1 3.62Å; I345-F356 HydrophobicContact CG2-CE1 4.35Å; I345-F356 HydrophobicContact CG2-CG 4.35Å; P347-F356 HydrophobicContact CB-CB 4.18Å; P347-F356 HydrophobicContact CB-CD2 4.26Å; P348-F356 HydrophobicContact CG-CE2 4.24Å; Y351-F356 HydrophobicContact CD1-CD2 4Å; Y351-F356 HydrophobicContact CE1-CB 4.43Å; Y351-F356 AromaticContact CE1-CD2 3.81Å; Y351-F356 HydrophobicContact CE1-CD2 3.81Å; Y351-F356 HydrophobicContact CE2-CD2 4.38Å; Y351-F356 HydrophobicContact CE2-CE2 4.46Å; Y351-F356 HydrophobicContact CG-CD2 4.37Å; Q354-F356 PolarHBondContact O-N 3.25Å; F356-W358 HydrophobicContact CE1-CB 4.45Å; F356-W358 AromaticContact CE1-CD1 3.86Å; F356-W358 AromaticContact CE1-CD2 3.69Å; F356-W358 HydrophobicContact CE1-CD2 3.69Å; F356-W358 AromaticContact CE1-CE2 3.82Å; F356-W358 HydrophobicContact CE1-CE3 4.25Å; F356-W358 AromaticContact CE1-CG 3.75Å; F356-W358 HydrophobicContact CE1-CG 3.75Å; F356-W358 HydrophobicContact CE1-CZ2 4.46Å; F356-W358 AromaticContact CE1-NE1 3.92Å; F356-W358 AromaticContact CZ-CD2 3.99Å; F356-W358 HydrophobicContact CZ-CD2 3.99Å; F356-W358 HydrophobicContact CZ-CE3 4.08Å; F356-W358 HydrophobicContact CZ-CG 4.42Å; F356-W358 HydrophobicContact CZ-CZ3 4.43Å; F356-Y361 AromaticContact CE2-CD1 3.81Å; F356-Y361 HydrophobicContact CE2-CD1 3.81Å; F356-Y361 HydrophobicContact CE2-CD2 4.17Å; F356-Y361 HydrophobicContact CE2-CE1 4.46Å; F356-Y361 AromaticContact CE2-CG 3.65Å; F356-Y361 HydrophobicContact CE2-CG 3.65Å; F356-Y361 AromaticContact CZ-CD1 3.59Å; F356-Y361 HydrophobicContact CZ-CD1 3.59Å; F356-Y361 HydrophobicContact CZ-CE1 4.38Å; F356-Y361 AromaticContact CZ-CG 3.79Å; F356-Y361 HydrophobicContact CZ-CG 3.79Å
357	D	92	Very high	91.2	Very high	76 Å²	76	65.1 Å²	65.1	41%	0.406	38%	0.384	S	S	.	.			trans	-115.8	131	170.5	179	-102.3	0	0	0	112	A359 D360 Y361	D357-A359 WeakPolarHBondContact OD1-CA 3.44Å; D357-A359 WeakPolarHBondContact OD1-CB 3.25Å; D357-A359 PolarHBondContact OD1-N 2.93Å; D357-D360 PolarHBondContact OD1-N 2.87Å; D357-Y361 VanDerWaalsContact O-CB 3.25Å; D357-Y361 WeakPolarHBondContact O-CB 3.45Å; D357-Y361 PolarHBondContact O-N 2.79Å; D357-Y361 VanDerWaalsContact O-N 3.09Å
358	W	94.8	Very high	91.3	Very high	10 Å²	10	70.2 Å²	70.2	4%	0.038	40%	0.404	C	S	.	.	H	α-helix	trans	-70.4	-33.2	-179.2	-97.2	122.3	0	0	0	113.4	K280 L281 E282 P294 V335 I345 F356 Y361 L362	K280-W358 HydrophobicContact CB-CH2 4.26Å; K280-W358 HydrophobicContact CB-CZ3 3.93Å; K280-W358 HydrophobicContact CG-CZ3 4.42Å; L281-W358 WeakPolarHBondContact O-CH2 3.28Å; E282-W358 HydrophobicContact CG-CZ2 3.57Å; E282-W358 PolarHBondContact OE1-NE1 2.56Å; P294-W358 HydrophobicContact CB-CH2 3.61Å; P294-W358 HydrophobicContact CB-CZ2 3.98Å; P294-W358 HydrophobicContact CB-CZ3 4.34Å; P294-W358 HydrophobicContact CG-CH2 4Å; P294-W358 HydrophobicContact CG-CZ2 3.95Å; V335-W358 HydrophobicContact CB-CD2 4.44Å; V335-W358 HydrophobicContact CG1-CB 4.02Å; V335-W358 HydrophobicContact CG1-CD2 3.67Å; V335-W358 HydrophobicContact CG1-CE3 4.16Å; V335-W358 HydrophobicContact CG1-CG 3.61Å; V335-W358 HydrophobicContact CG2-CD2 4.13Å; V335-W358 HydrophobicContact CG2-CE3 4.13Å; V335-W358 HydrophobicContact CG2-CH2 3.95Å; V335-W358 HydrophobicContact CG2-CZ2 3.96Å; V335-W358 HydrophobicContact CG2-CZ3 4.04Å; I345-W358 HydrophobicContact CD1-CZ2 3.99Å; F356-W358 HydrophobicContact CE1-CB 4.45Å; F356-W358 AromaticContact CE1-CD1 3.86Å; F356-W358 AromaticContact CE1-CD2 3.69Å; F356-W358 HydrophobicContact CE1-CD2 3.69Å; F356-W358 AromaticContact CE1-CE2 3.82Å; F356-W358 HydrophobicContact CE1-CE3 4.25Å; F356-W358 AromaticContact CE1-CG 3.75Å; F356-W358 HydrophobicContact CE1-CG 3.75Å; F356-W358 HydrophobicContact CE1-CZ2 4.46Å; F356-W358 AromaticContact CE1-NE1 3.92Å; F356-W358 AromaticContact CZ-CD2 3.99Å; F356-W358 HydrophobicContact CZ-CD2 3.99Å; F356-W358 HydrophobicContact CZ-CE3 4.08Å; F356-W358 HydrophobicContact CZ-CG 4.42Å; F356-W358 HydrophobicContact CZ-CZ3 4.43Å; W358-Y361 HydrophobicContact CE3-CD1 4.02Å; W358-Y361 AromaticContact CZ3-CD1 3.75Å; W358-Y361 HydrophobicContact CZ3-CD1 3.75Å; W358-Y361 HydrophobicContact CZ3-CE1 4.21Å; W358-L362 HydrophobicContact CE3-CD1 4.41Å; W358-L362 HydrophobicContact CE3-CD2 4.37Å; W358-L362 HydrophobicContact CE3-CG 4.04Å; W358-L362 HydrophobicContact CZ3-CD2 4.35Å; W358-L362 HydrophobicContact CZ3-CG 4.48Å; W358-L362 WeakPolarHBondContact O-CB 3.38Å; W358-L362 WeakPolarHBondContact O-CD1 3.39Å; W358-L362 WeakPolarHBondContact O-CG 3.35Å; W358-L362 PolarHBondContact O-N 2.88Å
359	A	93.6	Very high	91.5	Very high	62 Å²	62	72 Å²	72	51%	0.512	42%	0.418	S	S	.	.	H	α-helix	trans	-74.4	-43.5	-176	0	0	0	0	0	111.6	D357 K363	D357-A359 WeakPolarHBondContact OD1-CA 3.44Å; D357-A359 WeakPolarHBondContact OD1-CB 3.25Å; D357-A359 PolarHBondContact OD1-N 2.93Å; A359-K363 WeakPolarHBondContact O-CB 3.28Å; A359-K363 PolarHBondContact O-N 3.17Å
360	D	92.4	Very high	91.8	Very high	89 Å²	89	69.4 Å²	69.4	48%	0.476	40%	0.402	S	S	.	.	H	α-helix	trans	-69.5	-34.2	172.1	-88.4	-31.2	0	0	0	112	D357 K363 Q364	D357-D360 PolarHBondContact OD1-N 2.87Å; D360-K363 PolarHBondContact O-N 2.92Å; D360-K363 IonicContact OD1-NZ 2.85Å; D360-K363 PolarHBondContact OD1-NZ 3.44Å; D360-Q364 WeakPolarHBondContact O-CB 3.41Å; D360-Q364 PolarHBondContact O-N 3.12Å
361	Y	94.9	Very high	92	Very high	2 Å²	2	68.4 Å²	68.4	1%	0.008	39%	0.386	C	S	.	.	H	α-helix	trans	-67	-46.2	175.1	-174.5	-119.1	0	0	0	113.3	K280 P294 D311 L313 P348 Y351 F356 D357 W358 K363 Q364 C365	K280-Y361 HydrophobicContact CD-CE1 4.26Å; K280-Y361 PolarHBondContact NZ-OH 2.81Å; P294-Y361 HydrophobicContact CB-CE1 4Å; P294-Y361 HydrophobicContact CG-CE1 4.5Å; D311-Y361 PolarHBondContact OD2-OH 3.2Å; L313-Y361 HydrophobicContact CD1-CE2 4.04Å; L313-Y361 HydrophobicContact CD2-CE2 4.3Å; P348-Y361 HydrophobicContact CG-CE2 4.2Å; Y351-Y361 HydrophobicContact CD2-CD2 4.19Å; Y351-Y361 AromaticContact CE2-CD2 3.86Å; Y351-Y361 HydrophobicContact CE2-CD2 3.86Å; F356-Y361 AromaticContact CE2-CD1 3.81Å; F356-Y361 HydrophobicContact CE2-CD1 3.81Å; F356-Y361 HydrophobicContact CE2-CD2 4.17Å; F356-Y361 HydrophobicContact CE2-CE1 4.46Å; F356-Y361 AromaticContact CE2-CG 3.65Å; F356-Y361 HydrophobicContact CE2-CG 3.65Å; F356-Y361 AromaticContact CZ-CD1 3.59Å; F356-Y361 HydrophobicContact CZ-CD1 3.59Å; F356-Y361 HydrophobicContact CZ-CE1 4.38Å; F356-Y361 AromaticContact CZ-CG 3.79Å; F356-Y361 HydrophobicContact CZ-CG 3.79Å; D357-Y361 VanDerWaalsContact O-CB 3.25Å; D357-Y361 WeakPolarHBondContact O-CB 3.45Å; D357-Y361 PolarHBondContact O-N 2.79Å; D357-Y361 VanDerWaalsContact O-N 3.09Å; W358-Y361 HydrophobicContact CE3-CD1 4.02Å; W358-Y361 AromaticContact CZ3-CD1 3.75Å; W358-Y361 HydrophobicContact CZ3-CD1 3.75Å; W358-Y361 HydrophobicContact CZ3-CE1 4.21Å; Y361-K363 VanDerWaalsContact C-N 3.28Å; Y361-K363 PolarHBondContact O-N 3.37Å; Y361-Q364 PolarHBondContact O-N 3.12Å; Y361-Q364 VanDerWaalsContact O-N 3.16Å; Y361-C365 VanDerWaalsContact CE2-SG 3.55Å; Y361-C365 VanDerWaalsContact CZ-SG 3.56Å; Y361-C365 PolarHBondContact O-N 3.48Å
362	L	95.4	Very high	92.1	Very high	31 Å²	31	72 Å²	72	16%	0.162	40%	0.404	C	S	.	.	H	α-helix	trans	-57.9	-42.8	175.2	-73.6	164.7	0	0	0	111.6	K280 W358 C365 G366 A367 A369	K280-L362 HydrophobicContact CB-CD2 3.71Å; K280-L362 HydrophobicContact CG-CD2 3.82Å; W358-L362 HydrophobicContact CE3-CD1 4.41Å; W358-L362 HydrophobicContact CE3-CD2 4.37Å; W358-L362 HydrophobicContact CE3-CG 4.04Å; W358-L362 HydrophobicContact CZ3-CD2 4.35Å; W358-L362 HydrophobicContact CZ3-CG 4.48Å; W358-L362 WeakPolarHBondContact O-CB 3.38Å; W358-L362 WeakPolarHBondContact O-CD1 3.39Å; W358-L362 WeakPolarHBondContact O-CG 3.35Å; W358-L362 PolarHBondContact O-N 2.88Å; L362-C365 PolarHBondContact O-N 2.76Å; L362-G366 PolarHBondContact O-N 3.11Å; L362-A367 WeakPolarHBondContact CD2-O 3.42Å; L362-A367 PolarHBondContact O-N 3.4Å; L362-A369 HydrophobicContact CD1-CB 4.09Å; L362-A369 HydrophobicContact CD2-CB 4.38Å
363	K	94.3	Very high	92.4	Very high	157 Å²	157	75.4 Å²	75.4	68%	0.683	40%	0.402	S	S	*	.	H	α-helix	trans	-67.3	-34.4	176.6	174.9	-176.1	159.6	-153.6	0	113.1	A359 D360 Y361	A359-K363 WeakPolarHBondContact O-CB 3.28Å; A359-K363 PolarHBondContact O-N 3.17Å; D360-K363 PolarHBondContact O-N 2.92Å; D360-K363 IonicContact OD1-NZ 2.85Å; D360-K363 PolarHBondContact OD1-NZ 3.44Å; Y361-K363 VanDerWaalsContact C-N 3.28Å; Y361-K363 PolarHBondContact O-N 3.37Å
364	Q	92.2	Very high	92.8	Very high	122 Å²	122	73.5 Å²	73.5	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-69.1	-40.6	173	-176.9	-177.7	-0.2	0	0	111.7	D360 Y361	D360-Q364 WeakPolarHBondContact O-CB 3.41Å; D360-Q364 PolarHBondContact O-N 3.12Å; Y361-Q364 PolarHBondContact O-N 3.12Å; Y361-Q364 VanDerWaalsContact O-N 3.16Å
365	C	91.4	Very high	93.3	Very high	51 Å²	51	66.4 Å²	66.4	35%	0.345	36%	0.355	S	S	.	.	H	α-helix	trans	-79	-22	179.1	-71.8	0	0	0	0	114.2	Y361 L362 A367	Y361-C365 VanDerWaalsContact CE2-SG 3.55Å; Y361-C365 VanDerWaalsContact CZ-SG 3.56Å; Y361-C365 PolarHBondContact O-N 3.48Å; L362-C365 PolarHBondContact O-N 2.76Å; C365-A367 VanDerWaalsContact C-N 3.3Å; C365-A367 HydrophobicContact CB-CB 3.95Å
366	G	92.7	Very high	93.2	Very high	65 Å²	65	62.7 Å²	62.7	67%	0.67	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	35.2	-169.4	0	0	0	0	0	112.3	L362	L362-G366 PolarHBondContact O-N 3.11Å
367	A	93.8	Very high	92.6	Very high	12 Å²	12	67.2 Å²	67.2	10%	0.099	37%	0.37	C	S	.	.			trans	-119.4	156.6	-173.4	0	0	0	0	0	111.7	K280 L362 C365	K280-A367 HydrophobicContact CG-CB 3.75Å; L362-A367 WeakPolarHBondContact CD2-O 3.42Å; L362-A367 PolarHBondContact O-N 3.4Å; C365-A367 VanDerWaalsContact C-N 3.3Å; C365-A367 HydrophobicContact CB-CB 3.95Å
368	E	95.2	Very high	91.6	Very high	149 Å²	149	68.6 Å²	68.6	70%	0.696	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	144.4	179.6	-65.3	-167.3	168.4	0	0	111.7	M279 K280	M279-E368 CarbonylContact C-O 3.59Å; M279-E368 WeakPolarHBondContact CA-O 3Å; K280-E368 PolarHBondContact N-O 2.98Å
369	A	97.4	Very high	90.6	Very high	38 Å²	38	70.6 Å²	70.6	31%	0.314	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.8	172.7	0	0	0	0	0	111	V335 L362 P371	V335-A369 HydrophobicContact CB-CB 3.86Å; V335-A369 HydrophobicContact CG1-CB 4.22Å; V335-A369 HydrophobicContact CG2-CB 3.69Å; L362-A369 HydrophobicContact CD1-CB 4.09Å; L362-A369 HydrophobicContact CD2-CB 4.38Å; A369-P371 WeakPolarHBondContact O-CD 3.28Å
370	A	96.9	Very high	89	Confident	4 Å²	4	72.9 Å²	72.9	3%	0.033	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-55.6	117.6	172	0	0	0	0	0	110.3	F275 M279 K280 L281 F375	F275-A370 HydrophobicContact CD1-CB 4.22Å; F275-A370 HydrophobicContact CE1-CB 3.86Å; M279-A370 HydrophobicContact CB-CB 4.22Å; M279-A370 HydrophobicContact SD-CB 4.41Å; K280-A370 WeakPolarHBondContact O-CB 3.47Å; K280-A370 PolarHBondContact O-N 2.94Å; L281-A370 HydrophobicContact CB-CB 4.07Å; A370-F375 HydrophobicContact CB-CE2 3.68Å; A370-F375 HydrophobicContact CB-CZ 3.74Å
371	P	94.5	Very high	88.2	Confident	32 Å²	32	77.1 Å²	77.1	21%	0.208	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-62.7	146.9	-177.8	-28	37.7	0	0	0	113.1	M279 A369 R373 C374 F375	M279-P371 HydrophobicContact CE-CG 4.43Å; A369-P371 WeakPolarHBondContact O-CD 3.28Å; P371-R373 HydrophobicContact CB-CG 3.85Å; P371-R373 PolarHBondContact O-N 3.45Å; P371-C374 WeakPolarHBondContact O-CB 3.14Å; P371-C374 PolarHBondContact O-N 3.09Å; P371-F375 WeakPolarHBondContact O-CD2 3.47Å
372	Q	91.8	Very high	87.8	Confident	111 Å²	111	80.1 Å²	80.1	52%	0.519	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-51	-30.4	178.7	-178.4	62.2	77.2	0	0	114.1	C374 F375	Q372-C374 PolarHBondContact O-N 3.09Å; Q372-F375 PolarHBondContact O-N 2.82Å
373	R	91.6	Very high	87.4	Confident	193 Å²	193	83.2 Å²	83.2	73%	0.728	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-68.9	-12.4	177	63.2	169.2	-173.8	-88.5	-2.9	115.1	P371 F375	P371-R373 HydrophobicContact CB-CG 3.85Å; P371-R373 PolarHBondContact O-N 3.45Å; R373-F375 VanDerWaalsContact C-N 3.32Å
374	C	92.9	Very high	87.4	Confident	7 Å²	7	76.1 Å²	76.1	5%	0.047	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-82.9	-13.6	176.2	-57.2	0	0	0	0	112.4	T274 F275 P371 Q372	T274-C374 PolarHBondContact O-SG 3.49Å; T274-C374 VanDerWaalsContact O-SG 3.41Å; T274-C374 PolarHBondContact OG1-SG 2.86Å; F275-C374 HydrophobicContact CD1-CB 4Å; F275-C374 HydrophobicContact CD2-CB 4.16Å; F275-C374 HydrophobicContact CE1-CB 3.72Å; F275-C374 HydrophobicContact CE2-CB 3.88Å; F275-C374 WeakPolarHBondContact CE2-O 3.43Å; F275-C374 HydrophobicContact CG-CB 4.21Å; F275-C374 HydrophobicContact CZ-CB 3.65Å; F275-C374 WeakPolarHBondContact CZ-O 3.46Å; P371-C374 WeakPolarHBondContact O-CB 3.14Å; P371-C374 PolarHBondContact O-N 3.09Å; Q372-C374 PolarHBondContact O-N 3.09Å
375	F	92.1	Very high	87.5	Confident	20 Å²	20	76.1 Å²	76.1	9%	0.088	41%	0.412	C	S	.	.	S	Bend	trans	-105.8	149.4	-177	-58.9	-90.6	0	0	0	110.4	F275 L281 I332 F333 P334 A370 P371 Q372 R373	F275-F375 AromaticContact CE1-CE1 3.95Å; F275-F375 HydrophobicContact CE1-CE1 3.95Å; F275-F375 HydrophobicContact CE1-CE2 4.01Å; F275-F375 AromaticContact CE1-CZ 3.6Å; F275-F375 HydrophobicContact CE1-CZ 3.6Å; F275-F375 AromaticContact CZ-CD1 3.94Å; F275-F375 HydrophobicContact CZ-CD1 3.94Å; F275-F375 HydrophobicContact CZ-CD2 4.4Å; F275-F375 AromaticContact CZ-CE1 3.62Å; F275-F375 HydrophobicContact CZ-CE1 3.62Å; F275-F375 HydrophobicContact CZ-CE2 4.11Å; F275-F375 HydrophobicContact CZ-CG 4.32Å; F275-F375 AromaticContact CZ-CZ 3.71Å; F275-F375 HydrophobicContact CZ-CZ 3.71Å; L281-F375 HydrophobicContact CB-CZ 4Å; L281-F375 HydrophobicContact CD2-CZ 4.49Å; I332-F375 HydrophobicContact CB-CE1 4.28Å; I332-F375 HydrophobicContact CD1-CE1 4.4Å; I332-F375 HydrophobicContact CG1-CD1 4.43Å; I332-F375 HydrophobicContact CG1-CE1 4.3Å; F333-F375 WeakPolarHBondContact O-CE1 3.21Å; F333-F375 WeakPolarHBondContact O-CZ 3.22Å; P334-F375 VanDerWaalsContact CA-CE2 3.47Å; P334-F375 HydrophobicContact CB-CD2 3.79Å; P334-F375 HydrophobicContact CB-CE2 3.65Å; P334-F375 HydrophobicContact CB-CZ 4.25Å; P334-F375 HydrophobicContact CG-CD2 4.22Å; P334-F375 HydrophobicContact CG-CE2 4.45Å; A370-F375 HydrophobicContact CB-CE2 3.68Å; A370-F375 HydrophobicContact CB-CZ 3.74Å; P371-F375 WeakPolarHBondContact O-CD2 3.47Å; Q372-F375 PolarHBondContact O-N 2.82Å; R373-F375 VanDerWaalsContact C-N 3.32Å
376	P	84.8	Confident	87.7	Confident	57 Å²	57	78.4 Å²	78.4	37%	0.37	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-65.2	157.8	179.4	27.6	-34.9	0	0	0	111.6	A327	A327-P376 WeakPolarHBondContact O-CD 3.19Å
377	P	79.6	Confident	87.8	Confident	123 Å²	123	79.2 Å²	79.2	80%	0.799	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-61	139.4	171.9	27.4	-34.4	0	0	0	110.6	I379	P377-I379 PolarHBondContact O-N 3.4Å
378	L	72.4	Confident	87.8	Confident	106 Å²	106	79.5 Å²	79.5	56%	0.555	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-62.3	122.2	179.7	-76.9	154.4	0	0	0	111.2	S380	L378-S380 PolarHBondContact O-N 3.3Å; L378-S380 VanDerWaalsContact O-N 3.09Å
379	I	72.4	Confident	87.8	Confident	52 Å²	52	72.7 Å²	72.7	27%	0.267	37%	0.374	S	S	.	.			trans	-65	110.2	169.3	-54.6	170.9	0	0	0	107.6	P377 E433	P377-I379 PolarHBondContact O-N 3.4Å; I379-E433 HydrophobicContact CD1-CG 3.88Å; I379-E433 VanDerWaalsContact CD1-OE2 3.31Å; I379-E433 WeakPolarHBondContact CD1-OE2 3.38Å
380	S	61.3	Low	87.7	Confident	110 Å²	110	70.9 Å²	70.9	77%	0.769	36%	0.359	S	S	*	.			trans	-103.7	-10.5	-173.8	42	0	0	0	0	113.8	L378	L378-S380 PolarHBondContact O-N 3.3Å; L378-S380 VanDerWaalsContact O-N 3.09Å
381	E	73.8	Confident	87.6	Confident	178 Å²	178	70.8 Å²	70.8	83%	0.832	36%	0.358	S	S	*	.			trans	-122.2	107	-179.3	-65	-176.3	178	0	0	109.7
382	H	88.3	Confident	87.8	Confident	65 Å²	65	69.2 Å²	69.2	30%	0.301	35%	0.348	S	S	.	.			trans	-156.7	164.3	170.9	63.2	73.4	0	0	0	109.3	F384 V409 G411	H382-F384 HydrophobicContact CB-CD2 4.16Å; H382-F384 PolarHBondContact CE1-O 2.85Å; H382-F384 AromaticContact ND1-CD2 3.72Å; H382-F384 PolarHBondContact ND1-N 3.05Å; H382-V409 WeakPolarHBondContact CE1-CG1 3.45Å; H382-G411 PolarHBondContact NE2-O 2.97Å
383	E	87.1	Confident	87.9	Confident	96 Å²	96	64.3 Å²	64.3	45%	0.449	33%	0.325	S	S	.	.			trans	-96.4	-7	-171.3	-48.2	-173.7	102.8	0	0	114.7	P35 S38 K385	P35-E383 VanDerWaalsContact CB-OE2 3.29Å; P35-E383 WeakPolarHBondContact CB-OE2 3.47Å; P35-E383 HydrophobicContact CG-CB 4.34Å; P35-E383 WeakPolarHBondContact CG-OE2 3.48Å; S38-E383 WeakPolarHBondContact OG-CB 3.46Å; S38-E383 PolarHBondContact OG-OE2 2.75Å; E383-K385 WeakPolarHBondContact O-CE 3.27Å
384	F	93.8	Very high	88	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.035	29%	0.291	C	S	.	.			trans	-64.9	130.9	-175.5	-63.3	-93.1	0	0	0	111.8	V34 F39 H382 L390 I406 L414 V432 I437	V34-F384 HydrophobicContact CG1-CD1 3.71Å; V34-F384 HydrophobicContact CG1-CE1 3.65Å; V34-F384 HydrophobicContact CG1-CG 4.43Å; V34-F384 HydrophobicContact CG1-CZ 4.31Å; V34-F384 HydrophobicContact CG2-CD1 4.02Å; V34-F384 HydrophobicContact CG2-CE1 4.38Å; F39-F384 HydrophobicContact CD1-CZ 4.48Å; F39-F384 HydrophobicContact CE1-CE1 4.01Å; F39-F384 HydrophobicContact CE1-CZ 4.28Å; F39-F384 HydrophobicContact CZ-CE1 4.1Å; H382-F384 HydrophobicContact CB-CD2 4.16Å; H382-F384 PolarHBondContact CE1-O 2.85Å; H382-F384 AromaticContact ND1-CD2 3.72Å; H382-F384 PolarHBondContact ND1-N 3.05Å; F384-L390 HydrophobicContact CD1-CD2 4.35Å; F384-L390 HydrophobicContact CE1-CD2 4.1Å; F384-I406 HydrophobicContact CB-CD1 4.12Å; F384-I406 HydrophobicContact CD1-CD1 3.88Å; F384-L414 HydrophobicContact CB-CD1 4.46Å; F384-L414 HydrophobicContact CB-CD2 3.72Å; F384-L414 HydrophobicContact CD1-CD1 3.6Å; F384-L414 HydrophobicContact CD1-CD2 4.42Å; F384-L414 HydrophobicContact CE1-CD1 3.9Å; F384-L414 HydrophobicContact CG-CD1 4.06Å; F384-L414 HydrophobicContact CG-CD2 4.16Å; F384-V432 HydrophobicContact CB-CG1 4.49Å; F384-V432 HydrophobicContact CD2-CB 3.85Å; F384-V432 HydrophobicContact CD2-CG1 3.58Å; F384-V432 HydrophobicContact CE2-CB 3.66Å; F384-V432 HydrophobicContact CE2-CG1 3.92Å; F384-V432 HydrophobicContact CG-CG1 4.11Å; F384-V432 HydrophobicContact CZ-CB 4.38Å; F384-I437 HydrophobicContact CE1-CD1 4.2Å; F384-I437 HydrophobicContact CZ-CD1 4.21Å
385	K	94.3	Very high	88	Confident	122 Å²	122	56.3 Å²	56.3	53%	0.53	30%	0.299	S	S	.	.			trans	-137.1	152	-175.8	-69.6	158	-166.1	161.3	0	111.5	E383 M388	E383-K385 WeakPolarHBondContact O-CE 3.27Å; K385-M388 HydrophobicContact CB-CE 4.3Å; K385-M388 HydrophobicContact CB-CG 4.15Å; K385-M388 HydrophobicContact CB-SD 3.9Å; K385-M388 HydrophobicContact CD-CE 4.08Å; K385-M388 PolarHBondContact N-SD 2.78Å; K385-M388 VanDerWaalsContact N-SD 3.39Å; K385-M388 VanDerWaalsContact O-CB 3.3Å; K385-M388 WeakPolarHBondContact O-CB 3.41Å; K385-M388 WeakPolarHBondContact O-CG 3.23Å; K385-M388 PolarHBondContact O-N 2.81Å; K385-M388 VanDerWaalsContact O-N 3.11Å
386	E	95.3	Very high	87.9	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	142	173.2	-56.8	-177.9	167.3	0	0	110.3	M388 A408 V409 R410	E386-M388 PolarHBondContact O-N 2.87Å; E386-A408 WeakPolarHBondContact OE1-CA 3.33Å; E386-V409 HydrophobicContact CG-CB 4.37Å; E386-V409 HydrophobicContact CG-CG2 3.97Å; E386-V409 PolarHBondContact OE1-N 2.8Å; E386-R410 IonicContact OE1-CZ 2.64Å; E386-R410 IonicContact OE1-NH1 3.7Å; E386-R410 PolarHBondContact OE1-NH1 2.91Å; E386-R410 IonicContact OE1-NH2 3.7Å
387	N	94.2	Very high	88.2	Confident	81 Å²	81	59.3 Å²	59.3	43%	0.433	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	17.3	-171.1	-166.5	52	0	0	0	115.9	G30 S31 I406	G30-N387 PolarHBondContact O-ND2 3.11Å; G30-N387 VanDerWaalsContact O-ND2 3.12Å; S31-N387 WeakPolarHBondContact CB-O 3.15Å; N387-I406 PolarHBondContact N-O 2.86Å
388	M	94.8	Very high	88.7	Confident	18 Å²	18	56 Å²	56	9%	0.089	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	157.1	157.7	-70.8	-179.3	155.4	0	0	111.4	T32 V34 K385 E386 I406	T32-M388 CarbonylContact O-C 3.59Å; T32-M388 VanDerWaalsContact O-CA 3.23Å; T32-M388 WeakPolarHBondContact O-CA 3.36Å; V34-M388 HydrophobicContact CG2-CB 3.7Å; V34-M388 HydrophobicContact CG2-CG 4.42Å; V34-M388 HydrophobicContact CG2-SD 3.98Å; K385-M388 HydrophobicContact CB-CE 4.3Å; K385-M388 HydrophobicContact CB-CG 4.15Å; K385-M388 HydrophobicContact CB-SD 3.9Å; K385-M388 HydrophobicContact CD-CE 4.08Å; K385-M388 PolarHBondContact N-SD 2.78Å; K385-M388 VanDerWaalsContact N-SD 3.39Å; K385-M388 VanDerWaalsContact O-CB 3.3Å; K385-M388 WeakPolarHBondContact O-CB 3.41Å; K385-M388 WeakPolarHBondContact O-CG 3.23Å; K385-M388 PolarHBondContact O-N 2.81Å; K385-M388 VanDerWaalsContact O-N 3.11Å; E386-M388 PolarHBondContact O-N 2.87Å; M388-I406 HydrophobicContact CB-CD1 4.03Å; M388-I406 HydrophobicContact CB-CG1 4.45Å; M388-I406 PolarHBondContact O-N 2.87Å
389	K	94.9	Very high	89.5	Confident	7 Å²	7	56.3 Å²	56.3	3%	0.03	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.9	173.8	-64.4	-169.4	-171.7	-72	0	112.4	Y25 L26 T29 S31 T32 V34 V403 A404 T405 E419 L440	Y25-K389 HydrophobicContact CD1-CD 4.39Å; Y25-K389 HydrophobicContact CE1-CD 3.43Å; Y25-K389 VanDerWaalsContact CE1-CD 3.43Å; Y25-K389 VanDerWaalsContact OH-CE 3.27Å; Y25-K389 WeakPolarHBondContact OH-CE 3.46Å; Y25-K389 PolarHBondContact OH-NZ 2.77Å; Y25-K389 VanDerWaalsContact OH-NZ 3.11Å; L26-K389 HydrophobicContact CD2-CB 4.38Å; L26-K389 HydrophobicContact CD2-CD 4.17Å; T29-K389 VanDerWaalsContact OG1-CE 3.24Å; T29-K389 WeakPolarHBondContact OG1-CE 3.28Å; S31-K389 WeakPolarHBondContact OG-CD 3.42Å; S31-K389 WeakPolarHBondContact OG-CE 3.36Å; T32-K389 PolarHBondContact O-N 2.61Å; V34-K389 PolarHBondContact N-O 2.9Å; K389-V403 HydrophobicContact CD-CG1 4.43Å; K389-A404 VanDerWaalsContact CA-O 3.26Å; K389-A404 WeakPolarHBondContact CA-O 3.15Å; K389-T405 PolarHBondContact NZ-OG1 3.31Å; K389-E419 IonicContact NZ-OE1 3.22Å; K389-E419 PolarHBondContact NZ-OE1 2.88Å; K389-E419 IonicContact NZ-OE2 3.82Å; K389-L440 HydrophobicContact CB-CD1 4.34Å; K389-L440 HydrophobicContact CB-CD2 4.44Å
390	L	95.7	Very high	90.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	173.7	177	60.6	81.4	0	0	0	109.7	V34 F39 F384 A392 A404 I406 L414 L416 I437 F438 L440	V34-L390 HydrophobicContact CG2-CB 4.08Å; V34-L390 HydrophobicContact CG2-CD2 4.09Å; F39-L390 HydrophobicContact CE1-CB 4.33Å; F39-L390 HydrophobicContact CE1-CD2 4.26Å; F39-L390 HydrophobicContact CZ-CB 3.81Å; F39-L390 HydrophobicContact CZ-CD2 4.23Å; F384-L390 HydrophobicContact CD1-CD2 4.35Å; F384-L390 HydrophobicContact CE1-CD2 4.1Å; L390-A392 HydrophobicContact CD1-CB 3.66Å; L390-A404 HydrophobicContact CD1-CB 3.91Å; L390-A404 PolarHBondContact N-O 3.2Å; L390-A404 PolarHBondContact O-N 3.2Å; L390-I406 HydrophobicContact CD2-CD1 4.14Å; L390-I406 HydrophobicContact CD2-CG1 4.24Å; L390-L414 HydrophobicContact CD2-CD1 4.46Å; L390-L416 HydrophobicContact CD1-CD1 4.04Å; L390-L416 HydrophobicContact CD2-CD2 4.26Å; L390-I437 HydrophobicContact CD1-CB 4.12Å; L390-I437 HydrophobicContact CD1-CG2 4.18Å; L390-F438 WeakPolarHBondContact CB-O 3.49Å; L390-L440 VanDerWaalsContact C-CD2 3.43Å; L390-L440 VanDerWaalsContact CA-CD2 3.45Å
391	E	95.3	Very high	92	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.8	169.6	-72	175.7	-165	0	0	108.8	W22 V401 C402 F438 L440 G441 W442 C443 L450	W22-E391 HydrophobicContact CH2-CG 4.39Å; W22-E391 HydrophobicContact CZ2-CG 4.35Å; W22-E391 VanDerWaalsContact CZ2-OE1 3.28Å; W22-E391 WeakPolarHBondContact CZ2-OE1 3.23Å; E391-V401 HydrophobicContact CB-CG1 3.95Å; E391-C402 WeakPolarHBondContact CA-O 3.36Å; E391-F438 HydrophobicContact CB-CB 4.25Å; E391-F438 PolarHBondContact N-O 3.03Å; E391-F438 PolarHBondContact O-N 2.83Å; E391-L440 HydrophobicContact CG-CD2 4.13Å; E391-G441 WeakPolarHBondContact OE1-CA 3.33Å; E391-G441 PolarHBondContact OE1-N 2.91Å; E391-W442 WeakPolarHBondContact OE2-CB 3.34Å; E391-W442 PolarHBondContact OE2-N 2.93Å; E391-C443 WeakPolarHBondContact OE2-CB 3.04Å; E391-C443 PolarHBondContact OE2-N 3Å; E391-C443 PolarHBondContact OE2-SG 3Å; E391-L450 HydrophobicContact CG-CD1 3.9Å
392	A	96.9	Very high	93	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.6	-177.2	0	0	0	0	0	113.6	L390 V401 C402 A404 L416 L418 Y428 I437	L390-A392 HydrophobicContact CD1-CB 3.66Å; A392-V401 CarbonylContact O-C 3.59Å; A392-V401 WeakPolarHBondContact O-CA 3.3Å; A392-C402 PolarHBondContact N-O 3.47Å; A392-C402 PolarHBondContact O-N 3.08Å; A392-A404 HydrophobicContact CB-CB 3.81Å; A392-L416 HydrophobicContact CB-CD1 3.87Å; A392-L418 HydrophobicContact CB-CD2 4.13Å; A392-Y428 VanDerWaalsContact CB-OH 3.28Å; A392-Y428 WeakPolarHBondContact CB-OH 3.13Å; A392-I437 HydrophobicContact CB-CG2 4.08Å
393	V	95.6	Very high	93.2	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.042	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138.4	-179.6	178.6	0	0	0	0	110.8	R191 P395 P398 V401 Y428 D436 F438	R191-V393 VanDerWaalsContact NH2-CG1 3.35Å; R191-V393 VanDerWaalsContact NH2-CG2 3.28Å; V393-P395 VanDerWaalsContact O-CD 3.26Å; V393-P395 WeakPolarHBondContact O-CD 3.42Å; V393-P398 HydrophobicContact CG1-CB 4.18Å; V393-V401 HydrophobicContact CG2-CG2 4.03Å; V393-Y428 PolarHBondContact O-OH 2.85Å; V393-D436 HydrophobicContact CB-CB 3.92Å; V393-D436 HydrophobicContact CG2-CB 3.77Å; V393-D436 WeakPolarHBondContact CG2-O 3.42Å; V393-D436 WeakPolarHBondContact CG2-OD1 3.41Å; V393-D436 PolarHBondContact N-O 2.83Å; V393-D436 VanDerWaalsContact N-O 3.07Å; V393-F438 HydrophobicContact CG2-CE2 3.86Å
394	N	93.8	Very high	93.7	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	111.8	170.1	-176.9	-14.3	0	0	0	110.3	L396 L397 E400 L418 S421	N394-L396 PolarHBondContact O-N 3.47Å; N394-L396 VanDerWaalsContact O-N 3.09Å; N394-L396 PolarHBondContact OD1-N 3.01Å; N394-L397 HydrophobicContact CB-CB 4.24Å; N394-L397 CarbonylContact O-C 3.54Å; N394-L397 PolarHBondContact O-N 3.34Å; N394-L397 PolarHBondContact OD1-N 2.81Å; N394-E400 HydrophobicContact CB-CB 4.15Å; N394-E400 HydrophobicContact CB-CG 4.33Å; N394-E400 WeakPolarHBondContact CB-O 3.5Å; N394-E400 PolarHBondContact N-O 2.75Å; N394-E400 PolarHBondContact ND2-OE2 3.49Å; N394-L418 HydrophobicContact CB-CD1 3.92Å; N394-S421 PolarHBondContact ND2-OG 2.75Å
395	P	92.2	Very high	93.8	Very high	32 Å²	32	33.1 Å²	33.1	21%	0.208	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.3	-176.9	27	-36.2	0	0	0	113.6	P289 V393 I425 Y428	P289-P395 HydrophobicContact CG-CB 3.7Å; P289-P395 HydrophobicContact CG-CG 3.86Å; V393-P395 VanDerWaalsContact O-CD 3.26Å; V393-P395 WeakPolarHBondContact O-CD 3.42Å; P395-I425 HydrophobicContact CG-CD1 4.01Å; P395-Y428 HydrophobicContact CG-CD1 4.47Å; P395-Y428 HydrophobicContact CG-CD2 3.9Å; P395-Y428 HydrophobicContact CG-CE2 4.13Å; P395-Y428 HydrophobicContact CG-CG 4.06Å
396	L	90	Very high	93.9	Very high	85 Å²	85	27.3 Å²	27.3	45%	0.445	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.3	174.6	-55.7	-171	0	0	0	113.6	F290 N394 I425	F290-L396 HydrophobicContact CE2-CD1 4.32Å; F290-L396 HydrophobicContact CE2-CD2 4.14Å; F290-L396 HydrophobicContact CE2-CG 4.48Å; F290-L396 HydrophobicContact CZ-CD1 3.91Å; F290-L396 HydrophobicContact CZ-CD2 3.96Å; F290-L396 HydrophobicContact CZ-CG 3.9Å; N394-L396 PolarHBondContact O-N 3.47Å; N394-L396 VanDerWaalsContact O-N 3.09Å; N394-L396 PolarHBondContact OD1-N 3.01Å; L396-I425 HydrophobicContact CD1-CG2 3.75Å; L396-I425 HydrophobicContact CG-CG2 4.26Å
397	L	90.2	Very high	94	Very high	54 Å²	54	25.3 Å²	25.3	28%	0.283	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	75.8	178	-65.6	175	0	0	0	109.6	N394 E399 E400 K423	N394-L397 HydrophobicContact CB-CB 4.24Å; N394-L397 CarbonylContact O-C 3.54Å; N394-L397 PolarHBondContact O-N 3.34Å; N394-L397 PolarHBondContact OD1-N 2.81Å; L397-E399 PolarHBondContact O-N 3.28Å; L397-E400 HydrophobicContact CB-CB 4.26Å; L397-E400 WeakPolarHBondContact O-CB 3.48Å; L397-E400 PolarHBondContact O-N 3.4Å; L397-K423 HydrophobicContact CD1-CD 4.31Å
398	P	90.8	Very high	94.1	Very high	54 Å²	54	22 Å²	22	35%	0.351	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	-10.1	-168.7	-26.5	36.9	0	0	0	116.7	R191 W208 V393 E400	R191-P398 PolarHBondContact NH1-O 2.93Å; R191-P398 PolarHBondContact NH2-O 2.88Å; W208-P398 HydrophobicContact CB-CB 4.32Å; W208-P398 HydrophobicContact CG-CB 4.23Å; V393-P398 HydrophobicContact CG1-CB 4.18Å; P398-E400 VanDerWaalsContact C-N 3.28Å
399	E	90	Very high	94	Very high	113 Å²	113	22.4 Å²	22.4	53%	0.528	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-11.3	168.7	-59.5	-175.8	148.8	0	0	113.8	K193 W208 L397	K193-E399 VanDerWaalsContact CE-OE1 3.27Å; K193-E399 WeakPolarHBondContact CE-OE1 3.09Å; K193-E399 IonicContact NZ-OE1 2.74Å; K193-E399 PolarHBondContact NZ-OE1 3.27Å; W208-E399 HydrophobicContact CZ2-CG 4.28Å; L397-E399 PolarHBondContact O-N 3.28Å
400	E	92	Very high	93.9	Very high	3 Å²	3	26.1 Å²	26.1	1%	0.014	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.7	-176.6	176.8	174.7	-134.3	0	0	110.8	N394 L397 P398 S421 K422 S451	N394-E400 HydrophobicContact CB-CB 4.15Å; N394-E400 HydrophobicContact CB-CG 4.33Å; N394-E400 WeakPolarHBondContact CB-O 3.5Å; N394-E400 PolarHBondContact N-O 2.75Å; N394-E400 PolarHBondContact ND2-OE2 3.49Å; L397-E400 HydrophobicContact CB-CB 4.26Å; L397-E400 WeakPolarHBondContact O-CB 3.48Å; L397-E400 PolarHBondContact O-N 3.4Å; P398-E400 VanDerWaalsContact C-N 3.28Å; E400-S421 PolarHBondContact OE2-OG 3.39Å; E400-K422 VanDerWaalsContact OE1-CD 3.23Å; E400-K422 WeakPolarHBondContact OE1-CD 3.2Å; E400-K422 WeakPolarHBondContact OE1-CE 3.35Å; E400-K422 WeakPolarHBondContact OE1-CG 3.41Å; E400-K422 PolarHBondContact OE1-N 2.86Å; E400-K422 IonicContact OE1-NZ 3.62Å; E400-S451 WeakPolarHBondContact OE1-CB 3.3Å; E400-S451 PolarHBondContact OE1-OG 2.84Å
401	V	93.9	Very high	93.5	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.1	164	179.9	0	0	0	0	109.1	E391 A392 V393 W442 C443 L450 S451	E391-V401 HydrophobicContact CB-CG1 3.95Å; A392-V401 CarbonylContact O-C 3.59Å; A392-V401 WeakPolarHBondContact O-CA 3.3Å; V393-V401 HydrophobicContact CG2-CG2 4.03Å; V401-W442 HydrophobicContact CG2-CZ3 4.32Å; V401-C443 VanDerWaalsContact CG1-SG 3.58Å; V401-L450 HydrophobicContact CG1-CD1 4.2Å; V401-S451 PolarHBondContact O-N 2.92Å
402	C	93.8	Very high	93.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	162.3	-179.6	-66.5	0	0	0	0	111	E391 A392 L418 S421	E391-C402 WeakPolarHBondContact CA-O 3.36Å; A392-C402 PolarHBondContact N-O 3.47Å; A392-C402 PolarHBondContact O-N 3.08Å; C402-L418 HydrophobicContact CB-CB 4.1Å; C402-L418 HydrophobicContact CB-CD1 4.12Å; C402-L418 HydrophobicContact CB-CD2 4.05Å; C402-L418 HydrophobicContact CB-CG 4.31Å; C402-S421 VanDerWaalsContact SG-CA 3.58Å
403	V	93.8	Very high	93.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	134.1	159.6	-169.6	0	0	0	0	108.2	W22 Y25 K389 E419 L450 S451 P453	W22-V403 HydrophobicContact CH2-CG1 4.07Å; W22-V403 HydrophobicContact CH2-CG2 3.78Å; W22-V403 HydrophobicContact CZ3-CG1 3.98Å; W22-V403 HydrophobicContact CZ3-CG2 4.28Å; Y25-V403 HydrophobicContact CE1-CG1 3.89Å; K389-V403 HydrophobicContact CD-CG1 4.43Å; V403-E419 HydrophobicContact CB-CB 4.5Å; V403-E419 PolarHBondContact O-N 3.02Å; V403-L450 HydrophobicContact CG2-CD1 4.19Å; V403-L450 HydrophobicContact CG2-CD2 4Å; V403-L450 HydrophobicContact CG2-CG 4.15Å; V403-S451 PolarHBondContact N-O 2.71Å; V403-P453 HydrophobicContact CG2-CG 4.47Å
404	A	95.8	Very high	93.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	143.7	179.3	0	0	0	0	0	111.8	K389 L390 A392 L416 Q417 L418	K389-A404 VanDerWaalsContact CA-O 3.26Å; K389-A404 WeakPolarHBondContact CA-O 3.15Å; L390-A404 HydrophobicContact CD1-CB 3.91Å; L390-A404 PolarHBondContact N-O 3.2Å; L390-A404 PolarHBondContact O-N 3.2Å; A392-A404 HydrophobicContact CB-CB 3.81Å; A404-L416 HydrophobicContact CB-CB 4.49Å; A404-L416 HydrophobicContact CB-CD1 4.37Å; A404-Q417 WeakPolarHBondContact CA-O 3.46Å; A404-L418 HydrophobicContact CB-CD2 3.68Å
405	T	95.9	Very high	93.4	Very high	17 Å²	17	29.7 Å²	29.7	10%	0.104	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.8	172.8	-63.2	0	0	0	0	109.9	K389 T407 Q417 E419	K389-T405 PolarHBondContact NZ-OG1 3.31Å; T405-T407 PolarHBondContact O-N 2.9Å; T405-Q417 PolarHBondContact N-O 3.32Å; T405-Q417 PolarHBondContact O-N 2.79Å; T405-E419 PolarHBondContact OG1-OE1 2.83Å
406	I	97.6	Very high	93.7	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	109.2	173.1	-52.3	-175	0	0	0	108.8	V34 F384 N387 M388 L390 V409 L414 W415 L416	V34-I406 HydrophobicContact CG2-CD1 4Å; F384-I406 HydrophobicContact CB-CD1 4.12Å; F384-I406 HydrophobicContact CD1-CD1 3.88Å; N387-I406 PolarHBondContact N-O 2.86Å; M388-I406 HydrophobicContact CB-CD1 4.03Å; M388-I406 HydrophobicContact CB-CG1 4.45Å; M388-I406 PolarHBondContact O-N 2.87Å; L390-I406 HydrophobicContact CD2-CD1 4.14Å; L390-I406 HydrophobicContact CD2-CG1 4.24Å; I406-V409 HydrophobicContact CG2-CG2 3.56Å; I406-L414 HydrophobicContact CD1-CD1 4.24Å; I406-L414 HydrophobicContact CD1-CD2 4.35Å; I406-L414 HydrophobicContact CG2-CD2 4.28Å; I406-W415 CarbonylContact C-O 3.54Å; I406-W415 WeakPolarHBondContact CA-O 3.39Å; I406-L416 HydrophobicContact CB-CD2 4.39Å; I406-L416 HydrophobicContact CG1-CD2 3.78Å
407	T	96.8	Very high	94	Very high	56 Å²	56	27.5 Å²	27.5	34%	0.344	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-37	178.8	53.2	0	0	0	0	112.2	T405 W415 Q417 E427	T405-T407 PolarHBondContact O-N 2.9Å; T407-W415 PolarHBondContact N-O 3.42Å; T407-W415 WeakPolarHBondContact OG1-CB 3.45Å; T407-W415 PolarHBondContact OG1-O 3.35Å; T407-Q417 HydrophobicContact CG2-CB 3.67Å; T407-E427 WeakPolarHBondContact CB-OE2 3.42Å; T407-E427 PolarHBondContact OG1-OE2 2.78Å
408	A	95.4	Very high	94.2	Very high	13 Å²	13	25.5 Å²	25.5	11%	0.107	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	153.2	176	0	0	0	0	0	112.5	E386 W415	E386-A408 WeakPolarHBondContact OE1-CA 3.33Å; A408-W415 HydrophobicContact CB-CB 3.98Å; A408-W415 HydrophobicContact CB-CD2 4.3Å; A408-W415 HydrophobicContact CB-CE3 4.35Å; A408-W415 HydrophobicContact CB-CG 4.12Å; A408-W415 PolarHBondContact O-N 3.46Å
409	V	94.4	Very high	94.1	Very high	26 Å²	26	25.2 Å²	25.2	16%	0.158	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120.9	173.4	-178.7	0	0	0	0	110.1	H382 E386 I406 L414	H382-V409 WeakPolarHBondContact CE1-CG1 3.45Å; E386-V409 HydrophobicContact CG-CB 4.37Å; E386-V409 HydrophobicContact CG-CG2 3.97Å; E386-V409 PolarHBondContact OE1-N 2.8Å; I406-V409 HydrophobicContact CG2-CG2 3.56Å; V409-L414 HydrophobicContact CB-CD2 4.47Å; V409-L414 HydrophobicContact CG1-CD2 4.16Å; V409-L414 HydrophobicContact CG2-CD2 3.85Å
410	R	92.1	Very high	93.5	Very high	84 Å²	84	21 Å²	21	32%	0.317	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	105.8	178.9	-56.9	-66.1	175.5	-92.1	-4.7	110.1	W337 N341 L343 E386 S412 Y413 W415	W337-R410 HydrophobicContact CH2-CB 4.34Å; N341-R410 HydrophobicContact CB-CB 4.42Å; L343-R410 HydrophobicContact CD1-CG 4.37Å; L343-R410 HydrophobicContact CD2-CG 4.42Å; E386-R410 IonicContact OE1-CZ 2.64Å; E386-R410 IonicContact OE1-NH1 3.7Å; E386-R410 PolarHBondContact OE1-NH1 2.91Å; E386-R410 IonicContact OE1-NH2 3.7Å; R410-S412 PolarHBondContact O-N 2.75Å; R410-Y413 PolarHBondContact N-O 3.45Å; R410-Y413 PolarHBondContact O-N 2.61Å; R410-Y413 VanDerWaalsContact O-N 3.14Å; R410-W415 HydrophobicContact CB-CH2 4.19Å; R410-W415 HydrophobicContact CB-CZ3 3.76Å; R410-W415 HydrophobicContact CG-CE3 4.42Å; R410-W415 HydrophobicContact CG-CH2 4.3Å; R410-W415 HydrophobicContact CG-CZ3 3.91Å
411	G	88.3	Confident	93.2	Very high	32 Å²	32	21.9 Å²	21.9	33%	0.33	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-127.3	-170.9	0	0	0	0	0	111.4	H382 Y413	H382-G411 PolarHBondContact NE2-O 2.97Å; G411-Y413 VanDerWaalsContact C-N 3.27Å; G411-Y413 PolarHBondContact O-N 3.01Å
412	S	90.6	Very high	92.5	Very high	13 Å²	13	28.7 Å²	28.7	9%	0.091	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	16.5	177	59.2	0	0	0	0	114.2	R410 S431 V432	R410-S412 PolarHBondContact O-N 2.75Å; S412-S431 WeakPolarHBondContact O-CA 3.45Å; S412-V432 WeakPolarHBondContact O-CG2 3.37Å; S412-V432 PolarHBondContact O-N 2.94Å
413	Y	94	Very high	91.9	Very high	18 Å²	18	35 Å²	35	7%	0.071	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.4	-174.6	-67.5	-92.6	0	0	0	112.7	G331 F333 W337 R410 G411 I429 V430	G331-Y413 PolarHBondContact N-OH 2.69Å; F333-Y413 HydrophobicContact CD1-CE2 4.11Å; F333-Y413 HydrophobicContact CE1-CD1 4.23Å; F333-Y413 AromaticContact CE1-CD2 3.71Å; F333-Y413 HydrophobicContact CE1-CD2 3.71Å; F333-Y413 AromaticContact CE1-CE1 3.95Å; F333-Y413 HydrophobicContact CE1-CE1 3.95Å; F333-Y413 AromaticContact CE1-CE2 3.4Å; F333-Y413 HydrophobicContact CE1-CE2 3.4Å; F333-Y413 VanDerWaalsContact CE1-CE2 3.4Å; F333-Y413 HydrophobicContact CE1-CG 4.11Å; F333-Y413 AromaticContact CE1-CZ 3.52Å; F333-Y413 HydrophobicContact CZ-CD1 4.22Å; F333-Y413 HydrophobicContact CZ-CD2 4.48Å; F333-Y413 AromaticContact CZ-CE1 3.96Å; F333-Y413 HydrophobicContact CZ-CE1 3.96Å; F333-Y413 HydrophobicContact CZ-CE2 4.25Å; F333-Y413 HydrophobicContact CZ-CG 4.47Å; F333-Y413 AromaticContact CZ-CZ 3.97Å; W337-Y413 HydrophobicContact CH2-CD2 4.27Å; W337-Y413 HydrophobicContact CZ2-CD2 4.13Å; R410-Y413 PolarHBondContact N-O 3.45Å; R410-Y413 PolarHBondContact O-N 2.61Å; R410-Y413 VanDerWaalsContact O-N 3.14Å; G411-Y413 VanDerWaalsContact C-N 3.27Å; G411-Y413 PolarHBondContact O-N 3.01Å; Y413-I429 HydrophobicContact CD1-CG2 4.14Å; Y413-V430 WeakPolarHBondContact CA-O 3.37Å
414	L	96.4	Very high	91.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.1	-177.9	-50.7	177.9	0	0	0	109.6	F384 L390 I406 V409 L416 I429 V430 V432 I437	F384-L414 HydrophobicContact CB-CD1 4.46Å; F384-L414 HydrophobicContact CB-CD2 3.72Å; F384-L414 HydrophobicContact CD1-CD1 3.6Å; F384-L414 HydrophobicContact CD1-CD2 4.42Å; F384-L414 HydrophobicContact CE1-CD1 3.9Å; F384-L414 HydrophobicContact CG-CD1 4.06Å; F384-L414 HydrophobicContact CG-CD2 4.16Å; L390-L414 HydrophobicContact CD2-CD1 4.46Å; I406-L414 HydrophobicContact CD1-CD1 4.24Å; I406-L414 HydrophobicContact CD1-CD2 4.35Å; I406-L414 HydrophobicContact CG2-CD2 4.28Å; V409-L414 HydrophobicContact CB-CD2 4.47Å; V409-L414 HydrophobicContact CG1-CD2 4.16Å; V409-L414 HydrophobicContact CG2-CD2 3.85Å; L414-L416 HydrophobicContact CB-CD2 4.25Å; L414-L416 HydrophobicContact CB-CG 4.47Å; L414-I429 WeakPolarHBondContact O-CA 3.36Å; L414-V430 HydrophobicContact CB-CG1 3.96Å; L414-V430 HydrophobicContact CD1-CG1 4.49Å; L414-V430 PolarHBondContact N-O 2.9Å; L414-V430 PolarHBondContact O-N 2.82Å; L414-V432 HydrophobicContact CD1-CG1 4.15Å; L414-V432 HydrophobicContact CD2-CG1 3.8Å; L414-V432 HydrophobicContact CG-CG1 3.84Å; L414-I437 HydrophobicContact CD1-CD1 4.2Å
415	W	97.4	Very high	91.3	Very high	21 Å²	21	42 Å²	42	8%	0.08	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.7	163.5	-77.4	-119.2	0	0	0	107.1	W337 L343 I406 T407 A408 R410 Y428 I429	W337-W415 HydrophobicContact CH2-CH2 4.35Å; W337-W415 HydrophobicContact CZ3-CH2 4.47Å; L343-W415 HydrophobicContact CD1-CH2 3.47Å; L343-W415 VanDerWaalsContact CD1-CH2 3.47Å; L343-W415 HydrophobicContact CD1-CZ2 3.56Å; L343-W415 HydrophobicContact CD2-CH2 4.22Å; L343-W415 HydrophobicContact CD2-CZ2 3.73Å; L343-W415 HydrophobicContact CG-CZ2 4.29Å; I406-W415 CarbonylContact C-O 3.54Å; I406-W415 WeakPolarHBondContact CA-O 3.39Å; T407-W415 PolarHBondContact N-O 3.42Å; T407-W415 WeakPolarHBondContact OG1-CB 3.45Å; T407-W415 PolarHBondContact OG1-O 3.35Å; A408-W415 HydrophobicContact CB-CB 3.98Å; A408-W415 HydrophobicContact CB-CD2 4.3Å; A408-W415 HydrophobicContact CB-CE3 4.35Å; A408-W415 HydrophobicContact CB-CG 4.12Å; A408-W415 PolarHBondContact O-N 3.46Å; R410-W415 HydrophobicContact CB-CH2 4.19Å; R410-W415 HydrophobicContact CB-CZ3 3.76Å; R410-W415 HydrophobicContact CG-CE3 4.42Å; R410-W415 HydrophobicContact CG-CH2 4.3Å; R410-W415 HydrophobicContact CG-CZ3 3.91Å; W415-Y428 WeakPolarHBondContact CA-O 3.28Å; W415-I429 HydrophobicContact CD2-CG1 4.27Å; W415-I429 HydrophobicContact CH2-CD1 4.46Å; W415-I429 HydrophobicContact CH2-CG2 4.12Å; W415-I429 HydrophobicContact CZ2-CD1 3.63Å; W415-I429 HydrophobicContact CZ2-CG1 3.83Å; W415-I429 HydrophobicContact CZ2-CG2 4.23Å; W415-I429 HydrophobicContact CZ3-CG2 4.42Å
416	L	97.6	Very high	91.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.3	-177.8	-64.9	-171.5	0	0	0	111	L390 A392 A404 I406 L414 E427 Y428 V430 I437	L390-L416 HydrophobicContact CD1-CD1 4.04Å; L390-L416 HydrophobicContact CD2-CD2 4.26Å; A392-L416 HydrophobicContact CB-CD1 3.87Å; A404-L416 HydrophobicContact CB-CB 4.49Å; A404-L416 HydrophobicContact CB-CD1 4.37Å; I406-L416 HydrophobicContact CB-CD2 4.39Å; I406-L416 HydrophobicContact CG1-CD2 3.78Å; L414-L416 HydrophobicContact CB-CD2 4.25Å; L414-L416 HydrophobicContact CB-CG 4.47Å; L416-E427 VanDerWaalsContact O-CA 3.28Å; L416-E427 WeakPolarHBondContact O-CA 3.49Å; L416-Y428 HydrophobicContact CB-CD1 4.08Å; L416-Y428 HydrophobicContact CB-CE1 3.6Å; L416-Y428 HydrophobicContact CD1-CE1 4.37Å; L416-Y428 PolarHBondContact N-O 3.33Å; L416-Y428 VanDerWaalsContact O-CD1 3.26Å; L416-Y428 WeakPolarHBondContact O-CD1 3.07Å; L416-Y428 PolarHBondContact O-N 3.35Å; L416-Y428 VanDerWaalsContact O-N 3.09Å; L416-V430 HydrophobicContact CD1-CG1 3.6Å; L416-V430 HydrophobicContact CG-CG1 3.83Å; L416-I437 HydrophobicContact CD1-CG2 3.82Å
417	Q	96.3	Very high	91	Very high	72 Å²	72	48.6 Å²	48.6	34%	0.336	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	117.2	163.6	179.2	60	74.9	0	0	109.1	A404 T405 T407	A404-Q417 WeakPolarHBondContact CA-O 3.46Å; T405-Q417 PolarHBondContact N-O 3.32Å; T405-Q417 PolarHBondContact O-N 2.79Å; T407-Q417 HydrophobicContact CG2-CB 3.67Å
418	L	94.5	Very high	90.9	Very high	11 Å²	11	46.5 Å²	46.5	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	138.4	170.3	-59	-169.6	0	0	0	111	A392 N394 C402 A404 I425 Y428	A392-L418 HydrophobicContact CB-CD2 4.13Å; N394-L418 HydrophobicContact CB-CD1 3.92Å; C402-L418 HydrophobicContact CB-CB 4.1Å; C402-L418 HydrophobicContact CB-CD1 4.12Å; C402-L418 HydrophobicContact CB-CD2 4.05Å; C402-L418 HydrophobicContact CB-CG 4.31Å; A404-L418 HydrophobicContact CB-CD2 3.68Å; L418-I425 HydrophobicContact CD1-CD1 3.58Å; L418-I425 HydrophobicContact CD1-CG1 4.26Å; L418-I425 HydrophobicContact CG-CD1 4.08Å; L418-I425 HydrophobicContact CG-CG1 4.48Å; L418-Y428 HydrophobicContact CD1-CE1 4.23Å; L418-Y428 HydrophobicContact CD2-CE1 3.65Å; L418-Y428 HydrophobicContact CG-CD1 4.49Å; L418-Y428 HydrophobicContact CG-CE1 3.75Å
419	E	89.9	Confident	91	Very high	49 Å²	49	46.4 Å²	46.4	23%	0.229	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	147.2	170	-61.5	176.9	-136	0	0	109.6	Y25 K389 V403 T405 S421 P453	Y25-E419 PolarHBondContact OH-OE1 2.77Å; Y25-E419 PolarHBondContact OH-OE2 2.94Å; K389-E419 IonicContact NZ-OE1 3.22Å; K389-E419 PolarHBondContact NZ-OE1 2.88Å; K389-E419 IonicContact NZ-OE2 3.82Å; V403-E419 HydrophobicContact CB-CB 4.5Å; V403-E419 PolarHBondContact O-N 3.02Å; T405-E419 PolarHBondContact OG1-OE1 2.83Å; E419-S421 PolarHBondContact O-N 2.93Å; E419-S421 VanDerWaalsContact O-N 3.15Å; E419-P453 HydrophobicContact CB-CB 4.25Å; E419-P453 HydrophobicContact CB-CG 3.81Å; E419-P453 WeakPolarHBondContact OE2-CG 3.18Å
420	G	77.1	Confident	91.1	Very high	25 Å²	25	46 Å²	46	26%	0.258	24%	0.244	S	C	.	.	S	Bend	trans	80.9	-20.2	176.2	0	0	0	0	0	116.5	T452	G420-T452 WeakPolarHBondContact CA-O 3.38Å
421	S	85.1	Confident	91.2	Very high	20 Å²	20	42.5 Å²	42.5	14%	0.14	23%	0.232	C	C	.	.			trans	-41.3	135.3	176.9	176.1	0	0	0	0	113.9	N394 E400 C402 E419 K423	N394-S421 PolarHBondContact ND2-OG 2.75Å; E400-S421 PolarHBondContact OE2-OG 3.39Å; C402-S421 VanDerWaalsContact SG-CA 3.58Å; E419-S421 PolarHBondContact O-N 2.93Å; E419-S421 VanDerWaalsContact O-N 3.15Å; S421-K423 PolarHBondContact O-N 3.29Å; S421-K423 VanDerWaalsContact O-N 3.14Å; S421-K423 PolarHBondContact OG-N 3.42Å; S421-K423 PolarHBondContact OG-O 2.87Å
422	K	78.7	Confident	91.4	Very high	144 Å²	144	41.4 Å²	41.4	63%	0.626	22%	0.219	S	C	*	.	S	Bend	trans	-55.6	-28.8	175.9	-70.3	153.7	-163.6	164.6	0	113.1	E400	E400-K422 VanDerWaalsContact OE1-CD 3.23Å; E400-K422 WeakPolarHBondContact OE1-CD 3.2Å; E400-K422 WeakPolarHBondContact OE1-CE 3.35Å; E400-K422 WeakPolarHBondContact OE1-CG 3.41Å; E400-K422 PolarHBondContact OE1-N 2.86Å; E400-K422 IonicContact OE1-NZ 3.62Å
423	K	82.3	Confident	91.4	Very high	134 Å²	134	44.3 Å²	44.3	58%	0.583	23%	0.231	S	C	*	.	S	Bend	trans	-129.4	122.6	174.6	-65.3	177.9	-175.4	170.5	0	108.8	L397 S421 I425	L397-K423 HydrophobicContact CD1-CD 4.31Å; S421-K423 PolarHBondContact O-N 3.29Å; S421-K423 VanDerWaalsContact O-N 3.14Å; S421-K423 PolarHBondContact OG-N 3.42Å; S421-K423 PolarHBondContact OG-O 2.87Å; K423-I425 PolarHBondContact O-N 3Å
424	P	85.5	Confident	91.4	Very high	130 Å²	130	44.4 Å²	44.4	84%	0.844	24%	0.235	S	C	*	.			trans	-62.7	128.5	175	27.2	-33.4	0	0	0	109.7
425	I	91	Very high	91.2	Very high	16 Å²	16	46.3 Å²	46.3	8%	0.082	24%	0.244	C	C	.	.			trans	-115.4	157.9	173.3	63.7	172	0	0	0	109.1	F290 P395 L396 L418 K423 Y428	F290-I425 HydrophobicContact CE1-CB 4.17Å; F290-I425 HydrophobicContact CE1-CD1 4.23Å; F290-I425 HydrophobicContact CZ-CB 4.48Å; P395-I425 HydrophobicContact CG-CD1 4.01Å; L396-I425 HydrophobicContact CD1-CG2 3.75Å; L396-I425 HydrophobicContact CG-CG2 4.26Å; L418-I425 HydrophobicContact CD1-CD1 3.58Å; L418-I425 HydrophobicContact CD1-CG1 4.26Å; L418-I425 HydrophobicContact CG-CD1 4.08Å; L418-I425 HydrophobicContact CG-CG1 4.48Å; K423-I425 PolarHBondContact O-N 3Å; I425-Y428 HydrophobicContact CD1-CD1 4.26Å
426	P	92.4	Very high	91.1	Very high	76 Å²	76	48.3 Å²	48.3	49%	0.494	26%	0.256	S	S	.	.			trans	-58.2	165.4	167.2	-18.6	31.3	0	0	0	111.5	F290	F290-P426 HydrophobicContact CB-CB 4.26Å; F290-P426 HydrophobicContact CB-CG 4.41Å; F290-P426 HydrophobicContact CD1-CB 3.78Å; F290-P426 HydrophobicContact CD1-CG 3.91Å; F290-P426 HydrophobicContact CE1-CB 4.49Å; F290-P426 HydrophobicContact CE1-CG 4.39Å; F290-P426 HydrophobicContact CG-CB 4.16Å; F290-P426 HydrophobicContact CG-CG 4.04Å
427	E	94.4	Very high	91.1	Very high	81 Å²	81	48.3 Å²	48.3	38%	0.379	26%	0.257	S	S	.	.			trans	-58.4	143.7	162.7	62.7	178.6	-177	0	0	110.3	T407 L416	T407-E427 WeakPolarHBondContact CB-OE2 3.42Å; T407-E427 PolarHBondContact OG1-OE2 2.78Å; L416-E427 VanDerWaalsContact O-CA 3.28Å; L416-E427 WeakPolarHBondContact O-CA 3.49Å
428	Y	96	Very high	90.9	Very high	11 Å²	11	44.9 Å²	44.9	4%	0.043	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	155.5	-176.1	74.2	-73.4	0	0	0	111.9	P289 A392 V393 P395 W415 L416 L418 I425 V430	P289-Y428 HydrophobicContact CB-CD2 4.48Å; P289-Y428 HydrophobicContact CG-CD2 4.05Å; P289-Y428 HydrophobicContact CG-CG 4.45Å; P289-Y428 CarbonylContact O-C 3.5Å; P289-Y428 WeakPolarHBondContact O-CA 3.45Å; P289-Y428 WeakPolarHBondContact O-CB 3.4Å; A392-Y428 VanDerWaalsContact CB-OH 3.28Å; A392-Y428 WeakPolarHBondContact CB-OH 3.13Å; V393-Y428 PolarHBondContact O-OH 2.85Å; P395-Y428 HydrophobicContact CG-CD1 4.47Å; P395-Y428 HydrophobicContact CG-CD2 3.9Å; P395-Y428 HydrophobicContact CG-CE2 4.13Å; P395-Y428 HydrophobicContact CG-CG 4.06Å; W415-Y428 WeakPolarHBondContact CA-O 3.28Å; L416-Y428 HydrophobicContact CB-CD1 4.08Å; L416-Y428 HydrophobicContact CB-CE1 3.6Å; L416-Y428 HydrophobicContact CD1-CE1 4.37Å; L416-Y428 PolarHBondContact N-O 3.33Å; L416-Y428 VanDerWaalsContact O-CD1 3.26Å; L416-Y428 WeakPolarHBondContact O-CD1 3.07Å; L416-Y428 PolarHBondContact O-N 3.35Å; L416-Y428 VanDerWaalsContact O-N 3.09Å; L418-Y428 HydrophobicContact CD1-CE1 4.23Å; L418-Y428 HydrophobicContact CD2-CE1 3.65Å; L418-Y428 HydrophobicContact CG-CD1 4.49Å; L418-Y428 HydrophobicContact CG-CE1 3.75Å; I425-Y428 HydrophobicContact CD1-CD1 4.26Å; Y428-V430 HydrophobicContact CE2-CB 4.44Å
429	I	96.8	Very high	90.6	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.4	-170	-53.1	174.5	0	0	0	109	V284 P289 I292 Y413 L414 W415	V284-I429 HydrophobicContact CG1-CB 4.47Å; V284-I429 HydrophobicContact CG2-CB 4.05Å; V284-I429 HydrophobicContact CG2-CD1 4.11Å; V284-I429 HydrophobicContact CG2-CG2 3.91Å; P289-I429 PolarHBondContact O-N 2.78Å; I292-I429 HydrophobicContact CD1-CD1 4.26Å; I292-I429 HydrophobicContact CG1-CD1 3.76Å; Y413-I429 HydrophobicContact CD1-CG2 4.14Å; L414-I429 WeakPolarHBondContact O-CA 3.36Å; W415-I429 HydrophobicContact CD2-CG1 4.27Å; W415-I429 HydrophobicContact CH2-CD1 4.46Å; W415-I429 HydrophobicContact CH2-CG2 4.12Å; W415-I429 HydrophobicContact CZ2-CD1 3.63Å; W415-I429 HydrophobicContact CZ2-CG1 3.83Å; W415-I429 HydrophobicContact CZ2-CG2 4.23Å; W415-I429 HydrophobicContact CZ3-CG2 4.42Å
430	V	96.2	Very high	90.4	Very high	17 Å²	17	43.9 Å²	43.9	10%	0.103	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	149	179.3	69.2	0	0	0	0	111.1	Y413 L414 L416 Y428 S434 I437	Y413-V430 WeakPolarHBondContact CA-O 3.37Å; L414-V430 HydrophobicContact CB-CG1 3.96Å; L414-V430 HydrophobicContact CD1-CG1 4.49Å; L414-V430 PolarHBondContact N-O 2.9Å; L414-V430 PolarHBondContact O-N 2.82Å; L416-V430 HydrophobicContact CD1-CG1 3.6Å; L416-V430 HydrophobicContact CG-CG1 3.83Å; Y428-V430 HydrophobicContact CE2-CB 4.44Å; V430-S434 WeakPolarHBondContact CG2-OG 3.34Å; V430-I437 HydrophobicContact CG1-CG2 4.17Å; V430-I437 HydrophobicContact CG2-CG2 4.15Å
431	S	94.3	Very high	90.3	Very high	11 Å²	11	43.2 Å²	43.2	8%	0.077	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	146.9	172.3	176	0	0	0	0	111.1	S412 E433 S434	S412-S431 WeakPolarHBondContact O-CA 3.45Å; S431-E433 PolarHBondContact O-N 2.78Å; S431-E433 VanDerWaalsContact O-N 3.11Å; S431-E433 PolarHBondContact OG-N 3.33Å; S431-E433 VanDerWaalsContact OG-N 3.16Å; S431-S434 VanDerWaalsContact O-CB 3.28Å; S431-S434 WeakPolarHBondContact O-CB 3.44Å; S431-S434 PolarHBondContact O-N 3.05Å
432	V	93.2	Very high	90.3	Very high	10 Å²	10	42.6 Å²	42.6	6%	0.061	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.2	169.2	-64.8	0	0	0	0	113.6	F384 S412 L414	F384-V432 HydrophobicContact CB-CG1 4.49Å; F384-V432 HydrophobicContact CD2-CB 3.85Å; F384-V432 HydrophobicContact CD2-CG1 3.58Å; F384-V432 HydrophobicContact CE2-CB 3.66Å; F384-V432 HydrophobicContact CE2-CG1 3.92Å; F384-V432 HydrophobicContact CG-CG1 4.11Å; F384-V432 HydrophobicContact CZ-CB 4.38Å; S412-V432 WeakPolarHBondContact O-CG2 3.37Å; S412-V432 PolarHBondContact O-N 2.94Å; L414-V432 HydrophobicContact CD1-CG1 4.15Å; L414-V432 HydrophobicContact CD2-CG1 3.8Å; L414-V432 HydrophobicContact CG-CG1 3.84Å
433	E	90.6	Very high	90.3	Very high	73 Å²	73	35.8 Å²	35.8	34%	0.341	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	5.9	177.6	-54.2	-162.1	122.8	0	0	113.8	K40 I379 S431	K40-E433 IonicContact NZ-OE1 3.83Å; K40-E433 PolarHBondContact NZ-OE1 2.57Å; I379-E433 HydrophobicContact CD1-CG 3.88Å; I379-E433 VanDerWaalsContact CD1-OE2 3.31Å; I379-E433 WeakPolarHBondContact CD1-OE2 3.38Å; S431-E433 PolarHBondContact O-N 2.78Å; S431-E433 VanDerWaalsContact O-N 3.11Å; S431-E433 PolarHBondContact OG-N 3.33Å; S431-E433 VanDerWaalsContact OG-N 3.16Å
434	S	93.4	Very high	89.9	Confident	21 Å²	21	35.8 Å²	35.8	15%	0.147	20%	0.197	C	C	.	.			trans	-58.8	144.8	177.4	174.1	0	0	0	0	112.3	H41 V430 S431 D436 I437	H41-S434 PolarHBondContact CE1-O 3.12Å; H41-S434 PolarHBondContact ND1-O 3.28Å; V430-S434 WeakPolarHBondContact CG2-OG 3.34Å; S431-S434 VanDerWaalsContact O-CB 3.28Å; S431-S434 WeakPolarHBondContact O-CB 3.44Å; S431-S434 PolarHBondContact O-N 3.05Å; S434-D436 VanDerWaalsContact C-N 3.3Å; S434-D436 PolarHBondContact OG-N 3.12Å; S434-I437 WeakPolarHBondContact O-CG1 3.27Å
435	M	93.5	Very high	89	Confident	39 Å²	39	34.6 Å²	34.6	19%	0.192	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	10.3	176.2	-53.4	-175.8	-172.5	0	0	113.4	H41 Y210 L212 F438	H41-M435 HydrophobicContact CB-CG 4.22Å; Y210-M435 HydrophobicContact CD1-CB 4.14Å; Y210-M435 HydrophobicContact CD1-CG 4.24Å; Y210-M435 HydrophobicContact CD1-SD 3.66Å; Y210-M435 HydrophobicContact CD2-CB 4.48Å; Y210-M435 HydrophobicContact CG-CB 3.83Å; Y210-M435 HydrophobicContact CG-CG 4.4Å; Y210-M435 HydrophobicContact CG-SD 4.03Å; L212-M435 HydrophobicContact CB-CE 4.26Å; L212-M435 HydrophobicContact CB-SD 4.32Å; M435-F438 WeakPolarHBondContact O-CE1 3.49Å; M435-F438 WeakPolarHBondContact O-CZ 3.14Å
436	D	95.1	Very high	88.1	Confident	63 Å²	63	35.5 Å²	35.5	34%	0.337	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	16.3	179.3	-76.6	-57.6	0	0	0	112.9	R191 V393 S434	R191-D436 IonicContact CZ-OD1 2.68Å; R191-D436 IonicContact NE-OD1 2.85Å; R191-D436 PolarHBondContact NE-OD1 2.98Å; R191-D436 IonicContact NH2-OD1 2.64Å; R191-D436 PolarHBondContact NH2-OD1 3.5Å; V393-D436 HydrophobicContact CB-CB 3.92Å; V393-D436 HydrophobicContact CG2-CB 3.77Å; V393-D436 WeakPolarHBondContact CG2-O 3.42Å; V393-D436 WeakPolarHBondContact CG2-OD1 3.41Å; V393-D436 PolarHBondContact N-O 2.83Å; V393-D436 VanDerWaalsContact N-O 3.07Å; S434-D436 VanDerWaalsContact C-N 3.3Å; S434-D436 PolarHBondContact OG-N 3.12Å
437	I	96.3	Very high	87	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.1	172.4	59.7	173.2	0	0	0	110.2	F39 H41 F384 L390 A392 L414 L416 V430 S434	F39-I437 HydrophobicContact CD1-CG1 4.23Å; F39-I437 VanDerWaalsContact CD1-O 3.27Å; F39-I437 WeakPolarHBondContact CD1-O 3.43Å; F39-I437 HydrophobicContact CE1-CB 4.23Å; F39-I437 HydrophobicContact CE1-CD1 4.42Å; F39-I437 HydrophobicContact CE1-CG1 4.16Å; H41-I437 PolarHBondContact CE1-O 2.99Å; H41-I437 PolarHBondContact NE2-O 2.92Å; F384-I437 HydrophobicContact CE1-CD1 4.2Å; F384-I437 HydrophobicContact CZ-CD1 4.21Å; L390-I437 HydrophobicContact CD1-CB 4.12Å; L390-I437 HydrophobicContact CD1-CG2 4.18Å; A392-I437 HydrophobicContact CB-CG2 4.08Å; L414-I437 HydrophobicContact CD1-CD1 4.2Å; L416-I437 HydrophobicContact CD1-CG2 3.82Å; V430-I437 HydrophobicContact CG1-CG2 4.17Å; V430-I437 HydrophobicContact CG2-CG2 4.15Å; S434-I437 WeakPolarHBondContact O-CG1 3.27Å
438	F	93.2	Very high	86.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154	-166.7	-53.3	-65.8	0	0	0	112.6	F39 H41 V42 R191 L390 E391 V393 M435 W442	F39-F438 VanDerWaalsContact CE1-C 3.45Å; F39-F438 WeakPolarHBondContact CZ-O 3.37Å; H41-F438 AromaticContact NE2-CD1 3.51Å; H41-F438 AromaticContact NE2-CE1 3.31Å; H41-F438 VanDerWaalsContact NE2-CE1 3.31Å; H41-F438 WeakPolarHBondContact NE2-CE1 3.16Å; V42-F438 HydrophobicContact CG2-CD1 3.91Å; R191-F438 VanDerWaalsContact CD-CZ 3.47Å; R191-F438 HydrophobicContact CG-CE2 4.49Å; R191-F438 HydrophobicContact CG-CZ 3.8Å; L390-F438 WeakPolarHBondContact CB-O 3.49Å; E391-F438 HydrophobicContact CB-CB 4.25Å; E391-F438 PolarHBondContact N-O 3.03Å; E391-F438 PolarHBondContact O-N 2.83Å; V393-F438 HydrophobicContact CG2-CE2 3.86Å; M435-F438 WeakPolarHBondContact O-CE1 3.49Å; M435-F438 WeakPolarHBondContact O-CZ 3.14Å; F438-W442 HydrophobicContact CB-CB 3.67Å; F438-W442 HydrophobicContact CB-CD2 4.04Å; F438-W442 HydrophobicContact CB-CG 3.61Å; F438-W442 AromaticContact CD1-CD1 3.77Å; F438-W442 HydrophobicContact CD1-CD2 4.08Å; F438-W442 AromaticContact CD1-CE2 3.81Å; F438-W442 HydrophobicContact CD1-CG 4.11Å; F438-W442 HydrophobicContact CD1-CZ2 4.44Å; F438-W442 AromaticContact CD1-NE1 3.56Å; F438-W442 HydrophobicContact CD2-CD2 4.06Å; F438-W442 HydrophobicContact CD2-CE3 4.09Å; F438-W442 HydrophobicContact CD2-CZ3 4.45Å; F438-W442 HydrophobicContact CE1-CZ2 4.22Å; F438-W442 AromaticContact CE1-NE1 3.98Å; F438-W442 HydrophobicContact CE2-CH2 4.48Å; F438-W442 HydrophobicContact CE2-CZ2 4.48Å; F438-W442 HydrophobicContact CG-CB 4.4Å; F438-W442 AromaticContact CG-CD1 3.95Å; F438-W442 AromaticContact CG-CD2 3.77Å; F438-W442 HydrophobicContact CG-CD2 3.77Å; F438-W442 AromaticContact CG-CE2 3.98Å; F438-W442 HydrophobicContact CG-CE3 4.26Å; F438-W442 AromaticContact CG-CG 3.82Å; F438-W442 HydrophobicContact CG-CG 3.82Å; F438-W442 HydrophobicContact CZ-CZ2 4.26Å
439	P	88.4	Confident	85.9	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.026	22%	0.218	C	C	.	.			trans	-67.1	153.5	173.5	28	-33.3	0	0	0	111.6	Y36 F39 V42 G441 W442	Y36-P439 HydrophobicContact CD2-CB 3.79Å; Y36-P439 HydrophobicContact CD2-CG 3.56Å; Y36-P439 HydrophobicContact CE2-CB 4.32Å; Y36-P439 HydrophobicContact CE2-CG 3.62Å; Y36-P439 HydrophobicContact CG-CB 4.35Å; Y36-P439 HydrophobicContact CG-CG 4.2Å; F39-P439 HydrophobicContact CD2-CB 3.76Å; F39-P439 HydrophobicContact CD2-CG 4.09Å; F39-P439 HydrophobicContact CE2-CB 3.73Å; F39-P439 HydrophobicContact CE2-CG 4.47Å; V42-P439 HydrophobicContact CG1-CG 4.26Å; P439-G441 PolarHBondContact O-N 3.18Å; P439-W442 VanDerWaalsContact O-CB 3.27Å; P439-W442 WeakPolarHBondContact O-CB 3.38Å; P439-W442 PolarHBondContact O-N 2.93Å; P439-W442 VanDerWaalsContact O-N 3.1Å
440	L	84.8	Confident	85.5	Confident	35 Å²	35	37.8 Å²	37.8	18%	0.183	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	133.2	176	-56.5	-174.2	0	0	0	111	W22 L26 A33 K389 L390 E391	W22-L440 HydrophobicContact CD2-CB 4.27Å; W22-L440 HydrophobicContact CD2-CD1 4.35Å; W22-L440 HydrophobicContact CE3-CB 4.48Å; W22-L440 HydrophobicContact CE3-CD1 3.85Å; W22-L440 HydrophobicContact CE3-CD2 4.35Å; W22-L440 HydrophobicContact CE3-CG 4.46Å; W22-L440 HydrophobicContact CH2-CD2 3.68Å; W22-L440 HydrophobicContact CH2-CG 4.49Å; W22-L440 HydrophobicContact CZ2-CB 4.31Å; W22-L440 HydrophobicContact CZ2-CD2 4.23Å; W22-L440 HydrophobicContact CZ3-CD1 4.01Å; W22-L440 HydrophobicContact CZ3-CD2 3.76Å; W22-L440 HydrophobicContact CZ3-CG 4.35Å; L26-L440 HydrophobicContact CD1-CD1 4.22Å; L26-L440 HydrophobicContact CD2-CD1 4.15Å; A33-L440 HydrophobicContact CB-CD1 3.65Å; A33-L440 HydrophobicContact CB-CG 4.19Å; K389-L440 HydrophobicContact CB-CD1 4.34Å; K389-L440 HydrophobicContact CB-CD2 4.44Å; L390-L440 VanDerWaalsContact C-CD2 3.43Å; L390-L440 VanDerWaalsContact CA-CD2 3.45Å; E391-L440 HydrophobicContact CG-CD2 4.13Å
441	G	74.9	Confident	85	Confident	11 Å²	11	37.8 Å²	37.8	11%	0.113	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	2.9	-172.8	0	0	0	0	0	114.5	E391 P439 E444 T445	E391-G441 WeakPolarHBondContact OE1-CA 3.33Å; E391-G441 PolarHBondContact OE1-N 2.91Å; P439-G441 PolarHBondContact O-N 3.18Å; G441-E444 PolarHBondContact O-N 2.84Å; G441-T445 VanDerWaalsContact O-CB 3.27Å; G441-T445 WeakPolarHBondContact O-CB 3.42Å; G441-T445 PolarHBondContact O-N 2.95Å; G441-T445 PolarHBondContact O-OG1 3.07Å
442	W	84.5	Confident	84.1	Confident	6 Å²	6	40.2 Å²	40.2	2%	0.023	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-44.9	175.5	179.6	101	0	0	0	111.4	I188 R191 E391 V401 F438 P439 T445 N446 H448	I188-W442 HydrophobicContact CB-CH2 4.47Å; I188-W442 HydrophobicContact CG2-CH2 3.75Å; I188-W442 HydrophobicContact CG2-CZ3 4.25Å; I188-W442 WeakPolarHBondContact O-CH2 3.46Å; I188-W442 VanDerWaalsContact O-CZ2 3.3Å; I188-W442 WeakPolarHBondContact O-CZ2 3.33Å; R191-W442 HydrophobicContact CG-CH2 3.94Å; R191-W442 HydrophobicContact CG-CZ2 3.95Å; E391-W442 WeakPolarHBondContact OE2-CB 3.34Å; E391-W442 PolarHBondContact OE2-N 2.93Å; V401-W442 HydrophobicContact CG2-CZ3 4.32Å; F438-W442 HydrophobicContact CB-CB 3.67Å; F438-W442 HydrophobicContact CB-CD2 4.04Å; F438-W442 HydrophobicContact CB-CG 3.61Å; F438-W442 AromaticContact CD1-CD1 3.77Å; F438-W442 HydrophobicContact CD1-CD2 4.08Å; F438-W442 AromaticContact CD1-CE2 3.81Å; F438-W442 HydrophobicContact CD1-CG 4.11Å; F438-W442 HydrophobicContact CD1-CZ2 4.44Å; F438-W442 AromaticContact CD1-NE1 3.56Å; F438-W442 HydrophobicContact CD2-CD2 4.06Å; F438-W442 HydrophobicContact CD2-CE3 4.09Å; F438-W442 HydrophobicContact CD2-CZ3 4.45Å; F438-W442 HydrophobicContact CE1-CZ2 4.22Å; F438-W442 AromaticContact CE1-NE1 3.98Å; F438-W442 HydrophobicContact CE2-CH2 4.48Å; F438-W442 HydrophobicContact CE2-CZ2 4.48Å; F438-W442 HydrophobicContact CG-CB 4.4Å; F438-W442 AromaticContact CG-CD1 3.95Å; F438-W442 AromaticContact CG-CD2 3.77Å; F438-W442 HydrophobicContact CG-CD2 3.77Å; F438-W442 AromaticContact CG-CE2 3.98Å; F438-W442 HydrophobicContact CG-CE3 4.26Å; F438-W442 AromaticContact CG-CG 3.82Å; F438-W442 HydrophobicContact CG-CG 3.82Å; F438-W442 HydrophobicContact CZ-CZ2 4.26Å; P439-W442 VanDerWaalsContact O-CB 3.27Å; P439-W442 WeakPolarHBondContact O-CB 3.38Å; P439-W442 PolarHBondContact O-N 2.93Å; P439-W442 VanDerWaalsContact O-N 3.1Å; W442-T445 PolarHBondContact O-N 2.89Å; W442-N446 VanDerWaalsContact CD2-ND2 3.26Å; W442-N446 PolarHBondContact NE1-ND2 3.2Å; W442-N446 WeakPolarHBondContact O-CB 3.3Å; W442-N446 PolarHBondContact O-N 2.81Å; W442-N446 PolarHBondContact O-ND2 2.85Å; W442-H448 HydrophobicContact CZ3-CB 4.28Å
443	C	79.8	Confident	83.2	Confident	1 Å²	1	41 Å²	41	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-49.7	174	-87.4	0	0	0	0	111.8	E391 V401 T445 N446 G447 H448 L450	E391-C443 WeakPolarHBondContact OE2-CB 3.04Å; E391-C443 PolarHBondContact OE2-N 3Å; E391-C443 PolarHBondContact OE2-SG 3Å; V401-C443 VanDerWaalsContact CG1-SG 3.58Å; C443-T445 VanDerWaalsContact C-N 3.34Å; C443-T445 PolarHBondContact O-N 3.16Å; C443-N446 CarbonylContact O-C 3.47Å; C443-N446 PolarHBondContact O-N 2.98Å; C443-G447 PolarHBondContact O-N 3.48Å; C443-H448 WeakPolarHBondContact CB-O 3.27Å; C443-H448 PolarHBondContact O-N 3.38Å; C443-L450 HydrophobicContact CB-CB 3.83Å; C443-L450 HydrophobicContact CB-CD1 4.36Å
444	E	73.2	Confident	81.7	Confident	135 Å²	135	48.4 Å²	48.4	63%	0.631	27%	0.271	S	S	*	.	H	α-helix	trans	-59.5	-44.2	177.8	-174.1	-179	179	0	0	111.5	G441 N446 G447	G441-E444 PolarHBondContact O-N 2.84Å; E444-N446 VanDerWaalsContact C-N 3.3Å; E444-N446 PolarHBondContact O-N 3.35Å; E444-G447 PolarHBondContact O-N 3.25Å
445	T	66.4	Low	79.7	Confident	104 Å²	104	53 Å²	53	64%	0.638	29%	0.285	S	S	*	.	H	α-helix	trans	-64.6	-32.5	179.5	-59.5	0	0	0	0	112.7	G441 W442 C443	G441-T445 VanDerWaalsContact O-CB 3.27Å; G441-T445 WeakPolarHBondContact O-CB 3.42Å; G441-T445 PolarHBondContact O-N 2.95Å; G441-T445 PolarHBondContact O-OG1 3.07Å; W442-T445 PolarHBondContact O-N 2.89Å; C443-T445 VanDerWaalsContact C-N 3.34Å; C443-T445 PolarHBondContact O-N 3.16Å
446	N	73.7	Confident	76.8	Confident	35 Å²	35	55.2 Å²	55.2	19%	0.187	31%	0.309	C	S	.	.	H	α-helix	trans	-99.2	-1.8	-178.4	-66	-61.2	0	0	0	114.2	R45 I188 G189 W442 C443 E444 H448	R45-N446 PolarHBondContact NH1-ND2 3.12Å; R45-N446 PolarHBondContact NH1-OD1 3.44Å; R45-N446 PolarHBondContact NH2-OD1 2.88Å; I188-N446 HydrophobicContact CG2-CB 4.21Å; G189-N446 VanDerWaalsContact CA-OD1 3.23Å; G189-N446 WeakPolarHBondContact CA-OD1 3.46Å; W442-N446 VanDerWaalsContact CD2-ND2 3.26Å; W442-N446 PolarHBondContact NE1-ND2 3.2Å; W442-N446 WeakPolarHBondContact O-CB 3.3Å; W442-N446 PolarHBondContact O-N 2.81Å; W442-N446 PolarHBondContact O-ND2 2.85Å; C443-N446 CarbonylContact O-C 3.47Å; C443-N446 PolarHBondContact O-N 2.98Å; E444-N446 VanDerWaalsContact C-N 3.3Å; E444-N446 PolarHBondContact O-N 3.35Å; N446-H448 PolarHBondContact O-N 3.43Å
447	G	69.2	Low	73.9	Confident	70 Å²	70	62.1 Å²	62.1	72%	0.722	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	15.2	-174.6	0	0	0	0	0	114.8	C443 E444	C443-G447 PolarHBondContact O-N 3.48Å; E444-G447 PolarHBondContact O-N 3.25Å
448	H	81.6	Confident	70.8	Confident	19 Å²	19	67.7 Å²	67.7	9%	0.088	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-83.2	136.3	179.9	-170.8	64.1	0	0	0	110.8	I188 W442 C443 N446 L450	I188-H448 WeakPolarHBondContact CD1-ND1 3.32Å; I188-H448 HydrophobicContact CG2-CB 3.67Å; W442-H448 HydrophobicContact CZ3-CB 4.28Å; C443-H448 WeakPolarHBondContact CB-O 3.27Å; C443-H448 PolarHBondContact O-N 3.38Å; N446-H448 PolarHBondContact O-N 3.43Å; H448-L450 PolarHBondContact O-N 3.12Å
449	P	85.2	Confident	67.8	Low	100 Å²	100	74.1 Å²	74.1	65%	0.649	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-65	120.7	176.2	26.1	-35.5	0	0	0	112
450	L	87.5	Confident	65.2	Low	38 Å²	38	82 Å²	82	20%	0.199	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.5	172.7	-178.5	64.6	0	0	0	110.5	L20 W22 E391 V401 V403 C443 H448 T452	L20-L450 HydrophobicContact CD2-CD2 4.29Å; W22-L450 HydrophobicContact CH2-CD2 3.81Å; W22-L450 HydrophobicContact CZ2-CD2 3.47Å; W22-L450 VanDerWaalsContact CZ2-CD2 3.47Å; E391-L450 HydrophobicContact CG-CD1 3.9Å; V401-L450 HydrophobicContact CG1-CD1 4.2Å; V403-L450 HydrophobicContact CG2-CD1 4.19Å; V403-L450 HydrophobicContact CG2-CD2 4Å; V403-L450 HydrophobicContact CG2-CG 4.15Å; C443-L450 HydrophobicContact CB-CB 3.83Å; C443-L450 HydrophobicContact CB-CD1 4.36Å; H448-L450 PolarHBondContact O-N 3.12Å; L450-T452 HydrophobicContact CB-CG2 4.37Å; L450-T452 HydrophobicContact CD2-CG2 3.98Å; L450-T452 HydrophobicContact CG-CG2 3.99Å; L450-T452 PolarHBondContact O-N 2.89Å; L450-T452 VanDerWaalsContact O-N 3.08Å
451	S	86.1	Confident	62.4	Low	18 Å²	18	88.4 Å²	88.4	13%	0.126	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	101.5	167.9	-88.1	0	0	0	0	109.7	E400 V401 V403	E400-S451 WeakPolarHBondContact OE1-CB 3.3Å; E400-S451 PolarHBondContact OE1-OG 2.84Å; V401-S451 PolarHBondContact O-N 2.92Å; V403-S451 PolarHBondContact N-O 2.71Å
452	T	76.4	Confident	60.5	Low	61 Å²	61	98.5 Å²	98.5	37%	0.374	49%	0.492	S	S	.	.			trans	-92	153.3	-176	57.7	0	0	0	0	112.9	L20 G420 L450 R454	L20-T452 HydrophobicContact CB-CG2 4.38Å; L20-T452 HydrophobicContact CD2-CG2 3.89Å; G420-T452 WeakPolarHBondContact CA-O 3.38Å; L450-T452 HydrophobicContact CB-CG2 4.37Å; L450-T452 HydrophobicContact CD2-CG2 3.98Å; L450-T452 HydrophobicContact CG-CG2 3.99Å; L450-T452 PolarHBondContact O-N 2.89Å; L450-T452 VanDerWaalsContact O-N 3.08Å; T452-R454 PolarHBondContact O-N 2.79Å
453	P	73.5	Confident	58	Low	27 Å²	27	107.8 Å²	107.8	18%	0.175	53%	0.532	C	S	.	.			trans	-61.1	126.1	179	-17.6	29	0	0	0	111	Y25 V403 E419 R455	Y25-P453 HydrophobicContact CE2-CG 3.88Å; V403-P453 HydrophobicContact CG2-CG 4.47Å; E419-P453 HydrophobicContact CB-CB 4.25Å; E419-P453 HydrophobicContact CB-CG 3.81Å; E419-P453 WeakPolarHBondContact OE2-CG 3.18Å; P453-R455 PolarHBondContact O-N 3.1Å
454	R	58.4	Low	55.6	Low	229 Å²	229	114.3 Å²	114.3	86%	0.864	57%	0.566	S	S	*	*			trans	-63.8	94.5	176.7	-69.5	-173.1	-179.5	-165.4	0.3	110.3	T452 A456	T452-R454 PolarHBondContact O-N 2.79Å; R454-A456 PolarHBondContact O-N 3.44Å
455	R	51.8	Low	53.5	Low	117 Å²	117	112.7 Å²	112.7	44%	0.442	58%	0.575	S	S	.	*			trans	-52.3	100.8	178.7	-83.5	179.3	157.3	156.3	-4.4	111.3	P453 R457	P453-R455 PolarHBondContact O-N 3.1Å; R455-R457 PolarHBondContact O-N 3.01Å
456	A	33.5	Very low	51.7	Low	85 Å²	85	113.8 Å²	113.8	70%	0.702	58%	0.581	S	S	*	*			trans	-57.6	121.5	165.4	0	0	0	0	0	108.3	R454 V458	R454-A456 PolarHBondContact O-N 3.44Å; A456-V458 VanDerWaalsContact C-N 3.26Å; A456-V458 PolarHBondContact O-N 3.49Å
457	R	34.7	Very low	49.5	Very low	209 Å²	209	118.9 Å²	118.9	79%	0.789	61%	0.613	S	S	*	*			trans	-74.4	73.5	-167.9	-165.4	-174	-168.4	-171.3	6.3	111.9	R455 H459	R455-R457 PolarHBondContact O-N 3.01Å; R457-H459 PolarHBondContact O-N 2.91Å
458	V	30.3	Very low	47.4	Very low	117 Å²	117	123.5 Å²	123.5	71%	0.709	62%	0.616	S	S	*	*			trans	-65.8	95.1	177.5	-178.4	0	0	0	0	109.4	A456 K460	A456-V458 VanDerWaalsContact C-N 3.26Å; A456-V458 PolarHBondContact O-N 3.49Å; V458-K460 VanDerWaalsContact C-N 3.29Å; V458-K460 PolarHBondContact O-N 3Å
459	H	30.6	Very low	45.3	Very low	136 Å²	136	127.6 Å²	127.6	63%	0.63	64%	0.644	S	S	*	*			trans	-64.6	88.1	170.9	-76.9	-77.5	0	0	0	110	R457 Q461	R457-H459 PolarHBondContact O-N 2.91Å; H459-Q461 VanDerWaalsContact C-N 3.25Å; H459-Q461 PolarHBondContact O-N 2.94Å
460	K	33.4	Very low	42.4	Very low	170 Å²	170	131.5 Å²	131.5	74%	0.739	65%	0.654	S	S	*	*			trans	-59.2	89.2	164.5	-77.2	175.4	178.7	161.4	0	108.3	V458 R462	V458-K460 VanDerWaalsContact C-N 3.29Å; V458-K460 PolarHBondContact O-N 3Å; K460-R462 PolarHBondContact O-N 3.46Å
461	Q	26.8	Very low	39.6	Very low	168 Å²	168	138.1 Å²	138.1	79%	0.785	68%	0.681	S	S	*	*			trans	-62.3	94.5	-180	-76.3	-168.5	-3.5	0	0	110.3	H459 K463	H459-Q461 VanDerWaalsContact C-N 3.25Å; H459-Q461 PolarHBondContact O-N 2.94Å; Q461-K463 PolarHBondContact O-N 2.93Å
462	R	35.2	Very low	36.6	Very low	224 Å²	224	146.8 Å²	146.8	85%	0.845	72%	0.72	S	S	*	*			trans	-63.3	107.4	163.5	-71.3	-175.5	173.6	-176.5	-0.4	107.6	K460 I464	K460-R462 PolarHBondContact O-N 3.46Å; R462-I464 VanDerWaalsContact C-N 3.35Å; R462-I464 HydrophobicContact CB-CG1 4.42Å; R462-I464 PolarHBondContact O-N 2.82Å
463	K	31.7	Very low	34.2	Very low	201 Å²	201	150 Å²	150	87%	0.874	74%	0.739	S	S	*	*			trans	-67.7	92.7	172.4	-70.1	-176.3	178.7	179.1	0	109.1	Q461	Q461-K463 PolarHBondContact O-N 2.93Å
464	I	29	Very low	32.2	Very low	138 Å²	138	154.7 Å²	154.7	71%	0.708	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-84.1	126.5	177.8	-66.3	165	0	0	0	108.9	R462	R462-I464 VanDerWaalsContact C-N 3.35Å; R462-I464 HydrophobicContact CB-CG1 4.42Å; R462-I464 PolarHBondContact O-N 2.82Å
465	A	28.8	Very low	30.5	Very low	100 Å²	100	149.5 Å²	149.5	83%	0.826	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.1	128	165.9	0	0	0	0	0	109.4
466	V	28.6	Very low	29.2	Very low	128 Å²	128	149.1 Å²	149.1	78%	0.776	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-86.7	127.5	-169.3	176.1	0	0	0	0	112.1
467	V	27	Very low	28.7	Very low	141 Å²	141	157 Å²	157	86%	0.855	80%	0.795	S	S	*	*			trans	-139.9	127.5	146.1	-175.4	0	0	0	0	109.5
468	Q	25.6	Very low	28.2	Very low	167 Å²	167	153 Å²	153	78%	0.78	79%	0.794	S	S	*	*			trans	-124.6	162.2	160.3	-100.2	-169.1	66.8	0	0	106.2
469	P	38.3	Very low	27.8	Very low	105 Å²	105	152.6 Å²	152.6	68%	0.682	79%	0.792	S	S	*	*			cis	-126.2	-164.6	36.2	38.3	-17.2	0	0	0	112
470	E	23.8	Very low	27.5	Very low	183 Å²	183	155.4 Å²	155.4	86%	0.855	80%	0.804	S	S	*	*			cis	-154.6	172.4	22.1	-159.5	156.1	-138.2	0	0	114.4
471	K	27.4	Very low	27	Very low	177 Å²	177	155.8 Å²	155.8	77%	0.77	81%	0.809	S	S	*	*			trans	-88.8	151.9	-167.6	-60.1	172.1	178.2	174.6	0	114.2
472	Q	23.5	Very low	26.8	Very low	200 Å²	200	150.9 Å²	150.9	94%	0.935	80%	0.803	S	S	*	*			trans	-153.3	166.2	131.7	-116.4	161.6	69.4	0	0	112.2
473	V	25.4	Very low	26.3	Very low	129 Å²	129	148.7 Å²	148.7	78%	0.782	81%	0.807	S	S	*	*			trans	-120.5	148.7	-159.4	166.7	0	0	0	0	109.9
474	P	33.2	Very low	25.9	Very low	124 Å²	124	149.4 Å²	149.4	81%	0.805	80%	0.804	S	S	*	*			trans	-88.9	173	-160.6	36.1	-38	0	0	0	114.7
475	S	22.4	Very low	25.7	Very low	121 Å²	121	147.6 Å²	147.6	85%	0.846	80%	0.796	S	S	*	*			trans	-130.6	133.3	165.2	60.3	0	0	0	0	111.2
476	S	23.7	Very low	25.3	Very low	108 Å²	108	152.4 Å²	152.4	76%	0.755	80%	0.802	S	S	*	*			trans	-87	156.9	174.2	52.8	0	0	0	0	111.4
477	R	23.6	Very low	25	Very low	251 Å²	251	153.6 Å²	153.6	95%	0.947	80%	0.799	S	S	*	*			trans	-141.2	145	149.4	-76.9	-158.6	170.6	-176.3	-3.5	110.3
478	T	23	Very low	24.8	Very low	126 Å²	126	155.2 Å²	155.2	77%	0.773	80%	0.802	S	S	*	*			trans	-111.8	156.6	-169.1	22.5	0	0	0	0	112
479	V	23.5	Very low	24.6	Very low	108 Å²	108	154.1 Å²	154.1	66%	0.655	80%	0.801	S	S	*	*			trans	58.9	122.1	146.9	173.5	0	0	0	0	118.1
480	H	24.5	Very low	23.9	Very low	194 Å²	194	154.5 Å²	154.5	90%	0.898	81%	0.806	S	S	*	*				-144	152.3	117	-114.2	-75.9	0	0	0	110.8
481	E	21.7	Very low	23.9	Very low	179 Å²	179	152.2 Å²	152.2	84%	0.836	81%	0.805	S	S	*	*			trans	-131.8	153.1	-160	-179.9	-176.6	179.2	0	0	111.1
482	G	23.5	Very low	23.6	Very low	64 Å²	64	153.1 Å²	153.1	66%	0.66	81%	0.812	S	S	*	*			trans	104.8	114.2	156.6	0	0	0	0	0	116.7
483	L	23.6	Very low	23.6	Very low	178 Å²	178	148.1 Å²	148.1	93%	0.932	80%	0.799	S	S	*	*				-163.6	127.3	98.4	-100.8	166.5	0	0	0	112.7
484	R	23.4	Very low	23.7	Very low	216 Å²	216	148 Å²	148	82%	0.815	80%	0.798	S	S	*	*			trans	-72.4	169.7	163.1	-77.3	-171.9	163.1	-179.7	-7	110.4
485	N	24.4	Very low	23.5	Very low	101 Å²	101	147.6 Å²	147.6	54%	0.54	79%	0.794	S	S	.	*			cis	-160.2	156.4	-6.9	-118.8	25.1	0	0	0	107.1
486	Q	22.2	Very low	23.9	Very low	201 Å²	201	148.4 Å²	148.4	94%	0.939	79%	0.787	S	S	*	*			trans	-164.7	118	133.1	-115.2	172.6	8.4	0	0	110.9
487	E	22.3	Very low	24.7	Very low	152 Å²	152	150.2 Å²	150.2	71%	0.71	79%	0.789	S	S	*	*			trans	-100	153.5	173.5	-63.7	153.8	134.4	0	0	109.2
488	L	22	Very low	25.9	Very low	176 Å²	176	140.4 Å²	140.4	92%	0.921	77%	0.766	S	S	*	*			trans	-160.7	143.6	146.9	-107.8	163.5	0	0	0	109.2
489	N	22.1	Very low	27.4	Very low	143 Å²	143	140 Å²	140	77%	0.765	75%	0.753	S	S	*	*			trans	-91	155.6	-155.2	-57.6	-19.9	0	0	0	114.5
490	S	23	Very low	29.4	Very low	113 Å²	113	140.4 Å²	140.4	79%	0.79	74%	0.744	S	S	*	*			trans	-157	113.2	148.9	-59.9	0	0	0	0	110.8
491	T	22.9	Very low	31.6	Very low	136 Å²	136	134 Å²	134	83%	0.834	72%	0.72	S	S	*	*			trans	33.5	102.1	154.4	52.4	0	0	0	0	118.7
492	E	22.7	Very low	34.2	Very low	195 Å²	195	125.5 Å²	125.5	91%	0.911	68%	0.681	S	S	*	*			trans	-67.4	129.9	163.5	-64.1	-177.9	124.3	0	0	111
493	S	23.5	Very low	36.9	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	66%	0.664	S	S	*	*			trans	-115.8	117	161.8	48.9	0	0	0	0	108.8	T495	S493-T495 PolarHBondContact O-N 2.85Å; S493-T495 PolarHBondContact O-OG1 3.06Å; S493-T495 VanDerWaalsContact O-OG1 3.04Å
494	V	27.1	Very low	39.8	Very low	127 Å²	127	120.3 Å²	120.3	77%	0.77	64%	0.637	S	S	*	*			trans	-70.2	94.5	-169.4	177.6	0	0	0	0	110.4	I496	V494-I496 HydrophobicContact CG1-CD1 3.88Å; V494-I496 HydrophobicContact CG1-CG1 3.81Å
495	T	29	Very low	43	Very low	115 Å²	115	110 Å²	110	71%	0.706	60%	0.598	S	S	*	*			trans	-110.3	73	-176.2	30.2	0	0	0	0	111.2	S493 N497 G498	S493-T495 PolarHBondContact O-N 2.85Å; S493-T495 PolarHBondContact O-OG1 3.06Å; S493-T495 VanDerWaalsContact O-OG1 3.04Å; T495-N497 PolarHBondContact O-N 2.78Å; T495-G498 PolarHBondContact O-N 3.19Å
496	I	30.4	Very low	46.2	Very low	139 Å²	139	107.6 Å²	107.6	71%	0.713	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-60.2	-28.6	-174.4	-66.9	168.7	0	0	0	112.7	V494 G498	V494-I496 HydrophobicContact CG1-CD1 3.88Å; V494-I496 HydrophobicContact CG1-CG1 3.81Å; I496-G498 PolarHBondContact O-N 3.14Å; I496-G498 VanDerWaalsContact O-N 3.07Å
497	N	41.5	Very low	49.5	Very low	146 Å²	146	98.2 Å²	98.2	78%	0.781	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-68.4	-5.4	-178.4	-68	3.3	0	0	0	115	T495 K499	T495-N497 PolarHBondContact O-N 2.78Å; N497-K499 VanDerWaalsContact C-N 3.29Å; N497-K499 PolarHBondContact O-N 2.99Å
498	G	48.3	Very low	52.7	Low	45 Å²	45	91.4 Å²	91.4	46%	0.464	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-64.9	-24.2	-178.9	0	0	0	0	0	115.4	T495 I496 Y500	T495-G498 PolarHBondContact O-N 3.19Å; I496-G498 PolarHBondContact O-N 3.14Å; I496-G498 VanDerWaalsContact O-N 3.07Å; G498-Y500 PolarHBondContact O-N 3.01Å
499	K	53.4	Low	55.9	Low	117 Å²	117	85.6 Å²	85.6	51%	0.509	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-67.5	-33.4	-167	-170.3	-176.9	175.3	-158.5	0	115.1	N497 T592 A593	N497-K499 VanDerWaalsContact C-N 3.29Å; N497-K499 PolarHBondContact O-N 2.99Å; K499-T592 HydrophobicContact CG-CG2 4.21Å; K499-T592 CarbonylContact O-C 3.58Å; K499-T592 WeakPolarHBondContact O-CA 3.38Å; K499-A593 PolarHBondContact O-N 3.09Å
500	Y	66.6	Low	58.8	Low	116 Å²	116	87.5 Å²	87.5	46%	0.455	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-0.8	-175.8	-55.7	-77.1	0	0	0	113.2	G498 C502 C534 K591 T592	G498-Y500 PolarHBondContact O-N 3.01Å; Y500-C502 PolarHBondContact O-N 3.08Å; Y500-C534 PolarHBondContact O-N 2.99Å; Y500-C534 VanDerWaalsContact O-N 3.1Å; Y500-C534 PolarHBondContact O-SG 3.34Å; Y500-K591 WeakPolarHBondContact CD1-O 3.32Å; Y500-T592 HydrophobicContact CD1-CG2 3.83Å; Y500-T592 HydrophobicContact CE1-CG2 3.54Å
501	C	69.8	Low	61.9	Low	61 Å²	61	82.4 Å²	82.4	41%	0.412	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	111.7	178.2	-171.2	0	0	0	0	111	A593	C501-A593 VanDerWaalsContact O-CB 3.25Å; C501-A593 WeakPolarHBondContact O-CB 3.37Å
502	C	75.8	Confident	65	Low	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	125.3	174.7	-148.1	0	0	0	0	110.2	Y500 P531 G532 C534 V537	Y500-C502 PolarHBondContact O-N 3.08Å; C502-P531 WeakPolarHBondContact O-CA 3.35Å; C502-P531 WeakPolarHBondContact O-CB 3.4Å; C502-G532 WeakPolarHBondContact CA-O 3.42Å; C502-G532 WeakPolarHBondContact CB-O 3.42Å; C502-G532 PolarHBondContact N-O 2.95Å; C502-G532 PolarHBondContact O-N 2.88Å; C502-C534 HydrophobicContact CB-CB 4.43Å; C502-C534 PolarHBondContact N-SG 3.2Å; C502-V537 HydrophobicContact CB-CB 3.82Å; C502-V537 HydrophobicContact CB-CG1 4Å; C502-V537 HydrophobicContact CB-CG2 3.97Å
503	P	80.7	Confident	68.1	Low	49 Å²	49	68.7 Å²	68.7	32%	0.318	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-62	158.9	165.3	28.2	-36.3	0	0	0	111.1	I505 V596 P616	P503-I505 WeakPolarHBondContact O-CD1 3.44Å; P503-I505 PolarHBondContact O-N 3.34Å; P503-I505 VanDerWaalsContact O-N 3.14Å; P503-V596 HydrophobicContact CG-CG1 4.12Å; P503-P616 HydrophobicContact CB-CB 4.14Å; P503-P616 HydrophobicContact CG-CB 3.77Å
504	K	84.9	Confident	71.2	Confident	84 Å²	84	64.2 Å²	64.2	37%	0.365	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-52.3	119.9	173.8	-73.3	-166.5	165.5	-169.9	0	111.1	Y506 P616	K504-Y506 HydrophobicContact CB-CE1 4.37Å; K504-Y506 HydrophobicContact CB-CE2 3.78Å; K504-Y506 WeakPolarHBondContact O-CD2 3.31Å; K504-Y506 WeakPolarHBondContact O-CE2 3.33Å; K504-P616 WeakPolarHBondContact O-CA 3.22Å
505	I	91.5	Very high	74	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	106.7	176.6	-53.4	-55.4	0	0	0	108.5	P503 C528 V529 V537 L538 V541 V596 F614	P503-I505 WeakPolarHBondContact O-CD1 3.44Å; P503-I505 PolarHBondContact O-N 3.34Å; P503-I505 VanDerWaalsContact O-N 3.14Å; I505-C528 CarbonylContact O-C 3.54Å; I505-C528 WeakPolarHBondContact O-CA 3.29Å; I505-C528 VanDerWaalsContact O-CB 3.27Å; I505-C528 WeakPolarHBondContact O-CB 3.26Å; I505-V529 PolarHBondContact N-O 2.89Å; I505-V529 PolarHBondContact O-N 2.98Å; I505-V537 HydrophobicContact CG1-CG1 3.81Å; I505-L538 HydrophobicContact CD1-CD2 4.47Å; I505-L538 HydrophobicContact CG1-CD2 4.36Å; I505-V541 HydrophobicContact CB-CG2 3.92Å; I505-V541 HydrophobicContact CG1-CG2 4.37Å; I505-V541 HydrophobicContact CG2-CG1 4.11Å; I505-V541 HydrophobicContact CG2-CG2 3.82Å; I505-V596 HydrophobicContact CD1-CG1 3.49Å; I505-V596 VanDerWaalsContact CD1-CG1 3.49Å; I505-F614 HydrophobicContact CG2-CB 4.5Å; I505-F614 HydrophobicContact CG2-CD2 3.77Å
506	Y	90.8	Very high	76.9	Confident	50 Å²	50	55.8 Å²	55.8	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	140.1	-179.8	-61.4	-82.3	0	0	0	111.2	K504 Q527 C528 F614 G615 M618	K504-Y506 HydrophobicContact CB-CE1 4.37Å; K504-Y506 HydrophobicContact CB-CE2 3.78Å; K504-Y506 WeakPolarHBondContact O-CD2 3.31Å; K504-Y506 WeakPolarHBondContact O-CE2 3.33Å; Y506-Q527 CarbonylContact C-O 3.34Å; Y506-Q527 WeakPolarHBondContact CA-O 3.26Å; Y506-C528 HydrophobicContact CD1-CB 3.54Å; Y506-C528 HydrophobicContact CE1-CB 3.82Å; Y506-C528 HydrophobicContact CG-CB 4.13Å; Y506-F614 CarbonylContact O-C 3.59Å; Y506-F614 WeakPolarHBondContact O-CA 3.27Å; Y506-F614 WeakPolarHBondContact O-CB 3.26Å; Y506-G615 PolarHBondContact N-O 3.45Å; Y506-G615 PolarHBondContact O-N 2.85Å; Y506-G615 VanDerWaalsContact O-N 3.1Å; Y506-M618 HydrophobicContact CD1-CB 4.02Å; Y506-M618 HydrophobicContact CD1-CE 3.47Å; Y506-M618 VanDerWaalsContact CD1-CE 3.47Å; Y506-M618 HydrophobicContact CD1-CG 4.14Å; Y506-M618 HydrophobicContact CD2-CB 4.03Å; Y506-M618 HydrophobicContact CE1-CB 4.42Å; Y506-M618 HydrophobicContact CE1-CE 3.32Å; Y506-M618 HydrophobicContact CE2-CB 4.41Å; Y506-M618 HydrophobicContact CG-CB 3.82Å; Y506-M618 HydrophobicContact CG-CE 4.43Å; Y506-M618 HydrophobicContact CG-CG 4.28Å
507	F	91.2	Very high	79.9	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	106.6	166.4	-73.6	-73.7	0	0	0	108.9	H509 L525 P526 Q527 V529 V541 L544 L545 F614	F507-H509 VanDerWaalsContact C-N 3.29Å; F507-H509 PolarHBondContact O-CD2 2.91Å; F507-H509 PolarHBondContact O-N 3.39Å; F507-H509 PolarHBondContact O-NE2 3.32Å; F507-L525 HydrophobicContact CD1-CD1 3.93Å; F507-L525 HydrophobicContact CD2-CB 4.37Å; F507-L525 HydrophobicContact CD2-CD1 4.42Å; F507-L525 HydrophobicContact CE1-CD1 3.77Å; F507-L525 HydrophobicContact CE2-CD1 4.23Å; F507-L525 HydrophobicContact CG-CB 4.49Å; F507-L525 HydrophobicContact CG-CD1 4.26Å; F507-L525 HydrophobicContact CZ-CD1 3.91Å; F507-P526 VanDerWaalsContact CD2-O 3.25Å; F507-P526 WeakPolarHBondContact CD2-O 3.28Å; F507-Q527 PolarHBondContact N-O 2.83Å; F507-V529 HydrophobicContact CE2-CG2 3.89Å; F507-V541 HydrophobicContact CE1-CG1 4.23Å; F507-V541 HydrophobicContact CE2-CG2 4.47Å; F507-V541 HydrophobicContact CZ-CB 4.31Å; F507-V541 HydrophobicContact CZ-CG1 3.9Å; F507-V541 HydrophobicContact CZ-CG2 4.25Å; F507-L544 HydrophobicContact CE2-CD1 3.97Å; F507-L544 HydrophobicContact CZ-CB 4.25Å; F507-L544 HydrophobicContact CZ-CD1 4.22Å; F507-L545 HydrophobicContact CE1-CD1 4.34Å; F507-L545 HydrophobicContact CE1-CD2 3.85Å; F507-L545 HydrophobicContact CE1-CG 3.88Å; F507-L545 HydrophobicContact CZ-CG 4.48Å; F507-F614 HydrophobicContact CD1-CB 3.8Å; F507-F614 HydrophobicContact CE1-CB 4.04Å; F507-F614 HydrophobicContact CE1-CG 4.46Å
508	N	90.6	Very high	82.3	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.043	22%	0.22	C	C	.	.			trans	-84	73.4	-177.4	-66	-46.1	0	0	0	109.9	R510 C511 N612 L613 R617 M618 V619	N508-R510 PolarHBondContact O-N 2.89Å; N508-C511 HydrophobicContact CB-CB 4.42Å; N508-C511 VanDerWaalsContact O-CB 3.27Å; N508-C511 WeakPolarHBondContact O-CB 3.29Å; N508-C511 PolarHBondContact O-N 3.29Å; N508-N612 WeakPolarHBondContact CB-O 3.26Å; N508-N612 PolarHBondContact ND2-O 3.18Å; N508-L613 PolarHBondContact N-O 3.35Å; N508-R617 PolarHBondContact ND2-O 2.84Å; N508-M618 WeakPolarHBondContact OD1-CA 3.44Å; N508-V619 HydrophobicContact CB-CB 4.18Å; N508-V619 PolarHBondContact OD1-N 3.11Å
509	H	87.7	Confident	84.1	Confident	55 Å²	55	48.3 Å²	48.3	26%	0.255	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-18.8	-170.1	-37.2	-84.3	0	0	0	115.4	F507 I522 L525	F507-H509 VanDerWaalsContact C-N 3.29Å; F507-H509 PolarHBondContact O-CD2 2.91Å; F507-H509 PolarHBondContact O-N 3.39Å; F507-H509 PolarHBondContact O-NE2 3.32Å; H509-I522 PolarHBondContact ND1-O 3.4Å; H509-L525 PolarHBondContact CE1-O 2.92Å; H509-L525 VanDerWaalsContact CE1-O 3.32Å
510	R	83.1	Confident	85.6	Confident	183 Å²	183	44.3 Å²	44.3	69%	0.691	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-16.7	174.4	-64.4	-176.7	-180	-129.3	-2	113.9	N508	N508-R510 PolarHBondContact O-N 2.89Å
511	C	88.4	Confident	86.6	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.041	22%	0.215	C	C	.	.	S	Bend	trans	-74.3	161.8	179.1	-74.9	0	0	0	0	113	N508 S513 C610 L613	N508-C511 HydrophobicContact CB-CB 4.42Å; N508-C511 VanDerWaalsContact O-CB 3.27Å; N508-C511 WeakPolarHBondContact O-CB 3.29Å; N508-C511 PolarHBondContact O-N 3.29Å; C511-S513 PolarHBondContact O-N 2.96Å; C511-C610 HydrophobicContact CB-CB 3.83Å; C511-L613 HydrophobicContact CB-CB 4.49Å; C511-L613 HydrophobicContact CB-CD1 3.88Å
512	F	89	Confident	87.6	Confident	30 Å²	30	41.4 Å²	41.4	13%	0.132	20%	0.196	C	C	.	.			trans	-68.8	116.3	178.4	177.8	-105.2	0	0	0	112.1	G514 C609 C610 C627 K632 Y635	F512-G514 VanDerWaalsContact C-N 3.29Å; F512-G514 VanDerWaalsContact CE1-CA 3.43Å; F512-G514 PolarHBondContact O-N 3.05Å; F512-C609 WeakPolarHBondContact O-CB 3.38Å; F512-C610 HydrophobicContact CB-CB 4.29Å; F512-C610 WeakPolarHBondContact O-CB 3.34Å; F512-C610 PolarHBondContact O-N 3.5Å; F512-C627 HydrophobicContact CB-CB 4.03Å; F512-K632 HydrophobicContact CE2-CB 4.07Å; F512-K632 HydrophobicContact CE2-CD 4.3Å; F512-K632 HydrophobicContact CE2-CG 3.82Å; F512-K632 HydrophobicContact CZ-CG 3.96Å; F512-Y635 HydrophobicContact CB-CD1 4.49Å; F512-Y635 AromaticContact CD1-CD1 3.21Å; F512-Y635 HydrophobicContact CD1-CD1 3.21Å; F512-Y635 AromaticContact CD1-CE1 3.65Å; F512-Y635 HydrophobicContact CD1-CE1 3.65Å; F512-Y635 AromaticContact CD1-CG 3.9Å; F512-Y635 HydrophobicContact CD1-CG 3.9Å; F512-Y635 AromaticContact CE1-CD1 3.48Å; F512-Y635 HydrophobicContact CE1-CD1 3.48Å; F512-Y635 VanDerWaalsContact CE1-CD1 3.48Å; F512-Y635 HydrophobicContact CE1-CE1 4.24Å; F512-Y635 HydrophobicContact CE1-CG 4.19Å; F512-Y635 AromaticContact CG-CD1 3.97Å; F512-Y635 HydrophobicContact CG-CD1 3.97Å; F512-Y635 HydrophobicContact CG-CE1 4.43Å; F512-Y635 HydrophobicContact CG-CG 4.24Å; F512-Y635 HydrophobicContact CZ-CD1 4.42Å
513	S	87.8	Confident	87.9	Confident	12 Å²	12	44.5 Å²	44.5	8%	0.084	22%	0.222	C	C	.	.			trans	-79.9	3.5	-174.7	72.8	0	0	0	0	115.8	C511 L517 C609	C511-S513 PolarHBondContact O-N 2.96Å; S513-L517 WeakPolarHBondContact O-CB 3.42Å; S513-L517 PolarHBondContact OG-O 2.76Å; S513-C609 VanDerWaalsContact C-CB 3.47Å
514	G	87.8	Confident	88.2	Confident	2 Å²	2	49.2 Å²	49.2	2%	0.021	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	-169.1	179.7	0	0	0	0	0	115.1	F512 E608	F512-G514 VanDerWaalsContact C-N 3.29Å; F512-G514 VanDerWaalsContact CE1-CA 3.43Å; F512-G514 PolarHBondContact O-N 3.05Å; G514-E608 VanDerWaalsContact CA-O 3.28Å; G514-E608 WeakPolarHBondContact CA-O 3.29Å
515	P	86.3	Confident	88	Confident	47 Å²	47	46.4 Å²	46.4	31%	0.305	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-8.7	178.2	33.3	-30.6	0	0	0	114.2	E608	P515-E608 WeakPolarHBondContact CD-O 3.42Å; P515-E608 HydrophobicContact CG-CB 3.87Å
516	Y	89.9	Confident	87.6	Confident	17 Å²	17	49.5 Å²	49.5	7%	0.067	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-32.9	-177.2	-63.4	-96.9	0	0	0	113.7	Y550 R554 E558 L607 E608	Y516-Y550 WeakPolarHBondContact O-CD2 3.45Å; Y516-Y550 PolarHBondContact O-N 2.85Å; Y516-R554 HydrophobicContact CD1-CB 4.14Å; Y516-R554 HydrophobicContact CE1-CB 4.37Å; Y516-R554 VanDerWaalsContact CE1-CZ 3.42Å; Y516-R554 PolarHBondContact OH-NH2 2.86Å; Y516-R554 VanDerWaalsContact OH-NH2 3.14Å; Y516-E558 HydrophobicContact CD1-CG 4.39Å; Y516-E558 HydrophobicContact CE1-CG 3.69Å; Y516-E558 PolarHBondContact OH-OE1 2.76Å; Y516-L607 VanDerWaalsContact CD2-O 3.27Å; Y516-L607 WeakPolarHBondContact CD2-O 3.39Å; Y516-E608 HydrophobicContact CE2-CB 4.27Å; Y516-E608 HydrophobicContact CE2-CG 4.23Å
517	L	92.8	Very high	87.3	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-100.1	138.4	-173.2	-50.9	170.4	0	0	0	112.1	S513 I522 L545 A549 Y550 V555 L607 L613	S513-L517 WeakPolarHBondContact O-CB 3.42Å; S513-L517 PolarHBondContact OG-O 2.76Å; L517-I522 HydrophobicContact CB-CD1 4.13Å; L517-I522 HydrophobicContact CB-CG1 3.96Å; L517-I522 HydrophobicContact CD1-CD1 4.14Å; L517-L545 HydrophobicContact CD1-CD2 3.87Å; L517-L545 VanDerWaalsContact CD2-O 3.23Å; L517-L545 WeakPolarHBondContact CD2-O 3.27Å; L517-A549 HydrophobicContact CD2-CB 4.34Å; L517-Y550 WeakPolarHBondContact O-CE2 3.47Å; L517-V555 HydrophobicContact CD2-CG2 4Å; L517-L607 HydrophobicContact CD1-CD1 4.47Å; L517-L613 HydrophobicContact CD1-CD2 3.57Å
518	N	92.3	Very high	87.1	Confident	44 Å²	44	54.2 Å²	54.2	24%	0.235	28%	0.275	C	S	.	.			trans	-82.2	119.9	178.5	-177.2	-6.8	0	0	0	110.5	G520 R521 I522 A548 Y550	N518-G520 VanDerWaalsContact C-N 3.26Å; N518-G520 PolarHBondContact O-N 3.35Å; N518-G520 PolarHBondContact OD1-N 3.03Å; N518-G520 VanDerWaalsContact OD1-N 3.12Å; N518-R521 HydrophobicContact CB-CB 4.29Å; N518-R521 HydrophobicContact CB-CG 4.3Å; N518-R521 PolarHBondContact O-N 3.48Å; N518-I522 VanDerWaalsContact O-CG1 3.28Å; N518-I522 WeakPolarHBondContact O-CG1 3.04Å; N518-I522 PolarHBondContact O-N 3.35Å; N518-A548 WeakPolarHBondContact CB-O 3.47Å; N518-A548 PolarHBondContact N-O 2.67Å; N518-Y550 HydrophobicContact CB-CD1 3.91Å; N518-Y550 HydrophobicContact CB-CD2 4.48Å; N518-Y550 HydrophobicContact CB-CE1 3.67Å; N518-Y550 HydrophobicContact CB-CE2 4.26Å; N518-Y550 HydrophobicContact CB-CG 4.31Å
519	K	86.3	Confident	86.4	Confident	128 Å²	128	55 Å²	55	56%	0.557	28%	0.28	S	S	*	.	H	α-helix	trans	-59.4	-34.1	-177.2	-167.8	-172.8	175.1	-167.3	0	112.9	A523	K519-A523 PolarHBondContact O-N 2.94Å
520	G	85.5	Confident	86	Confident	33 Å²	33	53.8 Å²	53.8	34%	0.34	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-58.7	176	0	0	0	0	0	111	N518 I522 A523 E524	N518-G520 VanDerWaalsContact C-N 3.26Å; N518-G520 PolarHBondContact O-N 3.35Å; N518-G520 PolarHBondContact OD1-N 3.03Å; N518-G520 VanDerWaalsContact OD1-N 3.12Å; G520-I522 VanDerWaalsContact C-N 3.27Å; G520-I522 PolarHBondContact O-N 3.44Å; G520-A523 CarbonylContact O-C 3.51Å; G520-A523 WeakPolarHBondContact O-CA 3.4Å; G520-A523 WeakPolarHBondContact O-CB 3.42Å; G520-A523 PolarHBondContact O-N 3.27Å; G520-E524 VanDerWaalsContact C-OE1 3.31Å; G520-E524 PolarHBondContact O-N 2.94Å; G520-E524 VanDerWaalsContact O-N 3.11Å
521	R	87.6	Confident	85.7	Confident	114 Å²	114	48.8 Å²	48.8	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-35.2	177.2	-62.8	-177.4	-179.8	-176.8	-5.2	114.2	N518 A523 E524 L525 N547 A548	N518-R521 HydrophobicContact CB-CB 4.29Å; N518-R521 HydrophobicContact CB-CG 4.3Å; N518-R521 PolarHBondContact O-N 3.48Å; R521-A523 PolarHBondContact O-N 3.22Å; R521-E524 WeakPolarHBondContact CA-OE2 3.45Å; R521-E524 WeakPolarHBondContact O-CB 3.24Å; R521-E524 PolarHBondContact O-N 3.38Å; R521-E524 VanDerWaalsContact O-N 3.15Å; R521-L525 WeakPolarHBondContact O-CG 3.24Å; R521-L525 PolarHBondContact O-N 3.39Å; R521-N547 PolarHBondContact NH1-O 3.24Å; R521-A548 HydrophobicContact CB-CB 3.86Å
522	I	89	Confident	84.4	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-25.6	174.2	-68.3	-69.6	0	0	0	112.1	H509 L517 N518 G520 L525 L545 A548 L613	H509-I522 PolarHBondContact ND1-O 3.4Å; L517-I522 HydrophobicContact CB-CD1 4.13Å; L517-I522 HydrophobicContact CB-CG1 3.96Å; L517-I522 HydrophobicContact CD1-CD1 4.14Å; N518-I522 VanDerWaalsContact O-CG1 3.28Å; N518-I522 WeakPolarHBondContact O-CG1 3.04Å; N518-I522 PolarHBondContact O-N 3.35Å; G520-I522 VanDerWaalsContact C-N 3.27Å; G520-I522 PolarHBondContact O-N 3.44Å; I522-L525 HydrophobicContact CD1-CD1 3.95Å; I522-L545 HydrophobicContact CD1-CD2 3.82Å; I522-A548 HydrophobicContact CD1-CB 3.59Å; I522-A548 HydrophobicContact CG1-CB 4.06Å; I522-L613 HydrophobicContact CG2-CD1 4.41Å
523	A	83.7	Confident	83.9	Confident	65 Å²	65	52.2 Å²	52.2	54%	0.537	30%	0.3	S	S	.	.	H	α-helix	trans	-87.6	-10.8	171.9	0	0	0	0	0	113.7	K519 G520 R521	K519-A523 PolarHBondContact O-N 2.94Å; G520-A523 CarbonylContact O-C 3.51Å; G520-A523 WeakPolarHBondContact O-CA 3.4Å; G520-A523 WeakPolarHBondContact O-CB 3.42Å; G520-A523 PolarHBondContact O-N 3.27Å; R521-A523 PolarHBondContact O-N 3.22Å
524	E	85.6	Confident	83.5	Confident	147 Å²	147	51.7 Å²	51.7	69%	0.687	30%	0.296	S	S	*	.	H	α-helix	trans	-87.7	-10.6	171.2	-64.5	150.5	-150	0	0	112.2	G520 R521	G520-E524 VanDerWaalsContact C-OE1 3.31Å; G520-E524 PolarHBondContact O-N 2.94Å; G520-E524 VanDerWaalsContact O-N 3.11Å; R521-E524 WeakPolarHBondContact CA-OE2 3.45Å; R521-E524 WeakPolarHBondContact O-CB 3.24Å; R521-E524 PolarHBondContact O-N 3.38Å; R521-E524 VanDerWaalsContact O-N 3.15Å
525	L	81.3	Confident	83.3	Confident	26 Å²	26	52.5 Å²	52.5	14%	0.136	30%	0.301	C	S	.	.	S	Bend	trans	-71.4	154.1	175.5	-67.4	-170.8	0	0	0	112.2	F507 H509 R521 I522 L544 A548	F507-L525 HydrophobicContact CD1-CD1 3.93Å; F507-L525 HydrophobicContact CD2-CB 4.37Å; F507-L525 HydrophobicContact CD2-CD1 4.42Å; F507-L525 HydrophobicContact CE1-CD1 3.77Å; F507-L525 HydrophobicContact CE2-CD1 4.23Å; F507-L525 HydrophobicContact CG-CB 4.49Å; F507-L525 HydrophobicContact CG-CD1 4.26Å; F507-L525 HydrophobicContact CZ-CD1 3.91Å; H509-L525 PolarHBondContact CE1-O 2.92Å; H509-L525 VanDerWaalsContact CE1-O 3.32Å; R521-L525 WeakPolarHBondContact O-CG 3.24Å; R521-L525 PolarHBondContact O-N 3.39Å; I522-L525 HydrophobicContact CD1-CD1 3.95Å; L525-L544 HydrophobicContact CD1-CB 4.16Å; L525-L544 HydrophobicContact CD2-CB 3.91Å; L525-L544 HydrophobicContact CD2-CD2 4.13Å; L525-L544 HydrophobicContact CD2-CG 4.46Å; L525-A548 HydrophobicContact CD1-CB 4.38Å
526	P	84.2	Confident	82.9	Confident	64 Å²	64	55.5 Å²	55.5	42%	0.416	31%	0.314	S	S	.	.			trans	-58.3	153.6	171.3	26.5	-36.4	0	0	0	111.7	F507 C528 V529 L544	F507-P526 VanDerWaalsContact CD2-O 3.25Å; F507-P526 WeakPolarHBondContact CD2-O 3.28Å; P526-C528 VanDerWaalsContact C-N 3.26Å; P526-C528 PolarHBondContact O-N 2.86Å; P526-V529 HydrophobicContact CG-CG2 4.29Å; P526-L544 HydrophobicContact CG-CD1 4.14Å
527	Q	84.4	Confident	82.4	Confident	120 Å²	120	55.1 Å²	55.1	56%	0.561	31%	0.313	S	S	*	.	S	Bend	trans	-64	-31.5	-178.9	-167	-175.4	40.5	0	0	112.7	Y506 F507	Y506-Q527 CarbonylContact C-O 3.34Å; Y506-Q527 WeakPolarHBondContact CA-O 3.26Å; F507-Q527 PolarHBondContact N-O 2.83Å
528	C	86.3	Confident	82.3	Confident	33 Å²	33	55.1 Å²	55.1	22%	0.223	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	166.6	171.2	62.3	0	0	0	0	113	I505 Y506 P526	I505-C528 CarbonylContact O-C 3.54Å; I505-C528 WeakPolarHBondContact O-CA 3.29Å; I505-C528 VanDerWaalsContact O-CB 3.27Å; I505-C528 WeakPolarHBondContact O-CB 3.26Å; Y506-C528 HydrophobicContact CD1-CB 3.54Å; Y506-C528 HydrophobicContact CE1-CB 3.82Å; Y506-C528 HydrophobicContact CG-CB 4.13Å; P526-C528 VanDerWaalsContact C-N 3.26Å; P526-C528 PolarHBondContact O-N 2.86Å
529	V	76.1	Confident	82.1	Confident	24 Å²	24	58.1 Å²	58.1	15%	0.145	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.9	171.7	-178.2	0	0	0	0	108	I505 F507 P526 V537 E540 V541 L544	I505-V529 PolarHBondContact N-O 2.89Å; I505-V529 PolarHBondContact O-N 2.98Å; F507-V529 HydrophobicContact CE2-CG2 3.89Å; P526-V529 HydrophobicContact CG-CG2 4.29Å; V529-V537 HydrophobicContact CG1-CG1 4.16Å; V529-E540 HydrophobicContact CG1-CB 4.25Å; V529-E540 HydrophobicContact CG1-CG 4.13Å; V529-V541 HydrophobicContact CB-CG2 3.78Å; V529-V541 HydrophobicContact CG1-CG2 4.17Å; V529-V541 HydrophobicContact CG2-CG2 4.01Å; V529-L544 HydrophobicContact CG2-CD1 3.82Å
530	G	77.9	Confident	82.2	Confident	30 Å²	30	56.1 Å²	56.1	31%	0.309	31%	0.314	S	S	.	.			trans	91.1	-173	-177	0	0	0	0	0	114.1
531	P	77	Confident	82.5	Confident	79 Å²	79	54.5 Å²	54.5	51%	0.513	30%	0.297	S	S	.	.	S	Bend	cis	-70.8	170.3	4.8	34.3	-37.4	0	0	0	112.7	C502	C502-P531 WeakPolarHBondContact O-CA 3.35Å; C502-P531 WeakPolarHBondContact O-CB 3.4Å
532	G	61.2	Low	82.8	Confident	28 Å²	28	49.1 Å²	49.1	29%	0.289	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	163.8	-169.4	-177.6	0	0	0	0	0	111.3	C502 C534	C502-G532 WeakPolarHBondContact CA-O 3.42Å; C502-G532 WeakPolarHBondContact CB-O 3.42Å; C502-G532 PolarHBondContact N-O 2.95Å; C502-G532 PolarHBondContact O-N 2.88Å; G532-C534 PolarHBondContact O-N 2.93Å
533	N	80	Confident	82.8	Confident	80 Å²	80	50.7 Å²	50.7	43%	0.428	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	133	176.5	-179	-58.3	0	0	0	111.5	V535 L536 V537	N533-V535 VanDerWaalsContact C-N 3.32Å; N533-V535 PolarHBondContact O-N 2.79Å; N533-V535 PolarHBondContact OD1-N 2.79Å; N533-L536 HydrophobicContact CB-CB 4.32Å; N533-L536 HydrophobicContact CB-CD1 4.12Å; N533-L536 HydrophobicContact CB-CG 4.12Å; N533-L536 PolarHBondContact O-N 3.08Å; N533-V537 WeakPolarHBondContact O-CG2 3.11Å; N533-V537 PolarHBondContact O-N 2.8Å
534	C	79.1	Confident	83.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-52.4	-42.7	-179.2	-73.6	0	0	0	0	114.4	Y500 C502 G532 L538 K591 V596	Y500-C534 PolarHBondContact O-N 2.99Å; Y500-C534 VanDerWaalsContact O-N 3.1Å; Y500-C534 PolarHBondContact O-SG 3.34Å; C502-C534 HydrophobicContact CB-CB 4.43Å; C502-C534 PolarHBondContact N-SG 3.2Å; G532-C534 PolarHBondContact O-N 2.93Å; C534-L538 VanDerWaalsContact O-CB 3.26Å; C534-L538 WeakPolarHBondContact O-CB 3.08Å; C534-L538 VanDerWaalsContact O-CG 3.22Å; C534-L538 WeakPolarHBondContact O-CG 3.27Å; C534-L538 PolarHBondContact O-N 3.1Å; C534-L538 VanDerWaalsContact O-N 3.12Å; C534-K591 VanDerWaalsContact CB-O 3.25Å; C534-K591 WeakPolarHBondContact CB-O 3.49Å; C534-V596 HydrophobicContact CB-CG2 4.48Å
535	V	82.1	Confident	83.5	Confident	20 Å²	20	42.1 Å²	42.1	12%	0.121	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-48.5	-179.3	-175.3	0	0	0	0	109.9	N533 R539 E572 I589 K591	N533-V535 VanDerWaalsContact C-N 3.32Å; N533-V535 PolarHBondContact O-N 2.79Å; N533-V535 PolarHBondContact OD1-N 2.79Å; V535-R539 WeakPolarHBondContact O-CB 3.48Å; V535-R539 PolarHBondContact O-N 2.94Å; V535-E572 HydrophobicContact CG1-CG 3.93Å; V535-I589 HydrophobicContact CG1-CG2 4.48Å; V535-K591 HydrophobicContact CG2-CG 4.26Å
536	L	79.4	Confident	84	Confident	109 Å²	109	41 Å²	41	57%	0.571	23%	0.23	S	C	*	.	H	α-helix	trans	-64.6	-48.2	-178.5	-59.2	-177.5	0	0	0	112.7	N533 L538 R539 E540	N533-L536 HydrophobicContact CB-CB 4.32Å; N533-L536 HydrophobicContact CB-CD1 4.12Å; N533-L536 HydrophobicContact CB-CG 4.12Å; N533-L536 PolarHBondContact O-N 3.08Å; L536-L538 PolarHBondContact O-N 3.03Å; L536-R539 PolarHBondContact O-N 2.69Å; L536-E540 PolarHBondContact O-N 3.21Å
537	V	79.6	Confident	84.2	Confident	10 Å²	10	41.9 Å²	41.9	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-43.9	-179.2	172.2	0	0	0	0	111.1	C502 I505 V529 N533 V541	C502-V537 HydrophobicContact CB-CB 3.82Å; C502-V537 HydrophobicContact CB-CG1 4Å; C502-V537 HydrophobicContact CB-CG2 3.97Å; I505-V537 HydrophobicContact CG1-CG1 3.81Å; V529-V537 HydrophobicContact CG1-CG1 4.16Å; N533-V537 WeakPolarHBondContact O-CG2 3.11Å; N533-V537 PolarHBondContact O-N 2.8Å; V537-V541 VanDerWaalsContact O-CG2 3.27Å; V537-V541 WeakPolarHBondContact O-CG2 3.29Å; V537-V541 PolarHBondContact O-N 3.3Å
538	L	88.9	Confident	84.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-71.8	-36.6	178.9	-67.6	175.5	0	0	0	112.3	I505 C534 L536 E540 V541 L542 I589 V590 V596 F599	I505-L538 HydrophobicContact CD1-CD2 4.47Å; I505-L538 HydrophobicContact CG1-CD2 4.36Å; C534-L538 VanDerWaalsContact O-CB 3.26Å; C534-L538 WeakPolarHBondContact O-CB 3.08Å; C534-L538 VanDerWaalsContact O-CG 3.22Å; C534-L538 WeakPolarHBondContact O-CG 3.27Å; C534-L538 PolarHBondContact O-N 3.1Å; C534-L538 VanDerWaalsContact O-N 3.12Å; L536-L538 PolarHBondContact O-N 3.03Å; L538-E540 VanDerWaalsContact C-N 3.31Å; L538-E540 PolarHBondContact O-N 2.85Å; L538-V541 PolarHBondContact O-N 2.88Å; L538-L542 WeakPolarHBondContact O-CB 3.37Å; L538-L542 VanDerWaalsContact O-CG 3.26Å; L538-L542 WeakPolarHBondContact O-CG 3.39Å; L538-L542 PolarHBondContact O-N 3.41Å; L538-I589 HydrophobicContact CB-CG2 3.6Å; L538-I589 HydrophobicContact CD1-CG2 3.84Å; L538-I589 HydrophobicContact CG-CG2 4.37Å; L538-V590 HydrophobicContact CD1-CG2 3.52Å; L538-V596 HydrophobicContact CD1-CG2 4.32Å; L538-V596 HydrophobicContact CD2-CG1 4.48Å; L538-F599 HydrophobicContact CB-CE1 4.24Å; L538-F599 HydrophobicContact CD1-CD1 3.64Å; L538-F599 HydrophobicContact CD1-CE1 3.9Å; L538-F599 HydrophobicContact CD1-CG 4.36Å; L538-F599 HydrophobicContact CD2-CD1 3.86Å; L538-F599 HydrophobicContact CD2-CE1 4.03Å; L538-F599 HydrophobicContact CG-CD1 4.28Å; L538-F599 HydrophobicContact CG-CE1 4.29Å
539	R	88.3	Confident	84.8	Confident	107 Å²	107	34.8 Å²	34.8	40%	0.404	20%	0.196	S	C	.	.	H	α-helix	trans	-60	-40.8	174.7	-176.4	-175.1	-159.9	-125.6	21.9	112	V535 L536 T543 E572 L574 I589	V535-R539 WeakPolarHBondContact O-CB 3.48Å; V535-R539 PolarHBondContact O-N 2.94Å; L536-R539 PolarHBondContact O-N 2.69Å; R539-T543 WeakPolarHBondContact O-CB 3.33Å; R539-T543 PolarHBondContact O-N 3.12Å; R539-T543 PolarHBondContact O-OG1 2.95Å; R539-E572 IonicContact CZ-OE1 2.86Å; R539-E572 IonicContact CZ-OE2 3.84Å; R539-E572 VanDerWaalsContact NE-CD 3.26Å; R539-E572 IonicContact NE-OE1 3.54Å; R539-E572 PolarHBondContact NE-OE1 3.43Å; R539-E572 IonicContact NE-OE2 3.79Å; R539-E572 PolarHBondContact NE-OE2 3.05Å; R539-E572 IonicContact NH2-OE1 3.99Å; R539-E572 IonicContact NH2-OE2 3.82Å; R539-E572 PolarHBondContact NH2-OE2 2.7Å; R539-L574 HydrophobicContact CG-CD2 3.85Å; R539-I589 HydrophobicContact CB-CD1 3.9Å
540	E	88.7	Confident	85.5	Confident	86 Å²	86	39.1 Å²	39.1	40%	0.402	21%	0.211	S	C	.	.	H	α-helix	trans	-68.8	-49.1	174.3	-175.7	52	-146.2	0	0	111.5	V529 L536 L538 L542 T543 L544	V529-E540 HydrophobicContact CG1-CB 4.25Å; V529-E540 HydrophobicContact CG1-CG 4.13Å; L536-E540 PolarHBondContact O-N 3.21Å; L538-E540 VanDerWaalsContact C-N 3.31Å; L538-E540 PolarHBondContact O-N 2.85Å; E540-L542 VanDerWaalsContact C-N 3.28Å; E540-L542 PolarHBondContact O-N 2.96Å; E540-T543 WeakPolarHBondContact O-CA 3.14Å; E540-T543 WeakPolarHBondContact O-CB 3.29Å; E540-T543 PolarHBondContact O-N 3.04Å; E540-L544 HydrophobicContact CG-CD1 4.3Å; E540-L544 HydrophobicContact CG-CG 4.48Å; E540-L544 WeakPolarHBondContact O-CG 3.22Å; E540-L544 PolarHBondContact O-N 2.98Å; E540-L544 WeakPolarHBondContact OE1-CD2 3.3Å; E540-L544 WeakPolarHBondContact OE1-CG 3.4Å
541	V	92.1	Very high	86.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-53.2	-44.4	175.7	165.4	0	0	0	0	112.1	I505 F507 V529 V537 L538 L545 F614	I505-V541 HydrophobicContact CB-CG2 3.92Å; I505-V541 HydrophobicContact CG1-CG2 4.37Å; I505-V541 HydrophobicContact CG2-CG1 4.11Å; I505-V541 HydrophobicContact CG2-CG2 3.82Å; F507-V541 HydrophobicContact CE1-CG1 4.23Å; F507-V541 HydrophobicContact CE2-CG2 4.47Å; F507-V541 HydrophobicContact CZ-CB 4.31Å; F507-V541 HydrophobicContact CZ-CG1 3.9Å; F507-V541 HydrophobicContact CZ-CG2 4.25Å; V529-V541 HydrophobicContact CB-CG2 3.78Å; V529-V541 HydrophobicContact CG1-CG2 4.17Å; V529-V541 HydrophobicContact CG2-CG2 4.01Å; V537-V541 VanDerWaalsContact O-CG2 3.27Å; V537-V541 WeakPolarHBondContact O-CG2 3.29Å; V537-V541 PolarHBondContact O-N 3.3Å; L538-V541 PolarHBondContact O-N 2.88Å; V541-L545 HydrophobicContact CG1-CD1 3.99Å; V541-L545 WeakPolarHBondContact O-CD1 3.47Å; V541-L545 VanDerWaalsContact O-CG 3.25Å; V541-L545 WeakPolarHBondContact O-CG 3.44Å; V541-L545 PolarHBondContact O-N 2.79Å; V541-F614 HydrophobicContact CG1-CD2 3.59Å; V541-F614 HydrophobicContact CG1-CE2 3.64Å; V541-F614 HydrophobicContact CG1-CG 4.33Å; V541-F614 HydrophobicContact CG1-CZ 4.43Å
542	L	93.4	Very high	86.7	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-66.5	-38.3	175.9	-69	-178.6	0	0	0	112.4	L538 E540 L545 I546 L559 L574 V587 I589 F599 T603	L538-L542 WeakPolarHBondContact O-CB 3.37Å; L538-L542 VanDerWaalsContact O-CG 3.26Å; L538-L542 WeakPolarHBondContact O-CG 3.39Å; L538-L542 PolarHBondContact O-N 3.41Å; E540-L542 VanDerWaalsContact C-N 3.28Å; E540-L542 PolarHBondContact O-N 2.96Å; L542-L545 HydrophobicContact CD2-CD1 4.47Å; L542-L545 PolarHBondContact O-N 3.37Å; L542-I546 WeakPolarHBondContact O-CB 3.4Å; L542-I546 WeakPolarHBondContact O-CD1 3.31Å; L542-I546 WeakPolarHBondContact O-CG1 3.28Å; L542-I546 PolarHBondContact O-N 3.29Å; L542-L559 HydrophobicContact CD2-CD1 4.06Å; L542-L574 HydrophobicContact CB-CD1 3.72Å; L542-L574 HydrophobicContact CD1-CD1 3.77Å; L542-L574 HydrophobicContact CG-CD1 4.42Å; L542-V587 HydrophobicContact CD1-CG1 3.9Å; L542-I589 HydrophobicContact CD1-CD1 3.8Å; L542-I589 HydrophobicContact CD1-CG1 4Å; L542-F599 HydrophobicContact CD1-CZ 4.15Å; L542-T603 HydrophobicContact CD2-CG2 3.81Å
543	T	89.8	Confident	88	Confident	36 Å²	36	38.3 Å²	38.3	22%	0.221	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-44	178.1	-61.6	0	0	0	0	111.2	R539 E540 L545 I546 N547	R539-T543 WeakPolarHBondContact O-CB 3.33Å; R539-T543 PolarHBondContact O-N 3.12Å; R539-T543 PolarHBondContact O-OG1 2.95Å; E540-T543 WeakPolarHBondContact O-CA 3.14Å; E540-T543 WeakPolarHBondContact O-CB 3.29Å; E540-T543 PolarHBondContact O-N 3.04Å; T543-L545 PolarHBondContact O-N 2.87Å; T543-I546 PolarHBondContact O-N 2.68Å; T543-N547 PolarHBondContact O-N 2.85Å; T543-N547 PolarHBondContact O-ND2 3.12Å
544	L	91.6	Very high	88.4	Confident	32 Å²	32	39.6 Å²	39.6	17%	0.168	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-45.4	172.6	-65.8	174.6	0	0	0	112	F507 L525 P526 V529 E540 I546 N547 A548	F507-L544 HydrophobicContact CE2-CD1 3.97Å; F507-L544 HydrophobicContact CZ-CB 4.25Å; F507-L544 HydrophobicContact CZ-CD1 4.22Å; L525-L544 HydrophobicContact CD1-CB 4.16Å; L525-L544 HydrophobicContact CD2-CB 3.91Å; L525-L544 HydrophobicContact CD2-CD2 4.13Å; L525-L544 HydrophobicContact CD2-CG 4.46Å; P526-L544 HydrophobicContact CG-CD1 4.14Å; V529-L544 HydrophobicContact CG2-CD1 3.82Å; E540-L544 HydrophobicContact CG-CD1 4.3Å; E540-L544 HydrophobicContact CG-CG 4.48Å; E540-L544 WeakPolarHBondContact O-CG 3.22Å; E540-L544 PolarHBondContact O-N 2.98Å; E540-L544 WeakPolarHBondContact OE1-CD2 3.3Å; E540-L544 WeakPolarHBondContact OE1-CG 3.4Å; L544-I546 PolarHBondContact O-N 2.9Å; L544-N547 PolarHBondContact O-N 2.84Å; L544-A548 WeakPolarHBondContact O-CB 3.49Å; L544-A548 PolarHBondContact O-N 3Å
545	L	91.6	Very high	89	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.3	-39.5	175.8	-72.7	165.7	0	0	0	112.9	F507 L517 I522 V541 L542 T543 A548 A549 F614	F507-L545 HydrophobicContact CE1-CD1 4.34Å; F507-L545 HydrophobicContact CE1-CD2 3.85Å; F507-L545 HydrophobicContact CE1-CG 3.88Å; F507-L545 HydrophobicContact CZ-CG 4.48Å; L517-L545 HydrophobicContact CD1-CD2 3.87Å; L517-L545 VanDerWaalsContact CD2-O 3.23Å; L517-L545 WeakPolarHBondContact CD2-O 3.27Å; I522-L545 HydrophobicContact CD1-CD2 3.82Å; V541-L545 HydrophobicContact CG1-CD1 3.99Å; V541-L545 WeakPolarHBondContact O-CD1 3.47Å; V541-L545 VanDerWaalsContact O-CG 3.25Å; V541-L545 WeakPolarHBondContact O-CG 3.44Å; V541-L545 PolarHBondContact O-N 2.79Å; L542-L545 HydrophobicContact CD2-CD1 4.47Å; L542-L545 PolarHBondContact O-N 3.37Å; T543-L545 PolarHBondContact O-N 2.87Å; L545-A548 PolarHBondContact O-N 2.91Å; L545-A549 PolarHBondContact O-N 2.88Å; L545-F614 HydrophobicContact CD1-CD1 3.67Å; L545-F614 HydrophobicContact CD1-CD2 4.48Å; L545-F614 HydrophobicContact CD1-CE1 3.37Å; L545-F614 HydrophobicContact CD1-CE2 4.23Å; L545-F614 HydrophobicContact CD1-CG 4.22Å; L545-F614 HydrophobicContact CD1-CZ 3.68Å; L545-F614 HydrophobicContact CD2-CD1 4.34Å
546	I	92.2	Very high	89.3	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-43.2	175.6	-77.2	164.8	0	0	0	110.4	L542 T543 L544 A549 P552 V555 L556 L574 A576	L542-I546 WeakPolarHBondContact O-CB 3.4Å; L542-I546 WeakPolarHBondContact O-CD1 3.31Å; L542-I546 WeakPolarHBondContact O-CG1 3.28Å; L542-I546 PolarHBondContact O-N 3.29Å; T543-I546 PolarHBondContact O-N 2.68Å; L544-I546 PolarHBondContact O-N 2.9Å; I546-A549 WeakPolarHBondContact O-CB 3.43Å; I546-A549 PolarHBondContact O-N 2.86Å; I546-P552 HydrophobicContact CG2-CB 3.88Å; I546-P552 WeakPolarHBondContact O-CA 3.49Å; I546-P552 VanDerWaalsContact O-CB 3.29Å; I546-P552 WeakPolarHBondContact O-CB 3.47Å; I546-P552 WeakPolarHBondContact O-CG 2.86Å; I546-V555 HydrophobicContact CG1-CB 4.47Å; I546-V555 HydrophobicContact CG1-CG1 3.79Å; I546-L556 HydrophobicContact CD1-CD1 4.07Å; I546-L574 HydrophobicContact CD1-CB 4.18Å; I546-L574 HydrophobicContact CD1-CD1 3.72Å; I546-A576 HydrophobicContact CG2-CB 3.63Å
547	N	88.5	Confident	89.6	Confident	83 Å²	83	41 Å²	41	44%	0.444	18%	0.179	S	C	.	.	H	α-helix	trans	-73.4	-35	179.7	-69.1	-25.1	0	0	0	112.8	R521 T543 L544 A549	R521-N547 PolarHBondContact NH1-O 3.24Å; T543-N547 PolarHBondContact O-N 2.85Å; T543-N547 PolarHBondContact O-ND2 3.12Å; L544-N547 PolarHBondContact O-N 2.84Å; N547-A549 PolarHBondContact O-N 3Å
548	A	90.6	Very high	90.1	Very high	4 Å²	4	43.1 Å²	43.1	3%	0.033	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-5.4	172.9	0	0	0	0	0	114.1	N518 R521 I522 L525 L544 L545	N518-A548 WeakPolarHBondContact CB-O 3.47Å; N518-A548 PolarHBondContact N-O 2.67Å; R521-A548 HydrophobicContact CB-CB 3.86Å; I522-A548 HydrophobicContact CD1-CB 3.59Å; I522-A548 HydrophobicContact CG1-CB 4.06Å; L525-A548 HydrophobicContact CD1-CB 4.38Å; L544-A548 WeakPolarHBondContact O-CB 3.49Å; L544-A548 PolarHBondContact O-N 3Å; L545-A548 PolarHBondContact O-N 2.91Å
549	A	92.4	Very high	90	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-70.8	150.2	179.5	0	0	0	0	0	114	L517 L545 I546 N547 K551 P552 V555	L517-A549 HydrophobicContact CD2-CB 4.34Å; L545-A549 PolarHBondContact O-N 2.88Å; I546-A549 WeakPolarHBondContact O-CB 3.43Å; I546-A549 PolarHBondContact O-N 2.86Å; N547-A549 PolarHBondContact O-N 3Å; A549-K551 PolarHBondContact O-N 3.1Å; A549-P552 HydrophobicContact CB-CG 4.47Å; A549-V555 HydrophobicContact CB-CB 4.34Å; A549-V555 HydrophobicContact CB-CG2 3.55Å
550	Y	89.9	Confident	90	Very high	115 Å²	115	42.6 Å²	42.6	45%	0.451	19%	0.19	S	C	.	.	S	Bend	trans	-63.4	-30.2	166.8	-67	-71.8	0	0	0	112.3	Y516 L517 N518	Y516-Y550 WeakPolarHBondContact O-CD2 3.45Å; Y516-Y550 PolarHBondContact O-N 2.85Å; L517-Y550 WeakPolarHBondContact O-CE2 3.47Å; N518-Y550 HydrophobicContact CB-CD1 3.91Å; N518-Y550 HydrophobicContact CB-CD2 4.48Å; N518-Y550 HydrophobicContact CB-CE1 3.67Å; N518-Y550 HydrophobicContact CB-CE2 4.26Å; N518-Y550 HydrophobicContact CB-CG 4.31Å
551	K	91.6	Very high	89.5	Confident	107 Å²	107	41.3 Å²	41.3	47%	0.465	19%	0.186	S	C	.	.	S	Bend	trans	-145.4	94.8	175.4	-63.4	-166.9	177.1	179.8	0	108.4	A549 S553 R554 Y578	A549-K551 PolarHBondContact O-N 3.1Å; K551-S553 PolarHBondContact O-N 3.14Å; K551-R554 HydrophobicContact CB-CB 4.3Å; K551-R554 HydrophobicContact CB-CG 4.04Å; K551-R554 WeakPolarHBondContact O-CB 3.35Å; K551-R554 PolarHBondContact O-N 3.33Å; K551-Y578 HydrophobicContact CD-CE1 4.4Å; K551-Y578 HydrophobicContact CG-CE1 4.23Å; K551-Y578 HydrophobicContact CG-CE2 4.37Å
552	P	90.1	Very high	88.3	Confident	7 Å²	7	47.3 Å²	47.3	5%	0.045	22%	0.218	C	C	.	.	H	α-helix	trans	-49.2	-43.1	-179.7	-30.6	36	0	0	0	113.1	I546 A549 R554 V555 L556 A576 Y578	I546-P552 HydrophobicContact CG2-CB 3.88Å; I546-P552 WeakPolarHBondContact O-CA 3.49Å; I546-P552 VanDerWaalsContact O-CB 3.29Å; I546-P552 WeakPolarHBondContact O-CB 3.47Å; I546-P552 WeakPolarHBondContact O-CG 2.86Å; A549-P552 HydrophobicContact CB-CG 4.47Å; P552-R554 PolarHBondContact O-N 2.77Å; P552-V555 PolarHBondContact O-N 3.46Å; P552-V555 VanDerWaalsContact O-N 3.14Å; P552-L556 PolarHBondContact O-N 2.97Å; P552-A576 HydrophobicContact CB-CB 3.87Å; P552-Y578 HydrophobicContact CG-CD2 4.36Å
553	S	87.4	Confident	86.5	Confident	7 Å²	7	57.1 Å²	57.1	5%	0.049	26%	0.261	C	S	.	.	H	α-helix	trans	-70.4	3.1	176.8	68.1	0	0	0	0	115.6	K551 R557 Y583	K551-S553 PolarHBondContact O-N 3.14Å; S553-R557 VanDerWaalsContact O-CZ 3.22Å; S553-R557 PolarHBondContact O-NE 3.39Å; S553-R557 PolarHBondContact O-NH2 3.02Å; S553-Y583 VanDerWaalsContact CB-CD2 3.43Å
554	R	88	Confident	84.4	Confident	107 Å²	107	62.9 Å²	62.9	40%	0.404	29%	0.29	S	S	.	.	H	α-helix	trans	-96.5	-44.5	163.2	-71.3	-162.1	69	-144.4	-7.9	111.6	Y516 K551 P552 R557 E558	Y516-R554 HydrophobicContact CD1-CB 4.14Å; Y516-R554 HydrophobicContact CE1-CB 4.37Å; Y516-R554 VanDerWaalsContact CE1-CZ 3.42Å; Y516-R554 PolarHBondContact OH-NH2 2.86Å; Y516-R554 VanDerWaalsContact OH-NH2 3.14Å; K551-R554 HydrophobicContact CB-CB 4.3Å; K551-R554 HydrophobicContact CB-CG 4.04Å; K551-R554 WeakPolarHBondContact O-CB 3.35Å; K551-R554 PolarHBondContact O-N 3.33Å; P552-R554 PolarHBondContact O-N 2.77Å; R554-R557 PolarHBondContact O-N 2.8Å; R554-R557 VanDerWaalsContact O-N 3.12Å; R554-E558 IonicContact NH2-OE1 2.68Å; R554-E558 PolarHBondContact O-N 3.05Å; R554-E558 VanDerWaalsContact O-N 3.14Å
555	V	91.5	Very high	82.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.2	-51.3	174.8	172.1	0	0	0	0	109.7	L517 I546 A549 P552 R557 E558 L559 L607	L517-V555 HydrophobicContact CD2-CG2 4Å; I546-V555 HydrophobicContact CG1-CB 4.47Å; I546-V555 HydrophobicContact CG1-CG1 3.79Å; A549-V555 HydrophobicContact CB-CB 4.34Å; A549-V555 HydrophobicContact CB-CG2 3.55Å; P552-V555 PolarHBondContact O-N 3.46Å; P552-V555 VanDerWaalsContact O-N 3.14Å; V555-R557 PolarHBondContact O-N 3.19Å; V555-E558 PolarHBondContact O-N 3.46Å; V555-L559 HydrophobicContact CG1-CD1 3.76Å; V555-L559 HydrophobicContact CG1-CG 4.23Å; V555-L559 WeakPolarHBondContact O-CG 3.27Å; V555-L559 PolarHBondContact O-N 2.89Å; V555-L559 VanDerWaalsContact O-N 3.08Å; V555-L607 HydrophobicContact CB-CD2 4.35Å; V555-L607 HydrophobicContact CG1-CD1 4.11Å; V555-L607 HydrophobicContact CG1-CD2 3.88Å; V555-L607 HydrophobicContact CG2-CD2 4.29Å
556	L	89.3	Confident	80	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.016	34%	0.341	C	S	.	.	H	α-helix	trans	-56.4	-21.5	178.1	-174.3	61	0	0	0	114.3	I546 P552 Q560 L574 A576 A585 V587	I546-L556 HydrophobicContact CD1-CD1 4.07Å; P552-L556 PolarHBondContact O-N 2.97Å; L556-Q560 PolarHBondContact O-N 2.65Å; L556-L574 HydrophobicContact CD1-CB 3.78Å; L556-A576 HydrophobicContact CD2-CB 3.77Å; L556-A585 HydrophobicContact CD1-CB 3.77Å; L556-A585 HydrophobicContact CD2-CB 4.36Å; L556-A585 HydrophobicContact CG-CB 3.74Å; L556-V587 HydrophobicContact CD1-CG2 4.22Å
557	R	86.6	Confident	77.6	Confident	155 Å²	155	80.1 Å²	80.1	59%	0.585	38%	0.377	S	S	*	.	H	α-helix	trans	-93.6	-24.4	175.7	-88.6	-177.4	-68.6	-176.7	-5.9	114.9	S553 R554 V555 L559	S553-R557 VanDerWaalsContact O-CZ 3.22Å; S553-R557 PolarHBondContact O-NE 3.39Å; S553-R557 PolarHBondContact O-NH2 3.02Å; R554-R557 PolarHBondContact O-N 2.8Å; R554-R557 VanDerWaalsContact O-N 3.12Å; V555-R557 PolarHBondContact O-N 3.19Å; R557-L559 VanDerWaalsContact C-N 3.31Å
558	E	88.4	Confident	75.7	Confident	55 Å²	55	82.5 Å²	82.5	26%	0.257	39%	0.385	S	S	.	.	H	α-helix	trans	-83.3	-14.3	172	-55.3	-85.1	161.6	0	0	111.2	Y516 R554 V555 L607 K641	Y516-E558 HydrophobicContact CD1-CG 4.39Å; Y516-E558 HydrophobicContact CE1-CG 3.69Å; Y516-E558 PolarHBondContact OH-OE1 2.76Å; R554-E558 IonicContact NH2-OE1 2.68Å; R554-E558 PolarHBondContact O-N 3.05Å; R554-E558 VanDerWaalsContact O-N 3.14Å; V555-E558 PolarHBondContact O-N 3.46Å; E558-L607 HydrophobicContact CB-CD2 4.16Å; E558-K641 IonicContact OE2-NZ 3.61Å; E558-K641 PolarHBondContact OE2-NZ 2.82Å
559	L	88.8	Confident	74.1	Confident	5 Å²	5	83.9 Å²	83.9	3%	0.026	40%	0.4	C	S	.	.	S	Bend	trans	-96	-17.6	174.1	-61.2	-175.8	0	0	0	114.1	L542 V555 R557 V587 T603 L607	L542-L559 HydrophobicContact CD2-CD1 4.06Å; V555-L559 HydrophobicContact CG1-CD1 3.76Å; V555-L559 HydrophobicContact CG1-CG 4.23Å; V555-L559 WeakPolarHBondContact O-CG 3.27Å; V555-L559 PolarHBondContact O-N 2.89Å; V555-L559 VanDerWaalsContact O-N 3.08Å; R557-L559 VanDerWaalsContact C-N 3.31Å; L559-V587 HydrophobicContact CB-CG1 4.06Å; L559-V587 HydrophobicContact CB-CG2 3.95Å; L559-T603 HydrophobicContact CD2-CG2 3.76Å; L559-L607 HydrophobicContact CD2-CD1 4.28Å; L559-L607 HydrophobicContact CD2-CD2 3.98Å; L559-L607 HydrophobicContact CD2-CG 4.05Å; L559-L607 HydrophobicContact CG-CD2 4.21Å
560	Q	86.3	Confident	72.5	Confident	90 Å²	90	85.8 Å²	85.8	42%	0.421	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-57	142.5	-177.3	-178.6	165.6	5.2	0	0	112.1	L556 D562 A585	L556-Q560 PolarHBondContact O-N 2.65Å; Q560-D562 PolarHBondContact O-N 3.27Å; Q560-A585 HydrophobicContact CB-CB 4.08Å; Q560-A585 HydrophobicContact CG-CB 3.96Å
561	L	78.4	Confident	71.7	Confident	60 Å²	60	82.3 Å²	82.3	31%	0.314	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-60.6	122.4	173.9	-92.8	153.6	0	0	0	112.1	T586 E588	L561-T586 HydrophobicContact CD1-CG2 3.94Å; L561-T586 PolarHBondContact N-O 2.74Å; L561-E588 HydrophobicContact CD1-CB 4.21Å; L561-E588 HydrophobicContact CD2-CB 3.91Å; L561-E588 HydrophobicContact CD2-CG 4.31Å; L561-E588 HydrophobicContact CG-CB 4Å
562	D	68.6	Low	71	Confident	126 Å²	126	78.8 Å²	78.8	67%	0.674	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-82.2	131.4	169.7	-84.9	-43.7	0	0	0	110.1	Q560 D564 S565	Q560-D562 PolarHBondContact O-N 3.27Å; D562-D564 PolarHBondContact O-N 3.27Å; D562-S565 WeakPolarHBondContact O-CB 3.35Å; D562-S565 PolarHBondContact O-N 3.26Å; D562-S565 VanDerWaalsContact O-N 3.09Å; D562-S565 PolarHBondContact O-OG 2.97Å; D562-S565 VanDerWaalsContact O-OG 3.09Å
563	K	54.5	Low	70.7	Confident	207 Å²	207	80.9 Å²	80.9	90%	0.9	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-16	-167.1	-67.4	-171.7	174.9	-172.1	0	116.4
564	D	47	Very low	70.5	Confident	157 Å²	157	80.8 Å²	80.8	84%	0.84	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	9.2	-176.8	-52.3	-51.1	0	0	0	112.8	D562 V566	D562-D564 PolarHBondContact O-N 3.27Å; D564-V566 PolarHBondContact O-N 3.27Å
565	S	44.6	Very low	70.3	Confident	62 Å²	62	82.5 Å²	82.5	43%	0.434	42%	0.419	S	S	.	.			trans	-86.2	108.3	-177.6	-55.7	0	0	0	0	112.1	D562 W567	D562-S565 WeakPolarHBondContact O-CB 3.35Å; D562-S565 PolarHBondContact O-N 3.26Å; D562-S565 VanDerWaalsContact O-N 3.09Å; D562-S565 PolarHBondContact O-OG 2.97Å; D562-S565 VanDerWaalsContact O-OG 3.09Å; S565-W567 PolarHBondContact O-N 3.34Å
566	V	45.3	Very low	69.9	Low	133 Å²	133	82.7 Å²	82.7	81%	0.806	42%	0.42	S	S	*	.			trans	-87.1	92.6	172.2	-176.4	0	0	0	0	109.7	D564	D564-V566 PolarHBondContact O-N 3.27Å
567	W	42.3	Very low	69.3	Low	199 Å²	199	90.6 Å²	90.6	75%	0.754	45%	0.454	S	S	*	.			trans	-140.1	152.4	171.9	-77.6	88.4	0	0	0	111.1	S565 E588	S565-W567 PolarHBondContact O-N 3.34Å; W567-E588 WeakPolarHBondContact CB-OE1 3.47Å
568	H	48.3	Very low	69.1	Low	134 Å²	134	86.1 Å²	86.1	62%	0.62	44%	0.438	S	S	*	.			trans	-99	89.8	-175.9	-53.1	-110.9	0	0	0	110	R595	H568-R595 PolarHBondContact O-NH1 3.36Å; H568-R595 VanDerWaalsContact O-NH1 3.17Å
569	G	55.7	Low	68.7	Low	32 Å²	32	92 Å²	92	33%	0.33	46%	0.463	S	S	.	.			trans	-146	165.1	179.1	0	0	0	0	0	112.2
570	C	58.8	Low	68.1	Low	40 Å²	40	96 Å²	96	27%	0.27	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	139.3	177.2	-170.4	0	0	0	0	110.8	E572 E588 I589 K591	C570-E572 PolarHBondContact O-N 3.12Å; C570-E588 CarbonylContact O-C 3.54Å; C570-E588 WeakPolarHBondContact O-CA 3.26Å; C570-I589 PolarHBondContact N-O 2.94Å; C570-I589 PolarHBondContact O-N 3.14Å; C570-K591 HydrophobicContact CB-CG 4.33Å
571	G	74.1	Confident	67.3	Low	42 Å²	42	98.4 Å²	98.4	43%	0.433	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	82.5	-178.1	0	0	0	0	0	113.1	T586	G571-T586 VanDerWaalsContact O-CG2 3.29Å; G571-T586 WeakPolarHBondContact O-CG2 3.22Å
572	E	77.2	Confident	67.5	Low	34 Å²	34	99.9 Å²	99.9	16%	0.159	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	127.5	-174.8	-91.3	-74.2	179.6	0	0	113.5	V535 R539 C570 L574 T586 V587 I589	V535-E572 HydrophobicContact CG1-CG 3.93Å; R539-E572 IonicContact CZ-OE1 2.86Å; R539-E572 IonicContact CZ-OE2 3.84Å; R539-E572 VanDerWaalsContact NE-CD 3.26Å; R539-E572 IonicContact NE-OE1 3.54Å; R539-E572 PolarHBondContact NE-OE1 3.43Å; R539-E572 IonicContact NE-OE2 3.79Å; R539-E572 PolarHBondContact NE-OE2 3.05Å; R539-E572 IonicContact NH2-OE1 3.99Å; R539-E572 IonicContact NH2-OE2 3.82Å; R539-E572 PolarHBondContact NH2-OE2 2.7Å; C570-E572 PolarHBondContact O-N 3.12Å; E572-L574 PolarHBondContact O-N 3.31Å; E572-L574 VanDerWaalsContact O-N 3.11Å; E572-T586 CarbonylContact O-C 3.57Å; E572-T586 WeakPolarHBondContact O-CA 3.42Å; E572-V587 PolarHBondContact N-O 3.24Å; E572-V587 PolarHBondContact O-N 2.77Å; E572-I589 HydrophobicContact CB-CD1 3.75Å; E572-I589 HydrophobicContact CB-CG1 4.1Å; E572-I589 HydrophobicContact CG-CD1 3.98Å; E572-I589 HydrophobicContact CG-CG1 4.46Å
573	V	83.8	Confident	68.2	Low	51 Å²	51	97.8 Å²	97.8	31%	0.309	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	80.3	-176.4	-172.4	0	0	0	0	111.5	R584 T586	V573-R584 HydrophobicContact CG1-CB 4.26Å; V573-T586 HydrophobicContact CG2-CG2 4.27Å
574	L	82.6	Confident	69.7	Low	5 Å²	5	96 Å²	96	3%	0.026	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	143.5	176.5	-58	-174.5	0	0	0	112.2	R539 L542 I546 L556 E572 R584 A585 V587	R539-L574 HydrophobicContact CG-CD2 3.85Å; L542-L574 HydrophobicContact CB-CD1 3.72Å; L542-L574 HydrophobicContact CD1-CD1 3.77Å; L542-L574 HydrophobicContact CG-CD1 4.42Å; I546-L574 HydrophobicContact CD1-CB 4.18Å; I546-L574 HydrophobicContact CD1-CD1 3.72Å; L556-L574 HydrophobicContact CD1-CB 3.78Å; E572-L574 PolarHBondContact O-N 3.31Å; E572-L574 VanDerWaalsContact O-N 3.11Å; L574-R584 WeakPolarHBondContact O-CA 3.46Å; L574-A585 PolarHBondContact N-O 3.23Å; L574-A585 VanDerWaalsContact N-O 3.08Å; L574-A585 PolarHBondContact O-N 3.47Å; L574-A585 VanDerWaalsContact O-N 3.11Å; L574-V587 HydrophobicContact CD1-CB 4.01Å; L574-V587 HydrophobicContact CD1-CG1 4.35Å; L574-V587 HydrophobicContact CD1-CG2 3.96Å; L574-V587 HydrophobicContact CG-CB 4.32Å; L574-V587 HydrophobicContact CG-CG2 4.31Å
575	K	83.7	Confident	71.4	Confident	143 Å²	143	88.9 Å²	88.9	62%	0.622	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	142.1	-176.7	-53.8	180	-175.1	168	0	109.9	Y583 R584	K575-Y583 CarbonylContact C-O 3.57Å; K575-Y583 WeakPolarHBondContact CA-O 3.4Å; K575-R584 HydrophobicContact CG-CG 4.29Å
576	A	83.5	Confident	73.3	Confident	4 Å²	4	88.5 Å²	88.5	3%	0.033	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	129	175.8	0	0	0	0	0	111.8	I546 P552 L556 Y583	I546-A576 HydrophobicContact CG2-CB 3.63Å; P552-A576 HydrophobicContact CB-CB 3.87Å; L556-A576 HydrophobicContact CD2-CB 3.77Å; A576-Y583 PolarHBondContact N-O 3.09Å; A576-Y583 PolarHBondContact O-N 2.92Å
577	K	77.8	Confident	75.2	Confident	168 Å²	168	82.4 Å²	82.4	73%	0.73	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.8	171.1	-69.2	-179.5	179.1	177.3	0	109.9
578	Y	82.1	Confident	77.3	Confident	62 Å²	62	74.8 Å²	74.8	24%	0.243	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	125.1	172	-176.5	-107.1	0	0	0	111.5	K551 P552 G580 K581	K551-Y578 HydrophobicContact CD-CE1 4.4Å; K551-Y578 HydrophobicContact CG-CE1 4.23Å; K551-Y578 HydrophobicContact CG-CE2 4.37Å; P552-Y578 HydrophobicContact CG-CD2 4.36Å; Y578-G580 PolarHBondContact O-N 2.96Å; Y578-K581 PolarHBondContact N-O 3.4Å; Y578-K581 PolarHBondContact O-N 3.29Å; Y578-K581 VanDerWaalsContact O-N 3.09Å
579	K	80.1	Confident	79.2	Confident	179 Å²	179	68.4 Å²	68.4	78%	0.778	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	55.2	-177.5	-66.7	-164.5	170.1	-147.5	0	113.1	K581	K579-K581 PolarHBondContact O-N 3.15Å; K579-K581 VanDerWaalsContact O-N 3.09Å
580	G	75.2	Confident	80.6	Confident	89 Å²	89	67.5 Å²	67.5	92%	0.918	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	-1.5	179.9	0	0	0	0	0	115.6	Y578	Y578-G580 PolarHBondContact O-N 2.96Å
581	K	70.5	Confident	81.6	Confident	140 Å²	140	68.6 Å²	68.6	61%	0.609	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.6	179.6	-61.8	-167.2	177.7	-166.9	0	111.2	Y578 K579 Y583	Y578-K581 PolarHBondContact N-O 3.4Å; Y578-K581 PolarHBondContact O-N 3.29Å; Y578-K581 VanDerWaalsContact O-N 3.09Å; K579-K581 PolarHBondContact O-N 3.15Å; K579-K581 VanDerWaalsContact O-N 3.09Å; K581-Y583 HydrophobicContact CB-CE2 3.83Å; K581-Y583 WeakPolarHBondContact O-CD2 3.36Å; K581-Y583 WeakPolarHBondContact O-CE2 3.44Å
582	S	81.6	Confident	81.8	Confident	91 Å²	91	67.3 Å²	67.3	64%	0.636	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	137.9	171.9	-63.1	0	0	0	0	110.4
583	Y	83.7	Confident	82.1	Confident	81 Å²	81	66.8 Å²	66.8	32%	0.318	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	142.4	175.1	-61.1	-93.4	0	0	0	108.4	S553 K575 A576 K581	S553-Y583 VanDerWaalsContact CB-CD2 3.43Å; K575-Y583 CarbonylContact C-O 3.57Å; K575-Y583 WeakPolarHBondContact CA-O 3.4Å; A576-Y583 PolarHBondContact N-O 3.09Å; A576-Y583 PolarHBondContact O-N 2.92Å; K581-Y583 HydrophobicContact CB-CE2 3.83Å; K581-Y583 WeakPolarHBondContact O-CD2 3.36Å; K581-Y583 WeakPolarHBondContact O-CE2 3.44Å
584	R	85.3	Confident	82.1	Confident	170 Å²	170	69.8 Å²	69.8	64%	0.642	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.2	172.8	-60.8	-178.6	69.8	177.1	-1.2	108.4	V573 L574 K575	V573-R584 HydrophobicContact CG1-CB 4.26Å; L574-R584 WeakPolarHBondContact O-CA 3.46Å; K575-R584 HydrophobicContact CG-CG 4.29Å
585	A	84.1	Confident	82.2	Confident	7 Å²	7	74.4 Å²	74.4	6%	0.058	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	144	165.6	0	0	0	0	0	109.8	L556 Q560 L574	L556-A585 HydrophobicContact CD1-CB 3.77Å; L556-A585 HydrophobicContact CD2-CB 4.36Å; L556-A585 HydrophobicContact CG-CB 3.74Å; Q560-A585 HydrophobicContact CB-CB 4.08Å; Q560-A585 HydrophobicContact CG-CB 3.96Å; L574-A585 PolarHBondContact N-O 3.23Å; L574-A585 VanDerWaalsContact N-O 3.08Å; L574-A585 PolarHBondContact O-N 3.47Å; L574-A585 VanDerWaalsContact O-N 3.11Å
586	T	83.5	Confident	82.6	Confident	55 Å²	55	67.6 Å²	67.6	34%	0.337	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	127.7	169.9	-38.5	0	0	0	0	109.1	L561 G571 E572 V573	L561-T586 HydrophobicContact CD1-CG2 3.94Å; L561-T586 PolarHBondContact N-O 2.74Å; G571-T586 VanDerWaalsContact O-CG2 3.29Å; G571-T586 WeakPolarHBondContact O-CG2 3.22Å; E572-T586 CarbonylContact O-C 3.57Å; E572-T586 WeakPolarHBondContact O-CA 3.42Å; V573-T586 HydrophobicContact CG2-CG2 4.27Å
587	V	86.5	Confident	82.9	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.03	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.3	179.8	176.4	0	0	0	0	107.9	L542 L556 L559 E572 L574	L542-V587 HydrophobicContact CD1-CG1 3.9Å; L556-V587 HydrophobicContact CD1-CG2 4.22Å; L559-V587 HydrophobicContact CB-CG1 4.06Å; L559-V587 HydrophobicContact CB-CG2 3.95Å; E572-V587 PolarHBondContact N-O 3.24Å; E572-V587 PolarHBondContact O-N 2.77Å; L574-V587 HydrophobicContact CD1-CB 4.01Å; L574-V587 HydrophobicContact CD1-CG1 4.35Å; L574-V587 HydrophobicContact CD1-CG2 3.96Å; L574-V587 HydrophobicContact CG-CB 4.32Å; L574-V587 HydrophobicContact CG-CG2 4.31Å
588	E	84.5	Confident	83.5	Confident	38 Å²	38	67.1 Å²	67.1	18%	0.178	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	132.3	176.4	-159.1	-175	162.2	0	0	110.3	L561 W567 C570 F599	L561-E588 HydrophobicContact CD1-CB 4.21Å; L561-E588 HydrophobicContact CD2-CB 3.91Å; L561-E588 HydrophobicContact CD2-CG 4.31Å; L561-E588 HydrophobicContact CG-CB 4Å; W567-E588 WeakPolarHBondContact CB-OE1 3.47Å; C570-E588 CarbonylContact O-C 3.54Å; C570-E588 WeakPolarHBondContact O-CA 3.26Å; E588-F599 WeakPolarHBondContact O-CE2 3.46Å; E588-F599 WeakPolarHBondContact O-CZ 3.35Å
589	I	88.6	Confident	84.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.5	173.3	-59	-170.1	0	0	0	109.3	V535 L538 R539 L542 C570 E572 F599	V535-I589 HydrophobicContact CG1-CG2 4.48Å; L538-I589 HydrophobicContact CB-CG2 3.6Å; L538-I589 HydrophobicContact CD1-CG2 3.84Å; L538-I589 HydrophobicContact CG-CG2 4.37Å; R539-I589 HydrophobicContact CB-CD1 3.9Å; L542-I589 HydrophobicContact CD1-CD1 3.8Å; L542-I589 HydrophobicContact CD1-CG1 4Å; C570-I589 PolarHBondContact N-O 2.94Å; C570-I589 PolarHBondContact O-N 3.14Å; E572-I589 HydrophobicContact CB-CD1 3.75Å; E572-I589 HydrophobicContact CB-CG1 4.1Å; E572-I589 HydrophobicContact CG-CD1 3.98Å; E572-I589 HydrophobicContact CG-CG1 4.46Å; I589-F599 HydrophobicContact CG1-CZ 4.45Å
590	V	86.3	Confident	84.7	Confident	13 Å²	13	57 Å²	57	8%	0.079	30%	0.303	C	S	.	.			trans	-76.7	133.6	-178.9	-64.8	0	0	0	0	111.6	L538 R595 V596 F599	L538-V590 HydrophobicContact CD1-CG2 3.52Å; V590-R595 HydrophobicContact CB-CB 3.84Å; V590-R595 HydrophobicContact CG1-CB 3.84Å; V590-R595 HydrophobicContact CG2-CB 4.06Å; V590-V596 HydrophobicContact CG2-CG2 4.27Å; V590-F599 HydrophobicContact CG1-CB 4.01Å; V590-F599 HydrophobicContact CG1-CD2 3.89Å; V590-F599 HydrophobicContact CG1-CG 4.15Å; V590-F599 HydrophobicContact CG2-CB 3.69Å; V590-F599 HydrophobicContact CG2-CD1 4.35Å; V590-F599 HydrophobicContact CG2-CD2 4.34Å; V590-F599 HydrophobicContact CG2-CG 3.86Å
591	K	80	Confident	85.5	Confident	63 Å²	63	57.3 Å²	57.3	27%	0.274	28%	0.276	S	S	.	.			trans	-74.6	-28.3	177.8	-71.7	-174.9	169.5	-173.4	0	113.5	E19 Y500 C534 V535 C570	E19-K591 IonicContact OE1-NZ 2.98Å; E19-K591 PolarHBondContact OE1-NZ 3.14Å; E19-K591 IonicContact OE2-NZ 2.99Å; E19-K591 PolarHBondContact OE2-NZ 3.12Å; Y500-K591 WeakPolarHBondContact CD1-O 3.32Å; C534-K591 VanDerWaalsContact CB-O 3.25Å; C534-K591 WeakPolarHBondContact CB-O 3.49Å; V535-K591 HydrophobicContact CG2-CG 4.26Å; C570-K591 HydrophobicContact CB-CG 4.33Å
592	T	77.9	Confident	86.4	Confident	16 Å²	16	54.4 Å²	54.4	10%	0.098	27%	0.265	C	S	.	.	S	Bend	trans	-117.9	147.1	-165.4	58.7	0	0	0	0	114.2	K499 Y500 D594 R595	K499-T592 HydrophobicContact CG-CG2 4.21Å; K499-T592 CarbonylContact O-C 3.58Å; K499-T592 WeakPolarHBondContact O-CA 3.38Å; Y500-T592 HydrophobicContact CD1-CG2 3.83Å; Y500-T592 HydrophobicContact CE1-CG2 3.54Å; T592-D594 WeakPolarHBondContact CB-OD1 3.17Å; T592-D594 PolarHBondContact O-N 3Å; T592-D594 PolarHBondContact OG1-OD1 3.09Å; T592-R595 PolarHBondContact O-N 2.97Å; T592-R595 VanDerWaalsContact O-N 3.16Å
593	A	82.5	Confident	86.9	Confident	22 Å²	22	50.5 Å²	50.5	18%	0.182	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-33.5	-171.4	0	0	0	0	0	114	K499 C501 R595 V596	K499-A593 PolarHBondContact O-N 3.09Å; C501-A593 VanDerWaalsContact O-CB 3.25Å; C501-A593 WeakPolarHBondContact O-CB 3.37Å; A593-R595 PolarHBondContact O-N 3Å; A593-V596 WeakPolarHBondContact O-CB 3.46Å; A593-V596 PolarHBondContact O-N 3.02Å
594	D	84.4	Confident	87.3	Confident	114 Å²	114	46.6 Å²	46.6	61%	0.61	22%	0.222	S	C	*	.	H	α-helix	trans	-59.1	-35.1	175.5	65.2	-54.8	0	0	0	112.2	T592	T592-D594 WeakPolarHBondContact CB-OD1 3.17Å; T592-D594 PolarHBondContact O-N 3Å; T592-D594 PolarHBondContact OG1-OD1 3.09Å
595	R	85.4	Confident	87.4	Confident	102 Å²	102	41.4 Å²	41.4	39%	0.385	21%	0.206	S	C	.	.	H	α-helix	trans	-86.4	-17.8	-176.6	-58	-175.7	-179.7	-171.5	-2.9	113.5	H568 V590 T592 A593 T597 E598 F599	H568-R595 PolarHBondContact O-NH1 3.36Å; H568-R595 VanDerWaalsContact O-NH1 3.17Å; V590-R595 HydrophobicContact CB-CB 3.84Å; V590-R595 HydrophobicContact CG1-CB 3.84Å; V590-R595 HydrophobicContact CG2-CB 4.06Å; T592-R595 PolarHBondContact O-N 2.97Å; T592-R595 VanDerWaalsContact O-N 3.16Å; A593-R595 PolarHBondContact O-N 3Å; R595-T597 VanDerWaalsContact C-N 3.29Å; R595-T597 PolarHBondContact O-N 3.37Å; R595-E598 PolarHBondContact O-N 3.08Å; R595-F599 WeakPolarHBondContact O-CB 3.41Å; R595-F599 PolarHBondContact O-N 3.42Å
596	V	90.5	Very high	87.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-54.3	-42.7	-176.1	169.1	0	0	0	0	112.4	P503 I505 C534 L538 V590 A593 F599 C600	P503-V596 HydrophobicContact CG-CG1 4.12Å; I505-V596 HydrophobicContact CD1-CG1 3.49Å; I505-V596 VanDerWaalsContact CD1-CG1 3.49Å; C534-V596 HydrophobicContact CB-CG2 4.48Å; L538-V596 HydrophobicContact CD1-CG2 4.32Å; L538-V596 HydrophobicContact CD2-CG1 4.48Å; V590-V596 HydrophobicContact CG2-CG2 4.27Å; A593-V596 WeakPolarHBondContact O-CB 3.46Å; A593-V596 PolarHBondContact O-N 3.02Å; V596-F599 PolarHBondContact O-N 3.29Å; V596-C600 PolarHBondContact O-N 3.32Å; V596-C600 PolarHBondContact O-SG 2.88Å
597	T	91.4	Very high	88	Confident	82 Å²	82	42.6 Å²	42.6	50%	0.503	21%	0.205	S	C	.	.	H	α-helix	trans	-61.6	-49.4	-178.5	-55.2	0	0	0	0	111.8	R595 R601 P616	R595-T597 VanDerWaalsContact C-N 3.29Å; R595-T597 PolarHBondContact O-N 3.37Å; T597-R601 WeakPolarHBondContact O-CB 3.37Å; T597-R601 PolarHBondContact O-N 3.5Å; T597-P616 HydrophobicContact CG2-CG 4.14Å; T597-P616 WeakPolarHBondContact OG1-CG 3.25Å
598	E	90.2	Very high	88.1	Confident	81 Å²	81	43.6 Å²	43.6	38%	0.379	21%	0.21	S	C	.	.	H	α-helix	trans	-71.9	-35.8	-179.7	-178.2	61	-174.3	0	0	111.4	R595 C600 R601 Q602	R595-E598 PolarHBondContact O-N 3.08Å; E598-C600 PolarHBondContact O-N 2.93Å; E598-R601 PolarHBondContact O-N 2.86Å; E598-R601 IonicContact OE1-CZ 2.81Å; E598-R601 IonicContact OE1-NE 3.92Å; E598-R601 IonicContact OE1-NH2 3.73Å; E598-R601 PolarHBondContact OE1-NH2 3.36Å; E598-R601 IonicContact OE2-CZ 3.84Å; E598-R601 VanDerWaalsContact OE2-CZ 3.22Å; E598-R601 IonicContact OE2-NE 3.45Å; E598-R601 PolarHBondContact OE2-NE 3.49Å; E598-R601 IonicContact OE2-NH2 2.75Å; E598-R601 PolarHBondContact OE2-NH2 2.87Å; E598-Q602 HydrophobicContact CG-CG 4.11Å; E598-Q602 WeakPolarHBondContact O-CB 3.18Å; E598-Q602 WeakPolarHBondContact O-CG 3.23Å; E598-Q602 PolarHBondContact O-N 3.15Å; E598-Q602 WeakPolarHBondContact OE1-CG 3.43Å; E598-Q602 PolarHBondContact OE1-NE2 3.11Å
599	F	93.7	Very high	88.4	Confident	27 Å²	27	41.9 Å²	41.9	12%	0.118	20%	0.202	C	C	.	.	H	α-helix	trans	-57.9	-48.6	174.9	177.8	-99.3	0	0	0	112.8	L538 L542 E588 I589 V590 R595 V596 R601 T603	L538-F599 HydrophobicContact CB-CE1 4.24Å; L538-F599 HydrophobicContact CD1-CD1 3.64Å; L538-F599 HydrophobicContact CD1-CE1 3.9Å; L538-F599 HydrophobicContact CD1-CG 4.36Å; L538-F599 HydrophobicContact CD2-CD1 3.86Å; L538-F599 HydrophobicContact CD2-CE1 4.03Å; L538-F599 HydrophobicContact CG-CD1 4.28Å; L538-F599 HydrophobicContact CG-CE1 4.29Å; L542-F599 HydrophobicContact CD1-CZ 4.15Å; E588-F599 WeakPolarHBondContact O-CE2 3.46Å; E588-F599 WeakPolarHBondContact O-CZ 3.35Å; I589-F599 HydrophobicContact CG1-CZ 4.45Å; V590-F599 HydrophobicContact CG1-CB 4.01Å; V590-F599 HydrophobicContact CG1-CD2 3.89Å; V590-F599 HydrophobicContact CG1-CG 4.15Å; V590-F599 HydrophobicContact CG2-CB 3.69Å; V590-F599 HydrophobicContact CG2-CD1 4.35Å; V590-F599 HydrophobicContact CG2-CD2 4.34Å; V590-F599 HydrophobicContact CG2-CG 3.86Å; R595-F599 WeakPolarHBondContact O-CB 3.41Å; R595-F599 PolarHBondContact O-N 3.42Å; V596-F599 PolarHBondContact O-N 3.29Å; F599-R601 VanDerWaalsContact C-N 3.32Å; F599-R601 PolarHBondContact O-N 3.28Å; F599-T603 VanDerWaalsContact O-CB 3.28Å; F599-T603 WeakPolarHBondContact O-CB 3.15Å; F599-T603 PolarHBondContact O-N 3.41Å; F599-T603 PolarHBondContact O-OG1 3.24Å
600	C	93.9	Very high	88.4	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-44	177.1	-63.7	0	0	0	0	111	V596 E598 T603 C604 F614	V596-C600 PolarHBondContact O-N 3.32Å; V596-C600 PolarHBondContact O-SG 2.88Å; E598-C600 PolarHBondContact O-N 2.93Å; C600-T603 PolarHBondContact O-N 3.28Å; C600-C604 PolarHBondContact O-N 2.87Å; C600-C604 PolarHBondContact O-SG 2.83Å; C600-F614 HydrophobicContact CB-CD2 3.97Å; C600-F614 HydrophobicContact CB-CE2 3.67Å; C600-F614 HydrophobicContact CB-CZ 4.33Å
601	R	92.1	Very high	88.6	Confident	95 Å²	95	41.7 Å²	41.7	36%	0.358	20%	0.201	S	C	.	.	H	α-helix	trans	-64.5	-45.3	-179.2	-160.5	-177.6	70.9	88.3	5	112.5	T597 E598 F599 C604 I605 P611	T597-R601 WeakPolarHBondContact O-CB 3.37Å; T597-R601 PolarHBondContact O-N 3.5Å; E598-R601 PolarHBondContact O-N 2.86Å; E598-R601 IonicContact OE1-CZ 2.81Å; E598-R601 IonicContact OE1-NE 3.92Å; E598-R601 IonicContact OE1-NH2 3.73Å; E598-R601 PolarHBondContact OE1-NH2 3.36Å; E598-R601 IonicContact OE2-CZ 3.84Å; E598-R601 VanDerWaalsContact OE2-CZ 3.22Å; E598-R601 IonicContact OE2-NE 3.45Å; E598-R601 PolarHBondContact OE2-NE 3.49Å; E598-R601 IonicContact OE2-NH2 2.75Å; E598-R601 PolarHBondContact OE2-NH2 2.87Å; F599-R601 VanDerWaalsContact C-N 3.32Å; F599-R601 PolarHBondContact O-N 3.28Å; R601-C604 WeakPolarHBondContact O-CB 3.41Å; R601-C604 PolarHBondContact O-N 3.36Å; R601-I605 HydrophobicContact CG-CD1 4.46Å; R601-I605 WeakPolarHBondContact O-CD1 3.33Å; R601-I605 VanDerWaalsContact O-CG1 3.3Å; R601-I605 WeakPolarHBondContact O-CG1 3.33Å; R601-I605 PolarHBondContact O-N 3.11Å; R601-I605 VanDerWaalsContact O-N 3.1Å; R601-P611 HydrophobicContact CG-CB 3.82Å
602	Q	89.4	Confident	89.1	Confident	80 Å²	80	40.4 Å²	40.4	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-68	-38.9	177	-71.4	-67.1	-8.9	0	0	112	E598 C604 I605 K606	E598-Q602 HydrophobicContact CG-CG 4.11Å; E598-Q602 WeakPolarHBondContact O-CB 3.18Å; E598-Q602 WeakPolarHBondContact O-CG 3.23Å; E598-Q602 PolarHBondContact O-N 3.15Å; E598-Q602 WeakPolarHBondContact OE1-CG 3.43Å; E598-Q602 PolarHBondContact OE1-NE2 3.11Å; Q602-C604 VanDerWaalsContact C-N 3.34Å; Q602-C604 PolarHBondContact O-N 2.91Å; Q602-I605 PolarHBondContact O-N 3.32Å; Q602-K606 WeakPolarHBondContact O-CG 3.43Å; Q602-K606 PolarHBondContact O-N 3.04Å
603	T	91.8	Very high	89.8	Confident	8 Å²	8	39.7 Å²	39.7	5%	0.049	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-43.7	173.7	-63.4	0	0	0	0	111.4	L542 L559 F599 C600 I605 K606 L607 F614	L542-T603 HydrophobicContact CD2-CG2 3.81Å; L559-T603 HydrophobicContact CD2-CG2 3.76Å; F599-T603 VanDerWaalsContact O-CB 3.28Å; F599-T603 WeakPolarHBondContact O-CB 3.15Å; F599-T603 PolarHBondContact O-N 3.41Å; F599-T603 PolarHBondContact O-OG1 3.24Å; C600-T603 PolarHBondContact O-N 3.28Å; T603-I605 VanDerWaalsContact C-N 3.33Å; T603-I605 PolarHBondContact O-N 3.06Å; T603-K606 PolarHBondContact O-N 3.12Å; T603-L607 HydrophobicContact CG2-CD1 4.4Å; T603-L607 WeakPolarHBondContact O-CG 3.33Å; T603-L607 PolarHBondContact O-N 2.93Å; T603-L607 VanDerWaalsContact O-N 3.16Å; T603-F614 HydrophobicContact CG2-CE1 4.01Å; T603-F614 HydrophobicContact CG2-CZ 3.6Å
604	C	91.6	Very high	90.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.9	-44.1	172.7	-73	0	0	0	0	112.6	C600 R601 Q602 L607 E608 C609 C610 F614	C600-C604 PolarHBondContact O-N 2.87Å; C600-C604 PolarHBondContact O-SG 2.83Å; R601-C604 WeakPolarHBondContact O-CB 3.41Å; R601-C604 PolarHBondContact O-N 3.36Å; Q602-C604 VanDerWaalsContact C-N 3.34Å; Q602-C604 PolarHBondContact O-N 2.91Å; C604-L607 CarbonylContact O-C 3.53Å; C604-L607 PolarHBondContact O-N 3.34Å; C604-E608 PolarHBondContact O-N 2.87Å; C604-C609 WeakPolarHBondContact CA-SG 3.44Å; C604-C609 PolarHBondContact O-N 2.68Å; C604-C609 VanDerWaalsContact O-N 3.13Å; C604-C609 PolarHBondContact O-SG 3.45Å; C604-C610 WeakPolarHBondContact CB-O 3.25Å; C604-C610 PolarHBondContact SG-O 3.4Å; C604-C610 VanDerWaalsContact SG-O 3.39Å; C604-F614 WeakPolarHBondContact SG-CD1 3.49Å; C604-F614 WeakPolarHBondContact SG-CE1 3.47Å
605	I	88.2	Confident	90.7	Very high	61 Å²	61	33.6 Å²	33.6	31%	0.313	16%	0.158	S	C	.	.	H	α-helix	trans	-66.6	-41.7	179	-67.4	162.6	0	0	0	111.3	R601 Q602 T603 L607 E608 P611	R601-I605 HydrophobicContact CG-CD1 4.46Å; R601-I605 WeakPolarHBondContact O-CD1 3.33Å; R601-I605 VanDerWaalsContact O-CG1 3.3Å; R601-I605 WeakPolarHBondContact O-CG1 3.33Å; R601-I605 PolarHBondContact O-N 3.11Å; R601-I605 VanDerWaalsContact O-N 3.1Å; Q602-I605 PolarHBondContact O-N 3.32Å; T603-I605 VanDerWaalsContact C-N 3.33Å; T603-I605 PolarHBondContact O-N 3.06Å; I605-L607 PolarHBondContact O-N 3.27Å; I605-E608 PolarHBondContact O-N 2.72Å; I605-E608 VanDerWaalsContact O-N 3.1Å; I605-P611 HydrophobicContact CD1-CG 4.48Å; I605-P611 HydrophobicContact CG1-CG 4.12Å
606	K	88.5	Confident	90.8	Very high	86 Å²	86	30.5 Å²	30.5	37%	0.374	15%	0.151	S	C	.	.	H	α-helix	trans	-55.7	-37.2	173.6	-77.5	-176.1	177.3	-176.1	0	111.8	Q602 T603 K641	Q602-K606 WeakPolarHBondContact O-CG 3.43Å; Q602-K606 PolarHBondContact O-N 3.04Å; T603-K606 PolarHBondContact O-N 3.12Å; K606-K641 PolarHBondContact O-NZ 2.99Å
607	L	90.8	Very high	90.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	11.5	179.6	-60.6	-179.4	0	0	0	115	Y516 L517 V555 E558 L559 T603 C604 I605 C609	Y516-L607 VanDerWaalsContact CD2-O 3.27Å; Y516-L607 WeakPolarHBondContact CD2-O 3.39Å; L517-L607 HydrophobicContact CD1-CD1 4.47Å; V555-L607 HydrophobicContact CB-CD2 4.35Å; V555-L607 HydrophobicContact CG1-CD1 4.11Å; V555-L607 HydrophobicContact CG1-CD2 3.88Å; V555-L607 HydrophobicContact CG2-CD2 4.29Å; E558-L607 HydrophobicContact CB-CD2 4.16Å; L559-L607 HydrophobicContact CD2-CD1 4.28Å; L559-L607 HydrophobicContact CD2-CD2 3.98Å; L559-L607 HydrophobicContact CD2-CG 4.05Å; L559-L607 HydrophobicContact CG-CD2 4.21Å; T603-L607 HydrophobicContact CG2-CD1 4.4Å; T603-L607 WeakPolarHBondContact O-CG 3.33Å; T603-L607 PolarHBondContact O-N 2.93Å; T603-L607 VanDerWaalsContact O-N 3.16Å; C604-L607 CarbonylContact O-C 3.53Å; C604-L607 PolarHBondContact O-N 3.34Å; I605-L607 PolarHBondContact O-N 3.27Å; L607-C609 PolarHBondContact O-N 3.14Å; L607-C609 VanDerWaalsContact O-N 3.12Å
608	E	88.5	Confident	90.4	Very high	26 Å²	26	38.8 Å²	38.8	12%	0.121	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	30.4	179.4	-63.2	178.6	-149.9	0	0	113.7	G514 P515 Y516 C604 I605	G514-E608 VanDerWaalsContact CA-O 3.28Å; G514-E608 WeakPolarHBondContact CA-O 3.29Å; P515-E608 WeakPolarHBondContact CD-O 3.42Å; P515-E608 HydrophobicContact CG-CB 3.87Å; Y516-E608 HydrophobicContact CE2-CB 4.27Å; Y516-E608 HydrophobicContact CE2-CG 4.23Å; C604-E608 PolarHBondContact O-N 2.87Å; I605-E608 PolarHBondContact O-N 2.72Å; I605-E608 VanDerWaalsContact O-N 3.1Å
609	C	90.2	Very high	90.1	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.02	17%	0.166	C	C	.	.	S	Bend	trans	-108.5	-177.2	177.4	72.4	0	0	0	0	112	F512 S513 C604 L607 L613	F512-C609 WeakPolarHBondContact O-CB 3.38Å; S513-C609 VanDerWaalsContact C-CB 3.47Å; C604-C609 WeakPolarHBondContact CA-SG 3.44Å; C604-C609 PolarHBondContact O-N 2.68Å; C604-C609 VanDerWaalsContact O-N 3.13Å; C604-C609 PolarHBondContact O-SG 3.45Å; L607-C609 PolarHBondContact O-N 3.14Å; L607-C609 VanDerWaalsContact O-N 3.12Å; C609-L613 HydrophobicContact CB-CD2 3.89Å; C609-L613 VanDerWaalsContact SG-CD2 3.53Å
610	C	89.8	Confident	88.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.191	C	C	.	.			trans	-61	130.6	175.7	-177.7	0	0	0	0	110.6	C511 F512 C604 N612 L613 C627	C511-C610 HydrophobicContact CB-CB 3.83Å; F512-C610 HydrophobicContact CB-CB 4.29Å; F512-C610 WeakPolarHBondContact O-CB 3.34Å; F512-C610 PolarHBondContact O-N 3.5Å; C604-C610 WeakPolarHBondContact CB-O 3.25Å; C604-C610 PolarHBondContact SG-O 3.4Å; C604-C610 VanDerWaalsContact SG-O 3.39Å; C610-N612 PolarHBondContact O-N 3.1Å; C610-N612 PolarHBondContact SG-N 3.43Å; C610-L613 HydrophobicContact CB-CB 4.24Å; C610-L613 VanDerWaalsContact O-CB 3.27Å; C610-L613 WeakPolarHBondContact O-CB 3.44Å; C610-L613 PolarHBondContact O-N 2.71Å; C610-C627 HydrophobicContact CB-CB 4.32Å
611	P	89.8	Confident	87.6	Confident	9 Å²	9	46.4 Å²	46.4	6%	0.058	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-23.4	173	-29.3	35	0	0	0	115.3	R601 I605 E625 Y635 Y639	R601-P611 HydrophobicContact CG-CB 3.82Å; I605-P611 HydrophobicContact CD1-CG 4.48Å; I605-P611 HydrophobicContact CG1-CG 4.12Å; P611-E625 HydrophobicContact CG-CG 4.3Å; P611-Y635 WeakPolarHBondContact CD-OH 3.5Å; P611-Y639 HydrophobicContact CG-CD1 4.5Å; P611-Y639 HydrophobicContact CG-CE1 4.49Å
612	N	90.6	Very high	86.7	Confident	36 Å²	36	50.8 Å²	50.8	19%	0.193	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	21.6	175.3	-55.2	-50.4	0	0	0	112.8	N508 C610 F614 V619 S624	N508-N612 WeakPolarHBondContact CB-O 3.26Å; N508-N612 PolarHBondContact ND2-O 3.18Å; C610-N612 PolarHBondContact O-N 3.1Å; C610-N612 PolarHBondContact SG-N 3.43Å; N612-F614 VanDerWaalsContact C-N 3.26Å; N612-F614 PolarHBondContact O-N 2.64Å; N612-V619 HydrophobicContact CB-CG2 4.31Å; N612-S624 PolarHBondContact ND2-OG 3.43Å
613	L	92.1	Very high	86.3	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.228	C	C	.	.	S	Bend	trans	-61.6	-38.9	177.8	179.8	67.8	0	0	0	111.1	N508 C511 L517 I522 C609 C610	N508-L613 PolarHBondContact N-O 3.35Å; C511-L613 HydrophobicContact CB-CB 4.49Å; C511-L613 HydrophobicContact CB-CD1 3.88Å; L517-L613 HydrophobicContact CD1-CD2 3.57Å; I522-L613 HydrophobicContact CG2-CD1 4.41Å; C609-L613 HydrophobicContact CB-CD2 3.89Å; C609-L613 VanDerWaalsContact SG-CD2 3.53Å; C610-L613 HydrophobicContact CB-CB 4.24Å; C610-L613 VanDerWaalsContact O-CB 3.27Å; C610-L613 WeakPolarHBondContact O-CB 3.44Å; C610-L613 PolarHBondContact O-N 2.71Å
614	F	94.1	Very high	85.7	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.013	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.5	167.1	73.1	-84.4	0	0	0	110.7	I505 Y506 F507 V541 L545 C600 T603 C604 N612	I505-F614 HydrophobicContact CG2-CB 4.5Å; I505-F614 HydrophobicContact CG2-CD2 3.77Å; Y506-F614 CarbonylContact O-C 3.59Å; Y506-F614 WeakPolarHBondContact O-CA 3.27Å; Y506-F614 WeakPolarHBondContact O-CB 3.26Å; F507-F614 HydrophobicContact CD1-CB 3.8Å; F507-F614 HydrophobicContact CE1-CB 4.04Å; F507-F614 HydrophobicContact CE1-CG 4.46Å; V541-F614 HydrophobicContact CG1-CD2 3.59Å; V541-F614 HydrophobicContact CG1-CE2 3.64Å; V541-F614 HydrophobicContact CG1-CG 4.33Å; V541-F614 HydrophobicContact CG1-CZ 4.43Å; L545-F614 HydrophobicContact CD1-CD1 3.67Å; L545-F614 HydrophobicContact CD1-CD2 4.48Å; L545-F614 HydrophobicContact CD1-CE1 3.37Å; L545-F614 HydrophobicContact CD1-CE2 4.23Å; L545-F614 HydrophobicContact CD1-CG 4.22Å; L545-F614 HydrophobicContact CD1-CZ 3.68Å; L545-F614 HydrophobicContact CD2-CD1 4.34Å; C600-F614 HydrophobicContact CB-CD2 3.97Å; C600-F614 HydrophobicContact CB-CE2 3.67Å; C600-F614 HydrophobicContact CB-CZ 4.33Å; T603-F614 HydrophobicContact CG2-CE1 4.01Å; T603-F614 HydrophobicContact CG2-CZ 3.6Å; C604-F614 WeakPolarHBondContact SG-CD1 3.49Å; C604-F614 WeakPolarHBondContact SG-CE1 3.47Å; N612-F614 VanDerWaalsContact C-N 3.26Å; N612-F614 PolarHBondContact O-N 2.64Å
615	G	91.5	Very high	85.1	Confident	5 Å²	5	52.9 Å²	52.9	5%	0.052	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.6	-177.3	178	0	0	0	0	0	113.2	Y506 R617	Y506-G615 PolarHBondContact N-O 3.45Å; Y506-G615 PolarHBondContact O-N 2.85Å; Y506-G615 VanDerWaalsContact O-N 3.1Å; G615-R617 PolarHBondContact O-N 2.98Å; G615-R617 VanDerWaalsContact O-N 3.09Å
616	P	89	Confident	84.5	Confident	37 Å²	37	54.4 Å²	54.4	24%	0.24	27%	0.27	C	S	.	.	S	Bend	trans	-68.2	-7.6	-175.9	24.9	-32.8	0	0	0	115.2	P503 K504 T597	P503-P616 HydrophobicContact CB-CB 4.14Å; P503-P616 HydrophobicContact CG-CB 3.77Å; K504-P616 WeakPolarHBondContact O-CA 3.22Å; T597-P616 HydrophobicContact CG2-CG 4.14Å; T597-P616 WeakPolarHBondContact OG1-CG 3.25Å
617	R	86.9	Confident	84.2	Confident	188 Å²	188	50.5 Å²	50.5	71%	0.709	25%	0.254	S	S	*	.	S	Bend	trans	-108.5	115.7	178.8	-174.9	176.6	-177.3	171.7	4.6	111.1	N508 G615	N508-R617 PolarHBondContact ND2-O 2.84Å; G615-R617 PolarHBondContact O-N 2.98Å; G615-R617 VanDerWaalsContact O-N 3.09Å
618	M	86.6	Confident	83.2	Confident	68 Å²	68	54.4 Å²	54.4	34%	0.335	28%	0.281	S	S	.	.			trans	-67	139.8	167.6	-165.2	-168.5	-70.8	0	0	110.7	Y506 N508 L620	Y506-M618 HydrophobicContact CD1-CB 4.02Å; Y506-M618 HydrophobicContact CD1-CE 3.47Å; Y506-M618 VanDerWaalsContact CD1-CE 3.47Å; Y506-M618 HydrophobicContact CD1-CG 4.14Å; Y506-M618 HydrophobicContact CD2-CB 4.03Å; Y506-M618 HydrophobicContact CE1-CB 4.42Å; Y506-M618 HydrophobicContact CE1-CE 3.32Å; Y506-M618 HydrophobicContact CE2-CB 4.41Å; Y506-M618 HydrophobicContact CG-CB 3.82Å; Y506-M618 HydrophobicContact CG-CE 4.43Å; Y506-M618 HydrophobicContact CG-CG 4.28Å; N508-M618 WeakPolarHBondContact OD1-CA 3.44Å; M618-L620 HydrophobicContact CG-CD2 4.47Å; M618-L620 HydrophobicContact SD-CD2 3.54Å; M618-L620 VanDerWaalsContact SD-CD2 3.54Å; M618-L620 HydrophobicContact SD-CG 4.33Å
619	V	82.2	Confident	82.3	Confident	24 Å²	24	58.6 Å²	58.6	15%	0.145	31%	0.308	C	S	.	.			trans	-118.1	101.2	175.5	177.5	0	0	0	0	108.7	N508 N612 C623	N508-V619 HydrophobicContact CB-CB 4.18Å; N508-V619 PolarHBondContact OD1-N 3.11Å; N612-V619 HydrophobicContact CB-CG2 4.31Å; V619-C623 HydrophobicContact CG1-CB 3.99Å
620	L	68.9	Low	81.4	Confident	123 Å²	123	60.9 Å²	60.9	64%	0.644	32%	0.32	S	S	*	.	S	Bend	trans	-68.6	-66	-176.3	-65.5	167.7	0	0	0	112.2	M618	M618-L620 HydrophobicContact CG-CD2 4.47Å; M618-L620 HydrophobicContact SD-CD2 3.54Å; M618-L620 VanDerWaalsContact SD-CD2 3.54Å; M618-L620 HydrophobicContact SD-CG 4.33Å
621	D	66.6	Low	80.6	Confident	122 Å²	122	64.9 Å²	64.9	65%	0.652	34%	0.344	S	S	*	.	S	Bend	trans	-113.5	-56.4	-174.3	-71.2	-59	0	0	0	114.6
622	K	72.7	Confident	79.5	Confident	186 Å²	186	70.1 Å²	70.1	81%	0.809	37%	0.366	S	S	*	.			trans	-118.8	117.2	-171.6	-65.1	178.9	-175.2	172.2	0	110.6
623	C	81.7	Confident	78.5	Confident	7 Å²	7	74.2 Å²	74.2	5%	0.047	39%	0.393	C	S	.	.			trans	-72.9	138.7	172.4	177.8	0	0	0	0	111	V619 E625 N626	V619-C623 HydrophobicContact CG1-CB 3.99Å; C623-E625 PolarHBondContact O-N 3.07Å; C623-N626 WeakPolarHBondContact O-CA 3.41Å; C623-N626 PolarHBondContact O-N 3.32Å
624	S	79.8	Confident	77.3	Confident	72 Å²	72	80 Å²	80	50%	0.503	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-42.6	176	60.8	0	0	0	0	112.8	N612 N626	N612-S624 PolarHBondContact ND2-OG 3.43Å; S624-N626 PolarHBondContact O-N 3.07Å; S624-N626 PolarHBondContact O-ND2 2.91Å
625	E	77.8	Confident	76.3	Confident	53 Å²	53	79.9 Å²	79.9	25%	0.248	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	2.9	178.5	-52.7	-47	110.8	0	0	114.3	P611 C623 C627 Y639	P611-E625 HydrophobicContact CG-CG 4.3Å; C623-E625 PolarHBondContact O-N 3.07Å; E625-C627 HydrophobicContact CB-CB 4.44Å; E625-C627 PolarHBondContact O-N 3.08Å; E625-Y639 WeakPolarHBondContact OE2-CE1 3.41Å; E625-Y639 PolarHBondContact OE2-OH 3.21Å
626	N	77.4	Confident	75.2	Confident	94 Å²	94	81.9 Å²	81.9	50%	0.503	43%	0.429	S	S	.	.			trans	48.6	28.3	-176.5	-69.9	-82.8	0	0	0	113.6	C623 S624 S628 V629 L630	C623-N626 WeakPolarHBondContact O-CA 3.41Å; C623-N626 PolarHBondContact O-N 3.32Å; S624-N626 PolarHBondContact O-N 3.07Å; S624-N626 PolarHBondContact O-ND2 2.91Å; N626-S628 PolarHBondContact O-N 3.1Å; N626-S628 VanDerWaalsContact O-N 3.11Å; N626-V629 PolarHBondContact O-N 3.33Å; N626-L630 PolarHBondContact O-N 3.11Å
627	C	80.3	Confident	74.3	Confident	4 Å²	4	87 Å²	87	3%	0.027	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.2	-167.3	67.8	0	0	0	0	114.1	F512 C610 E625 Y635	F512-C627 HydrophobicContact CB-CB 4.03Å; C610-C627 HydrophobicContact CB-CB 4.32Å; E625-C627 HydrophobicContact CB-CB 4.44Å; E625-C627 PolarHBondContact O-N 3.08Å; C627-Y635 HydrophobicContact CB-CD2 3.95Å; C627-Y635 HydrophobicContact CB-CE2 3.38Å
628	S	70.9	Confident	73.3	Confident	82 Å²	82	86.2 Å²	86.2	57%	0.573	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-20.3	173.5	49.3	0	0	0	0	113.9	N626	N626-S628 PolarHBondContact O-N 3.1Å; N626-S628 VanDerWaalsContact O-N 3.11Å
629	V	70.4	Confident	72.2	Confident	113 Å²	113	87.1 Å²	87.1	69%	0.685	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-22.3	-180	-170.4	0	0	0	0	111.4	N626	N626-V629 PolarHBondContact O-N 3.33Å
630	L	71	Confident	71.2	Confident	51 Å²	51	86.6 Å²	86.6	27%	0.267	45%	0.447	S	S	.	.	S	Bend	trans	-86.5	126.7	179.7	-68.2	172.1	0	0	0	111.2	N626 K634 Y635 Y639	N626-L630 PolarHBondContact O-N 3.11Å; L630-K634 HydrophobicContact CD2-CB 4.42Å; L630-Y635 HydrophobicContact CB-CD2 4Å; L630-Y635 HydrophobicContact CD1-CD2 3.69Å; L630-Y635 HydrophobicContact CD1-CE2 4.12Å; L630-Y635 HydrophobicContact CG-CD2 4.5Å; L630-Y639 HydrophobicContact CD1-CE2 4.48Å
631	T	71.3	Confident	70.8	Confident	85 Å²	85	85.7 Å²	85.7	52%	0.521	44%	0.438	S	S	.	.			trans	-62.7	149.1	172.9	66.3	0	0	0	0	110.9	T633 K634 Y635	T631-T633 PolarHBondContact O-N 3.49Å; T631-K634 CarbonylContact O-C 3.59Å; T631-K634 WeakPolarHBondContact O-CA 3.42Å; T631-K634 WeakPolarHBondContact O-CB 3.19Å; T631-K634 PolarHBondContact O-N 2.86Å; T631-Y635 PolarHBondContact O-N 2.93Å
632	K	68.3	Low	70	Confident	119 Å²	119	89.4 Å²	89.4	52%	0.517	45%	0.448	S	S	.	.	H	α-helix	trans	-45.2	-45.1	-179.1	-179.4	163.4	-174.1	170.6	0	113.1	F512 Y635 T636	F512-K632 HydrophobicContact CE2-CB 4.07Å; F512-K632 HydrophobicContact CE2-CD 4.3Å; F512-K632 HydrophobicContact CE2-CG 3.82Å; F512-K632 HydrophobicContact CZ-CG 3.96Å; K632-Y635 PolarHBondContact O-N 2.77Å; K632-T636 PolarHBondContact O-N 3.21Å; K632-T636 VanDerWaalsContact O-N 3.08Å; K632-T636 PolarHBondContact O-OG1 3.19Å
633	T	68.7	Low	68.9	Low	122 Å²	122	89 Å²	89	75%	0.748	45%	0.447	S	S	*	.	H	α-helix	trans	-65.9	-35.9	178.5	-37.7	0	0	0	0	113.2	T631 H637	T631-T633 PolarHBondContact O-N 3.49Å; T633-H637 WeakPolarHBondContact O-CB 3.25Å; T633-H637 PolarHBondContact O-N 3.01Å
634	K	67.4	Low	66.8	Low	122 Å²	122	96.2 Å²	96.2	53%	0.53	49%	0.485	S	S	.	.	H	α-helix	trans	-72.1	-45.2	172.7	-74.3	-175.9	175.9	-177	0	111.1	L630 T631 T636 H637 Y638	L630-K634 HydrophobicContact CD2-CB 4.42Å; T631-K634 CarbonylContact O-C 3.59Å; T631-K634 WeakPolarHBondContact O-CA 3.42Å; T631-K634 WeakPolarHBondContact O-CB 3.19Å; T631-K634 PolarHBondContact O-N 2.86Å; K634-T636 PolarHBondContact O-N 2.93Å; K634-H637 WeakPolarHBondContact O-CB 3.38Å; K634-H637 PolarHBondContact O-N 2.86Å; K634-Y638 WeakPolarHBondContact O-CD2 3.47Å; K634-Y638 PolarHBondContact O-N 3.29Å
635	Y	72.7	Confident	64.8	Low	0 Å²	0	102.1 Å²	102.1	0%	0	50%	0.501	C	S	.	.	H	α-helix	trans	-60.3	-49.7	-177.4	-158.1	-90.7	0	0	0	111.8	F512 P611 C627 L630 T631 K632 H637 Y638 Y639	F512-Y635 HydrophobicContact CB-CD1 4.49Å; F512-Y635 AromaticContact CD1-CD1 3.21Å; F512-Y635 HydrophobicContact CD1-CD1 3.21Å; F512-Y635 AromaticContact CD1-CE1 3.65Å; F512-Y635 HydrophobicContact CD1-CE1 3.65Å; F512-Y635 AromaticContact CD1-CG 3.9Å; F512-Y635 HydrophobicContact CD1-CG 3.9Å; F512-Y635 AromaticContact CE1-CD1 3.48Å; F512-Y635 HydrophobicContact CE1-CD1 3.48Å; F512-Y635 VanDerWaalsContact CE1-CD1 3.48Å; F512-Y635 HydrophobicContact CE1-CE1 4.24Å; F512-Y635 HydrophobicContact CE1-CG 4.19Å; F512-Y635 AromaticContact CG-CD1 3.97Å; F512-Y635 HydrophobicContact CG-CD1 3.97Å; F512-Y635 HydrophobicContact CG-CE1 4.43Å; F512-Y635 HydrophobicContact CG-CG 4.24Å; F512-Y635 HydrophobicContact CZ-CD1 4.42Å; P611-Y635 WeakPolarHBondContact CD-OH 3.5Å; C627-Y635 HydrophobicContact CB-CD2 3.95Å; C627-Y635 HydrophobicContact CB-CE2 3.38Å; L630-Y635 HydrophobicContact CB-CD2 4Å; L630-Y635 HydrophobicContact CD1-CD2 3.69Å; L630-Y635 HydrophobicContact CD1-CE2 4.12Å; L630-Y635 HydrophobicContact CG-CD2 4.5Å; T631-Y635 PolarHBondContact O-N 2.93Å; K632-Y635 PolarHBondContact O-N 2.77Å; Y635-H637 PolarHBondContact O-N 2.98Å; Y635-Y638 PolarHBondContact O-N 3.36Å; Y635-Y639 HydrophobicContact CD1-CD2 4.21Å; Y635-Y639 AromaticContact CD2-CD2 3.96Å; Y635-Y639 HydrophobicContact CD2-CD2 3.96Å; Y635-Y639 HydrophobicContact CD2-CE2 4.13Å; Y635-Y639 AromaticContact CE1-CD2 3.87Å; Y635-Y639 HydrophobicContact CE1-CD2 3.87Å; Y635-Y639 AromaticContact CE1-CG 3.94Å; Y635-Y639 HydrophobicContact CE1-CG 3.94Å; Y635-Y639 AromaticContact CE2-CD2 3.56Å; Y635-Y639 HydrophobicContact CE2-CD2 3.56Å; Y635-Y639 AromaticContact CE2-CE2 3.51Å; Y635-Y639 HydrophobicContact CE2-CE2 3.51Å; Y635-Y639 HydrophobicContact CE2-CG 4.32Å; Y635-Y639 HydrophobicContact CG-CD2 4.26Å; Y635-Y639 AromaticContact CZ-CD2 3.5Å; Y635-Y639 AromaticContact CZ-CE2 3.77Å; Y635-Y639 AromaticContact CZ-CG 3.8Å; Y635-Y639 PolarHBondContact O-N 3.16Å
636	T	69.1	Low	63	Low	48 Å²	48	111.6 Å²	111.6	29%	0.294	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-21.1	175.5	-53.9	0	0	0	0	113.2	K632 K634 G640	K632-T636 PolarHBondContact O-N 3.21Å; K632-T636 VanDerWaalsContact O-N 3.08Å; K632-T636 PolarHBondContact O-OG1 3.19Å; K634-T636 PolarHBondContact O-N 2.93Å; T636-G640 VanDerWaalsContact O-CA 3.25Å; T636-G640 WeakPolarHBondContact O-CA 3.27Å; T636-G640 PolarHBondContact O-N 2.97Å; T636-G640 VanDerWaalsContact O-N 3.1Å
637	H	69.6	Low	61	Low	145 Å²	145	115.1 Å²	115.1	67%	0.671	55%	0.552	S	S	*	*	H	α-helix	trans	-77.3	-36.7	173.2	177.8	-84.1	0	0	0	113.2	T633 K634 Y635	T633-H637 WeakPolarHBondContact O-CB 3.25Å; T633-H637 PolarHBondContact O-N 3.01Å; K634-H637 WeakPolarHBondContact O-CB 3.38Å; K634-H637 PolarHBondContact O-N 2.86Å; Y635-H637 PolarHBondContact O-N 2.98Å
638	Y	65.3	Low	58.7	Low	170 Å²	170	117.8 Å²	117.8	67%	0.667	58%	0.58	S	S	*	*	H	α-helix	trans	-83.2	-39.9	178.8	-79.3	-80.3	0	0	0	113.2	K634 Y635	K634-Y638 WeakPolarHBondContact O-CD2 3.47Å; K634-Y638 PolarHBondContact O-N 3.29Å; Y635-Y638 PolarHBondContact O-N 3.36Å
639	Y	64.3	Low	56.8	Low	87 Å²	87	125.7 Å²	125.7	34%	0.341	60%	0.597	S	S	.	*	H	α-helix	trans	-111.5	-9.6	-171.5	-66.4	-94.1	0	0	0	114.5	P611 E625 L630 Y635	P611-Y639 HydrophobicContact CG-CD1 4.5Å; P611-Y639 HydrophobicContact CG-CE1 4.49Å; E625-Y639 WeakPolarHBondContact OE2-CE1 3.41Å; E625-Y639 PolarHBondContact OE2-OH 3.21Å; L630-Y639 HydrophobicContact CD1-CE2 4.48Å; Y635-Y639 HydrophobicContact CD1-CD2 4.21Å; Y635-Y639 AromaticContact CD2-CD2 3.96Å; Y635-Y639 HydrophobicContact CD2-CD2 3.96Å; Y635-Y639 HydrophobicContact CD2-CE2 4.13Å; Y635-Y639 AromaticContact CE1-CD2 3.87Å; Y635-Y639 HydrophobicContact CE1-CD2 3.87Å; Y635-Y639 AromaticContact CE1-CG 3.94Å; Y635-Y639 HydrophobicContact CE1-CG 3.94Å; Y635-Y639 AromaticContact CE2-CD2 3.56Å; Y635-Y639 HydrophobicContact CE2-CD2 3.56Å; Y635-Y639 AromaticContact CE2-CE2 3.51Å; Y635-Y639 HydrophobicContact CE2-CE2 3.51Å; Y635-Y639 HydrophobicContact CE2-CG 4.32Å; Y635-Y639 HydrophobicContact CG-CD2 4.26Å; Y635-Y639 AromaticContact CZ-CD2 3.5Å; Y635-Y639 AromaticContact CZ-CE2 3.77Å; Y635-Y639 AromaticContact CZ-CG 3.8Å; Y635-Y639 PolarHBondContact O-N 3.16Å
640	G	61	Low	55	Low	14 Å²	14	125.6 Å²	125.6	14%	0.144	60%	0.599	C	S	.	*	S	Bend	trans	-79.4	151.3	179.3	0	0	0	0	0	113.5	T636 K642	T636-G640 VanDerWaalsContact O-CA 3.25Å; T636-G640 WeakPolarHBondContact O-CA 3.27Å; T636-G640 PolarHBondContact O-N 2.97Å; T636-G640 VanDerWaalsContact O-N 3.1Å; G640-K642 PolarHBondContact O-N 3.41Å
641	K	60	Low	53	Low	103 Å²	103	129.1 Å²	129.1	45%	0.448	63%	0.625	S	S	.	*			trans	-52.7	112.6	177.7	-61.2	175.9	-172.4	177.5	0	110.1	E558 K606 K643	E558-K641 IonicContact OE2-NZ 3.61Å; E558-K641 PolarHBondContact OE2-NZ 2.82Å; K606-K641 PolarHBondContact O-NZ 2.99Å; K641-K643 PolarHBondContact O-N 3.42Å
642	K	51.3	Low	50.9	Low	200 Å²	200	129 Å²	129	87%	0.87	64%	0.64	S	S	*	*			trans	-59.9	95.2	179.9	-80.2	-177.7	-178.5	170	0	111	G640 N644	G640-K642 PolarHBondContact O-N 3.41Å; K642-N644 PolarHBondContact O-N 3.22Å; K642-N644 VanDerWaalsContact O-N 3.08Å
643	K	49.2	Very low	49.1	Very low	179 Å²	179	126.3 Å²	126.3	78%	0.778	65%	0.647	S	S	*	*			trans	-66.7	108.8	172.6	-74.3	173.2	-178.7	162.7	0	109.2	K641 K645	K641-K643 PolarHBondContact O-N 3.42Å; K643-K645 PolarHBondContact O-N 3.07Å
644	N	37.3	Very low	47.2	Very low	158 Å²	158	129.7 Å²	129.7	85%	0.845	65%	0.654	S	S	*	*			trans	-49.2	129.9	172.5	-80.7	-23.2	0	0	0	109.7	K642 R646	K642-N644 PolarHBondContact O-N 3.22Å; K642-N644 VanDerWaalsContact O-N 3.08Å; N644-R646 PolarHBondContact O-N 2.9Å
645	K	38.5	Very low	45.5	Very low	196 Å²	196	129.1 Å²	129.1	85%	0.852	67%	0.665	S	S	*	*			trans	-57.4	138.4	-175.2	-71.9	179.6	178.4	175.5	0	109.5	K643 I647	K643-K645 PolarHBondContact O-N 3.07Å; K645-I647 PolarHBondContact O-N 3.18Å
646	R	39.8	Very low	43.5	Very low	252 Å²	252	137.1 Å²	137.1	95%	0.951	71%	0.708	S	S	*	*			trans	-58.6	98.9	176	-69.7	178.8	177.8	169.3	-1.7	110.1	N644	N644-R646 PolarHBondContact O-N 2.9Å
647	I	35.4	Very low	41.8	Very low	168 Å²	168	142.6 Å²	142.6	86%	0.862	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-64.9	135.2	158.4	-64.6	171.6	0	0	0	106.4	K645	K645-I647 PolarHBondContact O-N 3.18Å
648	G	31.9	Very low	39.8	Very low	60 Å²	60	140.2 Å²	140.2	62%	0.619	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-65.4	152.2	-170.7	0	0	0	0	0	113.1	P650	G648-P650 WeakPolarHBondContact O-CD 3.4Å
649	R	31.3	Very low	38	Very low	247 Å²	247	137.4 Å²	137.4	93%	0.932	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-53.6	126.1	168.8	-84	-175.8	172.1	179.6	-3.2	110.2
650	P	31.6	Very low	36.2	Very low	111 Å²	111	138.1 Å²	138.1	72%	0.721	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.8	144.4	147.8	-14.6	30.2	0	0	0	108.8	G648	G648-P650 WeakPolarHBondContact O-CD 3.4Å
651	P	29.6	Very low	34.9	Very low	126 Å²	126	144.8 Å²	144.8	82%	0.818	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-61.4	143.8	166.7	-18.5	32.1	0	0	0	110.3
652	G	27.9	Very low	33.5	Very low	81 Å²	81	149.8 Å²	149.8	84%	0.835	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.2	170.9	171.5	0	0	0	0	0	112.2
653	G	30.2	Very low	32.4	Very low	64 Å²	64	150 Å²	150	66%	0.66	82%	0.822	S	S	*	*			cis	157.1	168.9	3.2	0	0	0	0	0	109.5
654	H	28.1	Very low	31.4	Very low	192 Å²	192	145.6 Å²	145.6	89%	0.889	82%	0.819	S	S	*	*			trans	-130.8	107.1	177.9	-79.4	-79.8	0	0	0	111.7
655	S	31.5	Very low	31.1	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	82%	0.82	S	S	*	*			trans	-95.5	129.8	159.8	44.6	0	0	0	0	108.1	L657	S655-L657 PolarHBondContact O-N 2.9Å
656	N	30.8	Very low	31.1	Very low	167 Å²	167	144.5 Å²	144.5	89%	0.893	82%	0.822	S	S	*	*			trans	-88.6	103.3	169.4	-79.1	-15.3	0	0	0	108.7
657	L	34.2	Very low	30.6	Very low	164 Å²	164	144.4 Å²	144.4	86%	0.859	82%	0.822	S	S	*	*			trans	-133.3	128.5	164.5	-163.5	81.9	0	0	0	108.3	S655	S655-L657 PolarHBondContact O-N 2.9Å
658	A	27.6	Very low	30.4	Very low	95 Å²	95	147.7 Å²	147.7	79%	0.785	82%	0.823	S	S	*	*			trans	-91.9	143.4	167.3	0	0	0	0	0	109.1
659	C	26.1	Very low	30.8	Very low	111 Å²	111	154.5 Å²	154.5	75%	0.75	84%	0.836	S	S	*	*			cis	-160.9	136.5	-13.8	176.9	0	0	0	0	108.8
660	A	27	Very low	30.8	Very low	102 Å²	102	154.9 Å²	154.9	84%	0.843	84%	0.837	S	S	*	*			trans	-157.2	145	160.6	0	0	0	0	0	110.6
661	L	33	Very low	30.9	Very low	154 Å²	154	160.2 Å²	160.2	81%	0.806	84%	0.843	S	S	*	*			trans	-116	131.9	-171.2	-69.9	163.5	0	0	0	112.3
662	K	30.8	Very low	31	Very low	207 Å²	207	164 Å²	164	90%	0.9	85%	0.847	S	S	*	*				-179.2	161.2	114.2	-95	156.4	-173.5	175.6	0	113.2
663	K	28.9	Very low	31.1	Very low	205 Å²	205	166.5 Å²	166.5	89%	0.891	84%	0.841	S	S	*	*			trans	-98	175.8	174.9	-52.9	171.7	-178.8	169.5	0	107.9
664	A	28.8	Very low	31.1	Very low	87 Å²	87	169.5 Å²	169.5	72%	0.719	85%	0.846	S	S	*	*			cis	-165	177	18.8	0	0	0	0	0	114.2
665	S	30.1	Very low	31.2	Very low	122 Å²	122	169.1 Å²	169.1	85%	0.853	84%	0.843	S	S	*	*			trans	109.8	148.9	144.3	84.8	0	0	0	0	118.8
666	K	38.1	Very low	31.2	Very low	208 Å²	208	167.9 Å²	167.9	90%	0.904	83%	0.83	S	S	*	*			trans	-134.1	141.5	-175.5	-64.8	173.9	177.5	173.3	0	109.2
667	R	29.7	Very low	31.2	Very low	251 Å²	251	168 Å²	168	95%	0.947	83%	0.825	S	S	*	*			trans	-149.4	79.8	162.4	-155.3	163.1	177	150.8	-3.5	117
668	R	31.1	Very low	30.9	Very low	236 Å²	236	169.3 Å²	169.3	89%	0.891	82%	0.824	S	S	*	*			trans	41.1	106.6	133.4	-156.5	176.3	-165.6	169	2.8	120.7
669	K	39.8	Very low	31	Very low	204 Å²	204	174.3 Å²	174.3	89%	0.887	83%	0.828	S	S	*	*			trans	24.1	134.8	142.4	-68.7	-177.6	174.5	179.9	0	120.8
670	R	31.3	Very low	31.1	Very low	254 Å²	254	177.1 Å²	177.1	96%	0.958	83%	0.827	S	S	*	*				-152.8	160.7	124.1	-142.6	171.3	177.8	176.7	-1.8	113.8
671	R	35.4	Very low	31.2	Very low	223 Å²	223	182.9 Å²	182.9	84%	0.842	83%	0.827	S	S	*	*			trans	-88.2	165.1	176.2	-64.2	170	163.7	162.2	-9.8	112
672	K	30.5	Very low	30.9	Very low	206 Å²	206	180.5 Å²	180.5	90%	0.896	82%	0.823	S	S	*	*				-151.5	159.3	120.7	-110.9	177.3	-179.7	-175.6	0	111.7
673	N	30.3	Very low	30.9	Very low	133 Å²	133	176 Å²	176	71%	0.711	82%	0.818	S	S	*	*			trans	-104.4	-175.1	172.5	-47.7	-2.9	0	0	0	108.4
674	V	29.7	Very low	30.9	Very low	127 Å²	127	171.1 Å²	171.1	77%	0.77	82%	0.816	S	S	*	*				158.9	115.7	123.6	158	0	0	0	0	113.8
675	F	30.1	Very low	30.9	Very low	185 Å²	185	171.6 Å²	171.6	81%	0.811	81%	0.814	S	S	*	*			trans	65.4	156.6	140.6	-85.1	-134.4	0	0	0	122
676	V	31.8	Very low	30.9	Very low	85 Å²	85	172.1 Å²	172.1	52%	0.515	81%	0.812	S	S	.	*			cis	-167.2	156.3	-21.2	77.1	0	0	0	0	114
677	H	30.8	Very low	30.4	Very low	169 Å²	169	168.7 Å²	168.7	78%	0.782	80%	0.803	S	S	*	*			trans	61.7	167.9	159.8	-64.2	-39.1	0	0	0	117.1
678	K	29.1	Very low	30.4	Very low	192 Å²	192	164.2 Å²	164.2	84%	0.835	80%	0.798	S	S	*	*			cis	-149.1	121.1	12.6	-155.5	170.6	-175.8	176.4	0	113.8
679	K	28.2	Very low	30.3	Very low	200 Å²	200	159 Å²	159	87%	0.87	79%	0.792	S	S	*	*			trans	-0.9	134.6	143.5	178.9	-177.7	-171.9	174.8	0	118
680	K	28.3	Very low	30.4	Very low	169 Å²	169	155 Å²	155	74%	0.735	79%	0.787	S	S	*	*				174.2	123.1	114.3	-171.9	173.4	178.9	-169.9	0	116.7
681	R	28.5	Very low	30.2	Very low	223 Å²	223	147.7 Å²	147.7	84%	0.842	78%	0.782	S	S	*	*			trans	58.1	131.2	149.1	-70.8	-177.3	-179.5	173	-2.2	124.1
682	S	27.6	Very low	29.8	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	78%	0.78	S	S	*	*			trans	-68.5	161.3	145.8	52.8	0	0	0	0	115
683	S	30.9	Very low	30	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	78%	0.777	S	S	*	*				169.3	132	115.9	56.1	0	0	0	0	115.9
684	A	28.2	Very low	30.7	Very low	103 Å²	103	135.3 Å²	135.3	85%	0.851	78%	0.775	S	S	*	*			trans	61.6	170.8	153.3	0	0	0	0	0	117.7
685	S	28.6	Very low	30.5	Very low	97 Å²	97	138.1 Å²	138.1	68%	0.678	78%	0.78	S	S	*	*			cis	-161.8	149.3	11.1	53.8	0	0	0	0	114.2
686	V	32	Very low	30.2	Very low	134 Å²	134	132.9 Å²	132.9	81%	0.812	78%	0.778	S	S	*	*			trans	57.7	155.8	150.5	-58.1	0	0	0	0	123
687	D	26.6	Very low	30	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	80%	0.797	S	S	*	*			trans	-70.2	158.5	-178.6	-42.7	-95.2	0	0	0	114.7
688	N	29	Very low	29.7	Very low	157 Å²	157	130.9 Å²	130.9	84%	0.84	80%	0.799	S	S	*	*				177.6	135.3	98.4	-92.4	-76.1	0	0	0	112
689	T	30.6	Very low	29.8	Very low	125 Å²	125	124.6 Å²	124.6	77%	0.767	79%	0.79	S	S	*	*			trans	-88.8	153.4	155	-7.2	0	0	0	0	108.3
690	P	40.7	Very low	29.8	Very low	120 Å²	120	123.8 Å²	123.8	78%	0.779	79%	0.789	S	S	*	*				-151.4	168.7	77.3	40	-21.4	0	0	0	117.2
691	A	28.4	Very low	29.8	Very low	102 Å²	102	122.1 Å²	122.1	84%	0.843	79%	0.788	S	S	*	*			trans	51.6	120	149.5	0	0	0	0	0	120.8
692	G	27	Very low	29.9	Very low	79 Å²	79	119.6 Å²	119.6	81%	0.814	79%	0.786	S	S	*	*			trans	171.1	88.1	167.2	0	0	0	0	0	114.6
693	S	34.2	Very low	29.9	Very low	119 Å²	119	122.4 Å²	122.4	83%	0.832	79%	0.793	S	S	*	*			trans	-106	165.1	159.1	-49.4	0	0	0	0	108.1
694	P	44.2	Very low	30	Very low	103 Å²	103	123.8 Å²	123.8	67%	0.669	79%	0.791	S	S	*	*			cis	-140.6	-162.8	8.2	43.8	-24.6	0	0	0	115
695	Q	25.9	Very low	30.7	Very low	187 Å²	187	124.2 Å²	124.2	87%	0.874	79%	0.786	S	S	*	*			trans	73.4	154.9	153.3	-74.3	171.7	-29.1	0	0	121.2
696	G	24.3	Very low	31	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	79%	0.789	S	S	*	*			trans	85.9	117.7	175.8	0	0	0	0	0	114.1
697	S	27.8	Very low	31.1	Very low	132 Å²	132	128.2 Å²	128.2	92%	0.923	79%	0.789	S	S	*	*			cis	84.5	125.4	15.9	-156.7	0	0	0	0	116.1
698	G	24.3	Very low	31.3	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	79%	0.789	S	S	*	*			trans	82.6	149.4	-169.3	0	0	0	0	0	112.3
699	G	30.8	Very low	31.5	Very low	61 Å²	61	125.4 Å²	125.4	63%	0.629	79%	0.791	S	S	*	*			cis	142.4	153.3	3.1	0	0	0	0	0	109.7
700	E	28.7	Very low	31.5	Very low	182 Å²	182	126.5 Å²	126.5	85%	0.85	79%	0.792	S	S	*	*			trans	66	153.6	169.4	-56.4	148	-137.1	0	0	116
701	D	28.8	Very low	31.1	Very low	135 Å²	135	126.6 Å²	126.6	72%	0.722	79%	0.786	S	S	*	*			cis	-156.5	159.4	-34	-102.9	-19.4	0	0	0	111.2
702	E	29.3	Very low	31.3	Very low	169 Å²	169	126.5 Å²	126.5	79%	0.79	78%	0.779	S	S	*	*			trans	33.4	166	146	-55.4	-160.7	127.9	0	0	125.8
703	D	27.8	Very low	31.4	Very low	165 Å²	165	129.7 Å²	129.7	88%	0.882	78%	0.777	S	S	*	*			trans	87.4	140.7	159	-75.1	-23.3	0	0	0	123.8
704	D	32.5	Very low	31.2	Very low	140 Å²	140	129.5 Å²	129.5	75%	0.749	78%	0.775	S	S	*	*			trans	-100.6	176.8	-170	-149.4	-12.6	0	0	0	110.7
705	P	44.1	Very low	30.5	Very low	112 Å²	112	133.3 Å²	133.3	73%	0.727	78%	0.784	S	S	*	*				-151.3	147.1	82.3	35.5	-14.9	0	0	0	118
706	D	34	Very low	30.5	Very low	140 Å²	140	128.1 Å²	128.1	75%	0.749	78%	0.781	S	S	*	*				41.8	148.2	110.4	-112	-10.1	0	0	0	120.5
707	E	35.2	Very low	30.8	Very low	174 Å²	174	129.6 Å²	129.6	81%	0.813	78%	0.78	S	S	*	*			cis	-130.7	167	4.1	-59.6	172.1	127.7	0	0	109.1
708	G	30.3	Very low	30.7	Very low	71 Å²	71	130.1 Å²	130.1	73%	0.732	78%	0.777	S	S	*	*				91.1	143.3	87.1	0	0	0	0	0	114
709	D	33.8	Very low	30.9	Very low	163 Å²	163	130.6 Å²	130.6	87%	0.872	77%	0.768	S	S	*	*			cis	-168.8	171.3	-4.4	-139.8	-5.7	0	0	0	112
710	D	30.5	Very low	30.7	Very low	149 Å²	149	135.3 Å²	135.3	80%	0.797	77%	0.774	S	S	*	*			trans	63.2	142	158.1	-148	50.9	0	0	0	118.4
711	D	31.3	Very low	30.7	Very low	121 Å²	121	133.7 Å²	133.7	65%	0.647	77%	0.766	S	S	*	*			cis	-150.5	-158	-9.6	-161.6	20.2	0	0	0	106.3
712	S	32.1	Very low	30.6	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	77%	0.767	S	S	*	*			cis	-158.2	177.3	10.8	-155.5	0	0	0	0	115.1
713	L	29.7	Very low	30.4	Very low	146 Å²	146	132.3 Å²	132.3	76%	0.764	76%	0.759	S	S	*	*			trans	-94.4	158.7	-161.9	-62.3	164.7	0	0	0	116.1
714	S	29.5	Very low	30.5	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	75%	0.751	S	S	*	*				135.7	118.5	118.9	68.7	0	0	0	0	118.5
715	E	29.8	Very low	30.2	Very low	184 Å²	184	130.9 Å²	130.9	86%	0.86	75%	0.746	S	S	*	*			trans	34.2	151.3	135.8	-73.3	-56.7	145.1	0	0	125.5
716	G	25.6	Very low	29.3	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	74%	0.743	S	S	*	*			trans	166.2	75.6	170.1	0	0	0	0	0	116.1
717	S	30.1	Very low	28.8	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	74%	0.74	S	S	*	*			trans	-106.7	155.3	-179.6	-176.7	0	0	0	0	114.1
718	T	25.7	Very low	28.3	Very low	142 Å²	142	132.4 Å²	132.4	87%	0.871	74%	0.739	S	S	*	*			trans	178.8	148.4	152.7	26.1	0	0	0	0	108.7
719	S	28.5	Very low	28.1	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	74%	0.735	S	S	*	*			cis	-152.8	147.3	2.7	55.2	0	0	0	0	111.6
720	E	28.4	Very low	27.8	Very low	160 Å²	160	133.3 Å²	133.3	75%	0.748	73%	0.729	S	S	*	*				46.8	144.3	128.8	-55.7	-179.5	138.4	0	0	121.4
721	Q	28.2	Very low	27.5	Very low	149 Å²	149	133.7 Å²	133.7	70%	0.696	73%	0.728	S	S	*	*			cis	-163.2	172.5	-3.1	-116.4	169.5	38.7	0	0	111.2
722	Q	25.8	Very low	27.3	Very low	156 Å²	156	130.2 Å²	130.2	73%	0.729	71%	0.713	S	S	*	*			trans	-32.5	171.7	155.3	-80.1	162.2	-85.3	0	0	118.7
723	D	26.6	Very low	27.1	Very low	119 Å²	119	135 Å²	135	64%	0.636	73%	0.725	S	S	*	*			cis	-157.9	172.2	9.6	-127.8	-31	0	0	0	116.3
724	E	28.1	Very low	27.1	Very low	152 Å²	152	136.3 Å²	136.3	71%	0.71	72%	0.724	S	S	*	*			trans	38.8	142.2	145.8	-89.1	-169.3	158.2	0	0	128.5
725	L	27.8	Very low	26.9	Very low	123 Å²	123	140.6 Å²	140.6	64%	0.644	73%	0.728	S	S	*	*			trans	80.3	135.3	138.6	-71	165.5	0	0	0	125.2
726	Q	24.7	Very low	26.7	Very low	140 Å²	140	136.7 Å²	136.7	65%	0.654	72%	0.721	S	S	*	*			trans	60.8	156.8	144.4	-73.9	173.2	-69.3	0	0	119.4
727	E	23.6	Very low	26.7	Very low	148 Å²	148	138.8 Å²	138.8	69%	0.692	72%	0.722	S	S	*	*			cis	-153.9	-170.8	-14	-128.8	158.6	-156.2	0	0	110.7
728	E	23.7	Very low	26.4	Very low	170 Å²	170	139.4 Å²	139.4	79%	0.794	73%	0.727	S	S	*	*			trans	9.6	134.3	163.1	-59.4	-165.1	150.5	0	0	121.5
729	S	27.2	Very low	26.5	Very low	94 Å²	94	138.3 Å²	138.3	66%	0.657	73%	0.725	S	S	*	*			cis	104.7	172.3	40.5	96.2	0	0	0	0	114.2
730	E	28	Very low	26.4	Very low	159 Å²	159	139.3 Å²	139.3	74%	0.743	73%	0.732	S	S	*	*			trans	65.1	152.5	-168.6	-50.7	-147.2	119.5	0	0	115.4
731	M	24	Very low	27.6	Very low	156 Å²	156	137.3 Å²	137.3	77%	0.768	73%	0.733	S	S	*	*			cis	-136.7	135.2	11.4	-177.4	72.4	161.7	0	0	108.4
732	S	26.7	Very low	27.7	Very low	48 Å²	48	136.5 Å²	136.5	34%	0.336	74%	0.738	S	S	.	*			cis	82.8	65.8	30.9	-179.9	0	0	0	0	116.3	K734	S732-K734 WeakPolarHBondContact OG-CE 3.48Å
733	E	28.1	Very low	27.8	Very low	202 Å²	202	137.9 Å²	137.9	94%	0.944	74%	0.744	S	S	*	*			trans	-73.8	139	155.7	-66.2	-161.7	130.2	0	0	111.3
734	K	28.3	Very low	27.9	Very low	173 Å²	173	138 Å²	138	75%	0.752	76%	0.755	S	S	*	*			trans	-137.6	132.8	-179	-75.2	172.4	179.1	154.7	0	111.7	S732	S732-K734 WeakPolarHBondContact OG-CE 3.48Å
735	K	26.1	Very low	27.9	Very low	204 Å²	204	139 Å²	139	89%	0.887	76%	0.759	S	S	*	*			trans	-151	106.9	158.7	-115.4	173.5	-176.6	175.1	0	113.6
736	S	26.4	Very low	27.9	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	77%	0.768	S	S	*	*			trans	26	102.3	145.9	57.5	0	0	0	0	121.8
737	C	24.5	Very low	28	Very low	123 Å²	123	138.5 Å²	138.5	83%	0.831	77%	0.768	S	S	*	*				42.6	153	117	-59.4	0	0	0	0	124.8
738	S	25.1	Very low	28.1	Very low	118 Å²	118	137.8 Å²	137.8	83%	0.825	77%	0.773	S	S	*	*			trans	77	141.7	163.4	71.2	0	0	0	0	118
739	S	26.2	Very low	28.1	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	77%	0.77	S	S	*	*			cis	-156.8	173.2	-2.9	33.7	0	0	0	0	113.3
740	S	28	Very low	28.1	Very low	112 Å²	112	138 Å²	138	78%	0.783	78%	0.78	S	S	*	*			trans	-94.5	-155.9	-166.1	-39.7	0	0	0	0	114.4
741	P	53.5	Low	29.2	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	78%	0.78	S	S	*	*				-138	169.9	-66.7	35.5	-17.1	0	0	0	116.7
742	T	28.5	Very low	30.5	Very low	131 Å²	131	133.8 Å²	133.8	80%	0.804	78%	0.778	S	S	*	*			trans	-162.2	128.1	152.3	20.1	0	0	0	0	108.3
743	Q	29.4	Very low	30.5	Very low	185 Å²	185	137.1 Å²	137.1	86%	0.864	79%	0.792	S	S	*	*				57.1	134.4	74.7	-68	-171.6	-8.2	0	0	113.9
744	S	28.1	Very low	30.6	Very low	123 Å²	123	136.3 Å²	136.3	86%	0.86	78%	0.78	S	S	*	*			cis	-138.8	-176.2	45.4	55.1	0	0	0	0	116.9
745	E	29	Very low	30.5	Very low	172 Å²	172	135.9 Å²	135.9	80%	0.804	78%	0.781	S	S	*	*			trans	-122.4	170.4	-167.5	-50.3	177.4	128	0	0	114.6
746	I	27.1	Very low	30.5	Very low	161 Å²	161	137.5 Å²	137.5	83%	0.826	78%	0.781	S	S	*	*			trans	-179.8	107.3	142.5	-91.3	149.9	0	0	0	105.9
747	S	27.6	Very low	30.5	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	79%	0.791	S	S	*	*				59.2	127.4	79.8	-66.7	0	0	0	0	114.1
748	T	24.1	Very low	30.5	Very low	132 Å²	132	146.8 Å²	146.8	81%	0.81	79%	0.788	S	S	*	*			cis	-168.3	168.7	7	9.2	0	0	0	0	107.9
749	S	24.6	Very low	30.4	Very low	103 Å²	103	150.8 Å²	150.8	72%	0.72	79%	0.785	S	S	*	*			cis	-162.9	-168.7	1.2	47.9	0	0	0	0	110.8
750	L	27	Very low	30.3	Very low	166 Å²	166	151.3 Å²	151.3	87%	0.869	77%	0.774	S	S	*	*			trans	-135.8	-158.9	175.6	-65.6	170.1	0	0	0	108.1
751	P	50.5	Low	30.3	Very low	115 Å²	115	153.6 Å²	153.6	75%	0.747	78%	0.777	S	S	*	*			cis	-134.9	-145.8	-9.2	46.3	-26.4	0	0	0	111.1
752	P	51.9	Low	28.9	Very low	111 Å²	111	159.3 Å²	159.3	72%	0.721	78%	0.783	S	S	*	*			cis	-125.5	-165.2	-20.3	43.5	-25.6	0	0	0	112
753	D	27.3	Very low	28.7	Very low	118 Å²	118	159.3 Å²	159.3	63%	0.631	78%	0.783	S	S	*	*			cis	-155.8	162.5	8.2	-149.6	-0.2	0	0	0	115.5
754	R	28.7	Very low	28.6	Very low	185 Å²	185	159.5 Å²	159.5	70%	0.698	78%	0.782	S	S	*	*			trans	46.9	116.3	149.5	-82.9	161.9	-142.4	-134.7	-3	126.1
755	Q	27.1	Very low	28.4	Very low	164 Å²	164	159.3 Å²	159.3	77%	0.766	78%	0.78	S	S	*	*				87.6	103.6	117	-75	176.6	14	0	0	124.5
756	R	26.1	Very low	28.3	Very low	238 Å²	238	159.8 Å²	159.8	90%	0.898	78%	0.78	S	S	*	*				10.1	125.1	127.2	-73.9	177.4	161.8	-178	-4.5	119.7
757	R	27.1	Very low	28.3	Very low	246 Å²	246	157.5 Å²	157.5	93%	0.928	78%	0.778	S	S	*	*				177.3	160.4	117.2	-91.5	155	-167.3	-145	5.2	108.1
758	K	24.3	Very low	28.4	Very low	175 Å²	175	160 Å²	160	76%	0.761	78%	0.784	S	S	*	*			cis	156.1	113.5	-28.2	-178.5	-171.9	-176.6	-169.2	0	105.7
759	R	23.2	Very low	28.6	Very low	201 Å²	201	160.8 Å²	160.8	76%	0.758	78%	0.784	S	S	*	*			trans	77.1	143.2	158.6	-94.5	172.1	162.8	-140.9	5.8	122.4
760	E	23.1	Very low	28.8	Very low	129 Å²	129	162.8 Å²	162.8	60%	0.603	78%	0.782	S	S	*	*			trans	91.2	109.6	138.7	-79.4	159.8	-144.2	0	0	123
761	L	28.8	Very low	29.2	Very low	160 Å²	160	161.5 Å²	161.5	84%	0.838	78%	0.775	S	S	*	*				42.9	116.2	125.6	-64.6	170.7	0	0	0	119.4
762	R	23.9	Very low	28.4	Very low	239 Å²	239	164.6 Å²	164.6	90%	0.902	78%	0.777	S	S	*	*			trans	-134.6	116	140	-68.3	-167.2	174.2	-172.4	-4.6	109.6
763	T	23.3	Very low	27.5	Very low	130 Å²	130	165.1 Å²	165.1	80%	0.798	78%	0.781	S	S	*	*				68.3	126.7	90.2	-16.4	0	0	0	0	114.3
764	F	27.2	Very low	27.7	Very low	190 Å²	190	165.1 Å²	165.1	83%	0.833	79%	0.787	S	S	*	*			trans	-66.7	152.8	165.9	-77.2	-100.6	0	0	0	111.1
765	S	24.4	Very low	27.8	Very low	119 Å²	119	161.1 Å²	161.1	83%	0.832	79%	0.787	S	S	*	*			trans	-144.4	130.6	155	-166.9	0	0	0	0	108.1
766	F	27.7	Very low	28.1	Very low	182 Å²	182	159.6 Å²	159.6	80%	0.798	79%	0.792	S	S	*	*			trans	-87.1	153.9	166.2	-91.3	-100.1	0	0	0	110
767	S	25.8	Very low	28.3	Very low	113 Å²	113	157.3 Å²	157.3	79%	0.79	79%	0.788	S	S	*	*			trans	-160.1	126.2	151.2	-170.6	0	0	0	0	106.8
768	D	29.5	Very low	28.4	Very low	143 Å²	143	154.4 Å²	154.4	77%	0.765	79%	0.785	S	S	*	*			trans	-70.5	149.5	159.1	-62.3	-67.5	0	0	0	109
769	D	28	Very low	28.6	Very low	150 Å²	150	153.5 Å²	153.5	80%	0.802	79%	0.787	S	S	*	*				176.8	174.2	94.6	-161.6	9.4	0	0	0	110.7
770	E	30	Very low	28.8	Very low	145 Å²	145	154.5 Å²	154.5	68%	0.678	79%	0.791	S	S	*	*			trans	77.9	134.2	163.7	-95.1	-75.3	68.9	0	0	120.6
771	N	35.2	Very low	29.3	Very low	138 Å²	138	155.7 Å²	155.7	74%	0.738	80%	0.8	S	S	*	*			trans	-93.9	127.1	-171.8	-81.4	-90.6	0	0	0	113.3
772	K	32.9	Very low	29.4	Very low	180 Å²	180	156.6 Å²	156.6	78%	0.783	80%	0.8	S	S	*	*			trans	-167.3	141.9	144.2	-103.9	136.5	-164	150.9	0	113.6
773	P	33.8	Very low	30.1	Very low	122 Å²	122	151.6 Å²	151.6	79%	0.792	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-80.5	130.9	172.9	32	-32.6	0	0	0	111.6
774	P	31.2	Very low	31	Very low	119 Å²	119	149.5 Å²	149.5	77%	0.773	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-78.3	140.5	167.5	31.5	-32.4	0	0	0	111.2
775	S	30.4	Very low	32.3	Very low	100 Å²	100	148.4 Å²	148.4	70%	0.699	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-63.4	158.9	170.2	43.3	0	0	0	0	112.2	K777	S775-K777 PolarHBondContact O-N 3.29Å
776	P	35	Very low	34.4	Very low	132 Å²	132	152 Å²	152	86%	0.857	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.6	122.5	-177.8	24.3	-34.9	0	0	0	111.3
777	K	29.6	Very low	36.8	Very low	190 Å²	190	145.1 Å²	145.1	83%	0.826	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-82.6	137	165.6	-70.4	-178.2	177.4	177.8	0	108.9	S775 I779	S775-K777 PolarHBondContact O-N 3.29Å; K777-I779 PolarHBondContact O-N 3.44Å
778	E	29.7	Very low	39.5	Very low	186 Å²	186	146.6 Å²	146.6	87%	0.869	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-57.1	120.9	175	-60.5	171.6	126.8	0	0	110.2	R780	E778-R780 PolarHBondContact O-N 2.73Å; E778-R780 VanDerWaalsContact O-N 3.11Å
779	I	28.3	Very low	42.3	Very low	155 Å²	155	140.2 Å²	140.2	80%	0.795	72%	0.715	S	S	*	*			trans	-75.4	100.6	165.6	-61.8	176.3	0	0	0	106.3	K777 I781	K777-I779 PolarHBondContact O-N 3.44Å; I779-I781 PolarHBondContact O-N 2.74Å; I779-I781 VanDerWaalsContact O-N 3.12Å
780	R	27.6	Very low	44.9	Very low	222 Å²	222	140.9 Å²	140.9	84%	0.838	72%	0.719	S	S	*	*			trans	-58	115.3	160.5	-75.8	-177.6	171	-172.4	-4.2	107.5	E778 E782	E778-R780 PolarHBondContact O-N 2.73Å; E778-R780 VanDerWaalsContact O-N 3.11Å; R780-E782 PolarHBondContact O-N 2.91Å
781	I	32.4	Very low	47.7	Very low	155 Å²	155	136.8 Å²	136.8	80%	0.795	71%	0.706	S	S	*	*			trans	-72.3	98.2	170.2	-59.3	175.2	0	0	0	106.5	I779 V783	I779-I781 PolarHBondContact O-N 2.74Å; I779-I781 VanDerWaalsContact O-N 3.12Å; I781-V783 PolarHBondContact O-N 3.4Å
782	E	31.9	Very low	50.2	Low	178 Å²	178	131.9 Å²	131.9	83%	0.832	68%	0.68	S	S	*	*			trans	-64.2	126	165	-67.7	-174.2	150	0	0	108	R780 A784	R780-E782 PolarHBondContact O-N 2.91Å; E782-A784 PolarHBondContact O-N 2.71Å
783	V	38.3	Very low	52.9	Low	135 Å²	135	123.3 Å²	123.3	82%	0.818	64%	0.643	S	S	*	*			trans	-70	106.1	-177.6	178.8	0	0	0	0	108.1	I781 E785	I781-V783 PolarHBondContact O-N 3.4Å; V783-E785 PolarHBondContact O-N 3.46Å
784	A	43	Very low	55.6	Low	85 Å²	85	121 Å²	121	70%	0.702	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-58.6	130.1	178.8	0	0	0	0	0	110.8	E782 R786	E782-A784 PolarHBondContact O-N 2.71Å; A784-R786 PolarHBondContact O-N 3.41Å
785	E	54.4	Low	58.4	Low	167 Å²	167	123.8 Å²	123.8	78%	0.78	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-59.1	128	-177.1	-61.9	177.2	138.5	0	0	110.9	V783 L787 R855	V783-E785 PolarHBondContact O-N 3.46Å; E785-L787 PolarHBondContact O-N 2.89Å; E785-R855 PolarHBondContact O-NH2 3.46Å
786	R	67.2	Low	61.5	Low	194 Å²	194	120.1 Å²	120.1	73%	0.732	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-64.4	135.5	175.8	-66.6	-165.8	-170.3	-171.1	5.9	109.5	A784 H788 E862	A784-R786 PolarHBondContact O-N 3.41Å; R786-H788 PolarHBondContact O-N 2.79Å; R786-E862 IonicContact CZ-OE1 3.69Å; R786-E862 IonicContact NH1-OE1 3.99Å; R786-E862 PolarHBondContact NH1-OE1 3.03Å
787	L	79.3	Confident	64.3	Low	38 Å²	38	116.4 Å²	116.4	20%	0.199	57%	0.572	C	S	.	*			trans	-81	114.7	176.4	-176	65.9	0	0	0	108.8	E785 L789 F804 R855 I856 A859 Q863	E785-L787 PolarHBondContact O-N 2.89Å; L787-L789 HydrophobicContact CD2-CD2 3.94Å; L787-L789 HydrophobicContact CG-CD2 3.99Å; L787-F804 HydrophobicContact CD1-CE2 4.39Å; L787-F804 HydrophobicContact CD2-CE2 4.16Å; L787-F804 HydrophobicContact CD2-CZ 4.01Å; L787-R855 HydrophobicContact CB-CB 4.49Å; L787-R855 HydrophobicContact CD2-CB 3.94Å; L787-I856 HydrophobicContact CD2-CG1 4.11Å; L787-A859 HydrophobicContact CB-CB 4.33Å; L787-A859 WeakPolarHBondContact O-CB 3.43Å; L787-Q863 PolarHBondContact O-NE2 2.8Å
788	H	82.6	Confident	67.3	Low	145 Å²	145	109 Å²	109	67%	0.671	54%	0.542	S	S	*	.			trans	-89.6	146.6	167.1	-163.6	41	0	0	0	109.7	R786 Q863	R786-H788 PolarHBondContact O-N 2.79Å; H788-Q863 PolarHBondContact ND1-OE1 3.24Å
789	L	87.9	Confident	70.4	Confident	8 Å²	8	102.8 Å²	102.8	4%	0.042	52%	0.523	C	S	.	.			trans	-123.8	117.9	-175.5	-64.5	178.9	0	0	0	110.2	L787 S791 P793 W796 F804 I856 A859 F864	L787-L789 HydrophobicContact CD2-CD2 3.94Å; L787-L789 HydrophobicContact CG-CD2 3.99Å; L789-S791 PolarHBondContact O-N 2.7Å; L789-P793 HydrophobicContact CD1-CG 3.7Å; L789-W796 HydrophobicContact CD2-CH2 3.88Å; L789-W796 HydrophobicContact CD2-CZ2 4.04Å; L789-F804 HydrophobicContact CD2-CE2 4.47Å; L789-I856 HydrophobicContact CD1-CG2 4.23Å; L789-A859 HydrophobicContact CD1-CB 3.56Å; L789-A859 HydrophobicContact CG-CB 3.75Å; L789-F864 HydrophobicContact CB-CE2 4.01Å
790	D	82.9	Confident	73.5	Confident	164 Å²	164	97.5 Å²	97.5	88%	0.877	50%	0.496	S	S	*	.	S	Bend	trans	-64.3	-12.3	-176.4	-51.2	-50.7	0	0	0	114.1
791	S	88.4	Confident	76.7	Confident	59 Å²	59	86.9 Å²	86.9	41%	0.413	46%	0.456	S	S	.	.	S	Bend	trans	-164	156.2	179.5	52.3	0	0	0	0	111.7	L789 P793 W796	L789-S791 PolarHBondContact O-N 2.7Å; S791-P793 WeakPolarHBondContact O-CD 3.46Å; S791-W796 PolarHBondContact O-NE1 3.38Å; S791-W796 PolarHBondContact OG-NE1 3.1Å
792	N	87.9	Confident	79.7	Confident	36 Å²	36	79.8 Å²	79.8	19%	0.193	42%	0.42	C	S	.	.			trans	-64	119.9	-178.3	-177.7	-24.9	0	0	0	112.3	L794 K795 F860 F864	N792-L794 VanDerWaalsContact C-N 3.28Å; N792-L794 PolarHBondContact O-N 2.96Å; N792-L794 WeakPolarHBondContact OD1-CB 3.46Å; N792-L794 PolarHBondContact OD1-N 3.12Å; N792-K795 PolarHBondContact O-N 3.01Å; N792-F860 WeakPolarHBondContact OD1-CE2 3.41Å; N792-F864 HydrophobicContact CB-CB 4.25Å; N792-F864 HydrophobicContact CB-CD1 3.79Å; N792-F864 HydrophobicContact CB-CD2 4.12Å; N792-F864 HydrophobicContact CB-CE1 4.12Å; N792-F864 HydrophobicContact CB-CE2 4.42Å; N792-F864 HydrophobicContact CB-CG 3.79Å; N792-F864 HydrophobicContact CB-CZ 4.43Å
793	P	89.6	Confident	82.7	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-57.4	-27.3	179.3	-29.3	37.8	0	0	0	116.4	L789 S791 K795 W796 G824 L828 I856 F860	L789-P793 HydrophobicContact CD1-CG 3.7Å; S791-P793 WeakPolarHBondContact O-CD 3.46Å; P793-K795 PolarHBondContact O-N 3.09Å; P793-W796 HydrophobicContact CB-CD2 4.07Å; P793-W796 HydrophobicContact CB-CE3 4.23Å; P793-W796 HydrophobicContact CB-CG 4.46Å; P793-W796 HydrophobicContact CG-CD2 4.32Å; P793-W796 HydrophobicContact CG-CH2 4.21Å; P793-W796 HydrophobicContact CG-CZ2 3.94Å; P793-W796 HydrophobicContact CG-CZ3 4.5Å; P793-W796 WeakPolarHBondContact O-CB 3.37Å; P793-W796 PolarHBondContact O-N 2.98Å; P793-G824 CarbonylContact O-C 3.38Å; P793-G824 VanDerWaalsContact O-CA 3.29Å; P793-G824 WeakPolarHBondContact O-CA 3.14Å; P793-L828 HydrophobicContact CB-CD1 4.19Å; P793-I856 HydrophobicContact CB-CG2 4.1Å; P793-I856 HydrophobicContact CG-CG2 3.68Å; P793-F860 HydrophobicContact CG-CB 4.21Å
794	L	89.7	Confident	85.3	Confident	73 Å²	73	73.6 Å²	73.6	38%	0.382	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-63	-13.5	175	-68.7	175.9	0	0	0	113.5	N792 Q825 L828 F860	N792-L794 VanDerWaalsContact C-N 3.28Å; N792-L794 PolarHBondContact O-N 2.96Å; N792-L794 WeakPolarHBondContact OD1-CB 3.46Å; N792-L794 PolarHBondContact OD1-N 3.12Å; L794-Q825 HydrophobicContact CD2-CG 4.04Å; L794-Q825 WeakPolarHBondContact O-CG 3.39Å; L794-Q825 PolarHBondContact O-NE2 2.88Å; L794-L828 HydrophobicContact CD2-CD1 3.79Å; L794-L828 HydrophobicContact CG-CD1 4.23Å; L794-F860 HydrophobicContact CD1-CE2 3.7Å; L794-F860 HydrophobicContact CD1-CZ 3.54Å; L794-F860 HydrophobicContact CG-CE2 3.85Å; L794-F860 HydrophobicContact CG-CZ 3.93Å
795	K	90.3	Very high	87.7	Confident	178 Å²	178	69.6 Å²	69.6	77%	0.774	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-110.8	5.1	176.5	-56.5	-168.9	179.3	-171.5	0	113.4	N792 P793 S797	N792-K795 PolarHBondContact O-N 3.01Å; P793-K795 PolarHBondContact O-N 3.09Å; K795-S797 PolarHBondContact O-N 2.62Å
796	W	95	Very high	89.6	Confident	22 Å²	22	68.9 Å²	68.9	8%	0.083	33%	0.332	C	S	.	.			trans	-74.1	124.6	176.9	-72.9	5	0	0	0	110.8	L789 S791 P793 D800 V801 F804 G824 L827 I856	L789-W796 HydrophobicContact CD2-CH2 3.88Å; L789-W796 HydrophobicContact CD2-CZ2 4.04Å; S791-W796 PolarHBondContact O-NE1 3.38Å; S791-W796 PolarHBondContact OG-NE1 3.1Å; P793-W796 HydrophobicContact CB-CD2 4.07Å; P793-W796 HydrophobicContact CB-CE3 4.23Å; P793-W796 HydrophobicContact CB-CG 4.46Å; P793-W796 HydrophobicContact CG-CD2 4.32Å; P793-W796 HydrophobicContact CG-CH2 4.21Å; P793-W796 HydrophobicContact CG-CZ2 3.94Å; P793-W796 HydrophobicContact CG-CZ3 4.5Å; P793-W796 WeakPolarHBondContact O-CB 3.37Å; P793-W796 PolarHBondContact O-N 2.98Å; W796-D800 HydrophobicContact CB-CB 3.91Å; W796-D800 HydrophobicContact CG-CB 4.09Å; W796-V801 HydrophobicContact CB-CG2 4.2Å; W796-V801 HydrophobicContact CE3-CG2 4.25Å; W796-F804 HydrophobicContact CH2-CB 4.34Å; W796-F804 AromaticContact CH2-CD2 3.73Å; W796-F804 HydrophobicContact CH2-CD2 3.73Å; W796-F804 HydrophobicContact CH2-CE2 4.34Å; W796-F804 HydrophobicContact CH2-CG 4.09Å; W796-F804 HydrophobicContact CZ3-CB 3.97Å; W796-F804 HydrophobicContact CZ3-CD2 4.07Å; W796-F804 AromaticContact CZ3-CG 3.94Å; W796-F804 HydrophobicContact CZ3-CG 3.94Å; W796-G824 PolarHBondContact O-N 2.85Å; W796-L827 HydrophobicContact CE3-CD2 4.22Å; W796-L827 HydrophobicContact CZ3-CD2 4.19Å; W796-I856 HydrophobicContact CH2-CG2 4.29Å; W796-I856 HydrophobicContact CZ3-CD1 4.33Å; W796-I856 HydrophobicContact CZ3-CG2 4.26Å
797	S	94.6	Very high	90.7	Very high	55 Å²	55	64.3 Å²	64.3	39%	0.385	33%	0.33	S	S	.	.			trans	-70.8	166.7	169.2	74.3	0	0	0	0	111	K795 A799 D800 V801	K795-S797 PolarHBondContact O-N 2.62Å; S797-A799 PolarHBondContact O-N 3.14Å; S797-A799 VanDerWaalsContact O-N 3.12Å; S797-A799 PolarHBondContact OG-N 3.04Å; S797-D800 VanDerWaalsContact CB-OD2 3.29Å; S797-D800 WeakPolarHBondContact CB-OD2 3.43Å; S797-D800 PolarHBondContact N-OD2 3.32Å; S797-D800 WeakPolarHBondContact O-CA 3.23Å; S797-D800 WeakPolarHBondContact O-CB 3.43Å; S797-D800 PolarHBondContact O-N 2.7Å; S797-D800 PolarHBondContact OG-N 3.29Å; S797-D800 PolarHBondContact OG-OD2 3.12Å; S797-V801 PolarHBondContact O-N 3.24Å
798	V	93.4	Very high	91.3	Very high	33 Å²	33	63.5 Å²	63.5	20%	0.2	33%	0.326	C	S	.	.	H	α-helix	trans	-49.7	-37.8	169.8	-172	0	0	0	0	111.4	D800 V802 L818 E821 D823	V798-D800 VanDerWaalsContact C-N 3.33Å; V798-D800 PolarHBondContact O-N 3.49Å; V798-V802 HydrophobicContact CG1-CG2 4.21Å; V798-V802 VanDerWaalsContact O-CB 3.24Å; V798-V802 WeakPolarHBondContact O-CB 3.39Å; V798-V802 WeakPolarHBondContact O-CG2 3.43Å; V798-V802 PolarHBondContact O-N 3.21Å; V798-L818 HydrophobicContact CG1-CD1 4.14Å; V798-E821 HydrophobicContact CG2-CB 4.47Å; V798-E821 WeakPolarHBondContact CG2-O 3.33Å; V798-D823 HydrophobicContact CG2-CB 4.2Å
799	A	93.8	Very high	91.5	Very high	57 Å²	57	60.9 Å²	60.9	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-68.5	-29.8	178.8	0	0	0	0	0	113.2	S797 R803	S797-A799 PolarHBondContact O-N 3.14Å; S797-A799 VanDerWaalsContact O-N 3.12Å; S797-A799 PolarHBondContact OG-N 3.04Å; A799-R803 WeakPolarHBondContact O-CB 3.48Å; A799-R803 PolarHBondContact O-N 2.93Å
800	D	93.8	Very high	91.6	Very high	43 Å²	43	60.8 Å²	60.8	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-78.4	-43	176.9	-54.5	-59.9	0	0	0	111.1	W796 S797 V798 V802 R803 F804	W796-D800 HydrophobicContact CB-CB 3.91Å; W796-D800 HydrophobicContact CG-CB 4.09Å; S797-D800 VanDerWaalsContact CB-OD2 3.29Å; S797-D800 WeakPolarHBondContact CB-OD2 3.43Å; S797-D800 PolarHBondContact N-OD2 3.32Å; S797-D800 WeakPolarHBondContact O-CA 3.23Å; S797-D800 WeakPolarHBondContact O-CB 3.43Å; S797-D800 PolarHBondContact O-N 2.7Å; S797-D800 PolarHBondContact OG-N 3.29Å; S797-D800 PolarHBondContact OG-OD2 3.12Å; V798-D800 VanDerWaalsContact C-N 3.33Å; V798-D800 PolarHBondContact O-N 3.49Å; D800-V802 VanDerWaalsContact C-N 3.35Å; D800-V802 PolarHBondContact O-N 3.32Å; D800-R803 WeakPolarHBondContact O-CB 3.48Å; D800-R803 PolarHBondContact O-N 2.83Å; D800-R803 VanDerWaalsContact O-N 3.11Å; D800-R803 IonicContact OD1-CZ 3.15Å; D800-R803 IonicContact OD1-NH1 2.69Å; D800-R803 PolarHBondContact OD1-NH1 2.83Å; D800-R803 IonicContact OD1-NH2 2.71Å; D800-R803 PolarHBondContact OD1-NH2 2.77Å; D800-F804 PolarHBondContact O-N 3.22Å
801	V	94.7	Very high	92	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.4	-48	170.7	175.3	0	0	0	0	111	W796 S797 R803 F804 I805 F817 D823 L827	W796-V801 HydrophobicContact CB-CG2 4.2Å; W796-V801 HydrophobicContact CE3-CG2 4.25Å; S797-V801 PolarHBondContact O-N 3.24Å; V801-R803 VanDerWaalsContact C-N 3.26Å; V801-R803 PolarHBondContact O-N 3.42Å; V801-F804 PolarHBondContact O-N 3.17Å; V801-I805 HydrophobicContact CG1-CG1 4.3Å; V801-I805 WeakPolarHBondContact O-CG1 3.5Å; V801-I805 PolarHBondContact O-N 3.22Å; V801-F817 HydrophobicContact CG1-CB 4.41Å; V801-F817 HydrophobicContact CG1-CD1 3.62Å; V801-F817 HydrophobicContact CG1-CE1 4.33Å; V801-F817 HydrophobicContact CG1-CG 4.28Å; V801-D823 VanDerWaalsContact CG2-C 3.45Å; V801-L827 HydrophobicContact CG1-CB 4.47Å; V801-L827 HydrophobicContact CG1-CD1 4.03Å; V801-L827 HydrophobicContact CG1-CD2 3.98Å; V801-L827 HydrophobicContact CG1-CG 4.4Å; V801-L827 HydrophobicContact CG2-CB 4.41Å; V801-L827 HydrophobicContact CG2-CD2 4.02Å
802	V	95.2	Very high	92.1	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-31.5	177.5	169.7	0	0	0	0	111.6	V798 D800 R806 A814 F817 L818	V798-V802 HydrophobicContact CG1-CG2 4.21Å; V798-V802 VanDerWaalsContact O-CB 3.24Å; V798-V802 WeakPolarHBondContact O-CB 3.39Å; V798-V802 WeakPolarHBondContact O-CG2 3.43Å; V798-V802 PolarHBondContact O-N 3.21Å; D800-V802 VanDerWaalsContact C-N 3.35Å; D800-V802 PolarHBondContact O-N 3.32Å; V802-R806 WeakPolarHBondContact O-CB 3.24Å; V802-R806 WeakPolarHBondContact O-CD 3.27Å; V802-R806 WeakPolarHBondContact O-CG 3.47Å; V802-R806 PolarHBondContact O-N 2.82Å; V802-A814 HydrophobicContact CG1-CB 4.35Å; V802-F817 HydrophobicContact CG2-CB 3.94Å; V802-L818 HydrophobicContact CG2-CB 3.85Å; V802-L818 HydrophobicContact CG2-CD1 4.38Å
803	R	94.6	Very high	92.1	Very high	151 Å²	151	56.7 Å²	56.7	57%	0.57	30%	0.302	S	S	*	.	H	α-helix	trans	-68.9	-43.7	172.6	-163.4	-172.4	-49.9	110.7	11	111.6	A799 D800 V801 R806 S807	A799-R803 WeakPolarHBondContact O-CB 3.48Å; A799-R803 PolarHBondContact O-N 2.93Å; D800-R803 WeakPolarHBondContact O-CB 3.48Å; D800-R803 PolarHBondContact O-N 2.83Å; D800-R803 VanDerWaalsContact O-N 3.11Å; D800-R803 IonicContact OD1-CZ 3.15Å; D800-R803 IonicContact OD1-NH1 2.69Å; D800-R803 PolarHBondContact OD1-NH1 2.83Å; D800-R803 IonicContact OD1-NH2 2.71Å; D800-R803 PolarHBondContact OD1-NH2 2.77Å; V801-R803 VanDerWaalsContact C-N 3.26Å; V801-R803 PolarHBondContact O-N 3.42Å; R803-R806 PolarHBondContact O-N 3.2Å; R803-S807 PolarHBondContact O-N 2.9Å
804	F	93.4	Very high	92.2	Very high	32 Å²	32	56.8 Å²	56.8	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-51.5	175.9	-179.8	-83.5	0	0	0	111.8	L787 L789 W796 D800 V801 R806 S807 T808 I856	L787-F804 HydrophobicContact CD1-CE2 4.39Å; L787-F804 HydrophobicContact CD2-CE2 4.16Å; L787-F804 HydrophobicContact CD2-CZ 4.01Å; L789-F804 HydrophobicContact CD2-CE2 4.47Å; W796-F804 HydrophobicContact CH2-CB 4.34Å; W796-F804 AromaticContact CH2-CD2 3.73Å; W796-F804 HydrophobicContact CH2-CD2 3.73Å; W796-F804 HydrophobicContact CH2-CE2 4.34Å; W796-F804 HydrophobicContact CH2-CG 4.09Å; W796-F804 HydrophobicContact CZ3-CB 3.97Å; W796-F804 HydrophobicContact CZ3-CD2 4.07Å; W796-F804 AromaticContact CZ3-CG 3.94Å; W796-F804 HydrophobicContact CZ3-CG 3.94Å; D800-F804 PolarHBondContact O-N 3.22Å; V801-F804 PolarHBondContact O-N 3.17Å; F804-R806 PolarHBondContact O-N 3.22Å; F804-R806 VanDerWaalsContact O-N 3.12Å; F804-S807 PolarHBondContact O-N 3.31Å; F804-S807 PolarHBondContact O-OG 3.16Å; F804-T808 HydrophobicContact CD1-CG2 4.13Å; F804-T808 HydrophobicContact CE1-CG2 3.56Å; F804-T808 HydrophobicContact CZ-CG2 4.06Å; F804-I856 HydrophobicContact CD1-CD1 3.72Å; F804-I856 HydrophobicContact CD1-CG1 4.47Å; F804-I856 HydrophobicContact CE1-CD1 3.36Å; F804-I856 HydrophobicContact CE1-CG1 3.8Å; F804-I856 HydrophobicContact CE2-CD1 4.43Å; F804-I856 HydrophobicContact CE2-CG1 4.19Å; F804-I856 HydrophobicContact CG-CD1 4.43Å; F804-I856 HydrophobicContact CZ-CD1 3.76Å; F804-I856 HydrophobicContact CZ-CG1 3.63Å
805	I	94.1	Very high	92.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.5	-32.6	-179.1	-60.4	-64	0	0	0	110.7	V801 S807 T808 C810 A811 A814 F817 L849	V801-I805 HydrophobicContact CG1-CG1 4.3Å; V801-I805 WeakPolarHBondContact O-CG1 3.5Å; V801-I805 PolarHBondContact O-N 3.22Å; I805-S807 VanDerWaalsContact C-N 3.33Å; I805-S807 PolarHBondContact O-N 2.96Å; I805-T808 PolarHBondContact O-N 3.37Å; I805-T808 PolarHBondContact O-OG1 2.59Å; I805-C810 HydrophobicContact CG2-CB 4.3Å; I805-C810 WeakPolarHBondContact CG2-O 3.28Å; I805-A811 VanDerWaalsContact O-CA 3.25Å; I805-A811 WeakPolarHBondContact O-CA 3.36Å; I805-A811 PolarHBondContact O-N 2.84Å; I805-A814 HydrophobicContact CB-CB 3.98Å; I805-A814 HydrophobicContact CG2-CB 3.79Å; I805-F817 HydrophobicContact CD1-CE2 4.47Å; I805-F817 HydrophobicContact CD1-CZ 4.41Å; I805-F817 HydrophobicContact CG1-CD1 4.45Å; I805-F817 HydrophobicContact CG1-CD2 4.21Å; I805-F817 HydrophobicContact CG1-CE2 4.35Å; I805-F817 HydrophobicContact CG1-CG 4.29Å; I805-F817 HydrophobicContact CG2-CD2 4.46Å; I805-L849 HydrophobicContact CD1-CD1 3.82Å
806	R	94.2	Very high	92	Very high	153 Å²	153	55.3 Å²	55.3	58%	0.577	29%	0.29	S	S	*	.	H	α-helix	trans	-67.3	-19.2	174.2	-76.2	173.3	-170.6	-175.4	5.8	115.8	V802 R803 F804 A814	V802-R806 WeakPolarHBondContact O-CB 3.24Å; V802-R806 WeakPolarHBondContact O-CD 3.27Å; V802-R806 WeakPolarHBondContact O-CG 3.47Å; V802-R806 PolarHBondContact O-N 2.82Å; R803-R806 PolarHBondContact O-N 3.2Å; F804-R806 PolarHBondContact O-N 3.22Å; F804-R806 VanDerWaalsContact O-N 3.12Å; R806-A814 HydrophobicContact CG-CB 3.57Å
807	S	90	Very high	91.9	Very high	98 Å²	98	54.2 Å²	54.2	69%	0.685	29%	0.286	S	S	*	.	H	α-helix	trans	-90.8	-9.6	173.3	63.9	0	0	0	0	113.5	R803 F804 I805	R803-S807 PolarHBondContact O-N 2.9Å; F804-S807 PolarHBondContact O-N 3.31Å; F804-S807 PolarHBondContact O-OG 3.16Å; I805-S807 VanDerWaalsContact C-N 3.33Å; I805-S807 PolarHBondContact O-N 2.96Å
808	T	91.7	Very high	91.7	Very high	20 Å²	20	55.5 Å²	55.5	12%	0.123	29%	0.288	C	S	.	.	S	Bend	trans	-90.3	168.9	175.4	72	0	0	0	0	112.6	F804 I805 C810 A811 H852	F804-T808 HydrophobicContact CD1-CG2 4.13Å; F804-T808 HydrophobicContact CE1-CG2 3.56Å; F804-T808 HydrophobicContact CZ-CG2 4.06Å; I805-T808 PolarHBondContact O-N 3.37Å; I805-T808 PolarHBondContact O-OG1 2.59Å; T808-C810 PolarHBondContact O-N 3.14Å; T808-C810 VanDerWaalsContact O-N 3.12Å; T808-C810 WeakPolarHBondContact OG1-CB 3.17Å; T808-C810 PolarHBondContact OG1-N 3.49Å; T808-C810 VanDerWaalsContact OG1-N 3.11Å; T808-A811 WeakPolarHBondContact O-CB 3.42Å; T808-A811 PolarHBondContact O-N 3.39Å; T808-A811 VanDerWaalsContact O-N 3.09Å; T808-H852 HydrophobicContact CG2-CB 4.39Å
809	D	86	Confident	91.4	Very high	90 Å²	90	58.1 Å²	58.1	48%	0.481	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-3.9	169.6	80.5	-40.5	0	0	0	113.7	K848 H852	D809-K848 WeakPolarHBondContact OD2-CD 3.41Å; D809-K848 WeakPolarHBondContact OD2-CE 3.5Å; D809-K848 IonicContact OD2-NZ 4Å; D809-K848 PolarHBondContact OD2-NZ 2.86Å; D809-H852 IonicContact OD1-CD2 3.95Å; D809-H852 IonicContact OD1-CE1 3.2Å; D809-H852 IonicContact OD1-NE2 2.75Å; D809-H852 PolarHBondContact OD1-NE2 3.25Å
810	C	91.1	Very high	91	Very high	6 Å²	6	61.1 Å²	61.1	4%	0.041	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	9.7	169.6	-68.4	0	0	0	0	113.8	I805 T808 P812 L813 L849	I805-C810 HydrophobicContact CG2-CB 4.3Å; I805-C810 WeakPolarHBondContact CG2-O 3.28Å; T808-C810 PolarHBondContact O-N 3.14Å; T808-C810 VanDerWaalsContact O-N 3.12Å; T808-C810 WeakPolarHBondContact OG1-CB 3.17Å; T808-C810 PolarHBondContact OG1-N 3.49Å; T808-C810 VanDerWaalsContact OG1-N 3.11Å; C810-P812 VanDerWaalsContact C-N 3.31Å; C810-P812 WeakPolarHBondContact O-CD 3.35Å; C810-P812 VanDerWaalsContact O-N 3.07Å; C810-L813 HydrophobicContact CB-CD1 4.07Å; C810-L813 HydrophobicContact CB-CG 4.44Å; C810-L813 WeakPolarHBondContact O-CA 3.28Å; C810-L813 VanDerWaalsContact O-CB 3.26Å; C810-L813 WeakPolarHBondContact O-CB 3.17Å; C810-L813 WeakPolarHBondContact O-CG 3.38Å; C810-L813 PolarHBondContact O-N 3.29Å; C810-L849 HydrophobicContact CB-CD1 4.31Å
811	A	90.7	Very high	90.8	Very high	37 Å²	37	66.8 Å²	66.8	31%	0.306	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-45.2	-37.4	179.6	0	0	0	0	0	116.8	I805 T808 L813 A814	I805-A811 VanDerWaalsContact O-CA 3.25Å; I805-A811 WeakPolarHBondContact O-CA 3.36Å; I805-A811 PolarHBondContact O-N 2.84Å; T808-A811 WeakPolarHBondContact O-CB 3.42Å; T808-A811 PolarHBondContact O-N 3.39Å; T808-A811 VanDerWaalsContact O-N 3.09Å; A811-L813 PolarHBondContact O-N 3.07Å; A811-A814 VanDerWaalsContact O-CB 3.27Å; A811-A814 WeakPolarHBondContact O-CB 3.35Å; A811-A814 PolarHBondContact O-N 3.29Å; A811-A814 VanDerWaalsContact O-N 3.14Å
812	P	90.1	Very high	90.6	Very high	112 Å²	112	67.6 Å²	67.6	73%	0.727	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-60.6	-25	174.7	-25	36	0	0	0	114.3	C810	C810-P812 VanDerWaalsContact C-N 3.31Å; C810-P812 WeakPolarHBondContact O-CD 3.35Å; C810-P812 VanDerWaalsContact O-N 3.07Å
813	L	89.3	Confident	90.4	Very high	25 Å²	25	70.1 Å²	70.1	13%	0.131	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-80.9	-16.1	-179.7	-50	-176.5	0	0	0	112.4	C810 A811 R815 I816 L841 L849	C810-L813 HydrophobicContact CB-CD1 4.07Å; C810-L813 HydrophobicContact CB-CG 4.44Å; C810-L813 WeakPolarHBondContact O-CA 3.28Å; C810-L813 VanDerWaalsContact O-CB 3.26Å; C810-L813 WeakPolarHBondContact O-CB 3.17Å; C810-L813 WeakPolarHBondContact O-CG 3.38Å; C810-L813 PolarHBondContact O-N 3.29Å; A811-L813 PolarHBondContact O-N 3.07Å; L813-R815 PolarHBondContact O-N 2.88Å; L813-I816 HydrophobicContact CD2-CD1 4.3Å; L813-I816 WeakPolarHBondContact O-CB 3.27Å; L813-I816 PolarHBondContact O-N 3.01Å; L813-L841 HydrophobicContact CD1-CD1 3.93Å; L813-L841 HydrophobicContact CD2-CD1 4.46Å; L813-L841 HydrophobicContact CD2-CD2 3.72Å; L813-L849 HydrophobicContact CD1-CB 4.09Å; L813-L849 HydrophobicContact CD1-CD2 3.8Å; L813-L849 HydrophobicContact CD1-CG 4.4Å
814	A	90.4	Very high	90.1	Very high	1 Å²	1	63 Å²	63	1%	0.008	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-18.9	-177.5	0	0	0	0	0	113.9	V802 I805 R806 A811 L818	V802-A814 HydrophobicContact CG1-CB 4.35Å; I805-A814 HydrophobicContact CB-CB 3.98Å; I805-A814 HydrophobicContact CG2-CB 3.79Å; R806-A814 HydrophobicContact CG-CB 3.57Å; A811-A814 VanDerWaalsContact O-CB 3.27Å; A811-A814 WeakPolarHBondContact O-CB 3.35Å; A811-A814 PolarHBondContact O-N 3.29Å; A811-A814 VanDerWaalsContact O-N 3.14Å; A814-L818 PolarHBondContact O-N 3.17Å
815	R	87.4	Confident	89.8	Confident	175 Å²	175	66.7 Å²	66.7	66%	0.66	34%	0.338	S	S	*	.	H	α-helix	trans	-71.1	-35.6	170.8	-176.5	171.6	-177.9	155.3	8.9	112.5	L813 F817 L818 D819	L813-R815 PolarHBondContact O-N 2.88Å; R815-F817 VanDerWaalsContact C-N 3.32Å; R815-F817 PolarHBondContact O-N 2.8Å; R815-L818 PolarHBondContact O-N 3.08Å; R815-D819 VanDerWaalsContact CG-OD2 3.3Å; R815-D819 WeakPolarHBondContact CG-OD2 3.1Å; R815-D819 IonicContact NE-OD1 3.93Å; R815-D819 IonicContact NE-OD2 3.06Å; R815-D819 PolarHBondContact NE-OD2 3.01Å; R815-D819 VanDerWaalsContact O-CB 3.31Å; R815-D819 WeakPolarHBondContact O-CB 3.25Å; R815-D819 VanDerWaalsContact O-CG 3.23Å; R815-D819 PolarHBondContact O-N 3.2Å
816	I	89.3	Confident	89.6	Confident	45 Å²	45	68.5 Å²	68.5	23%	0.231	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-40.4	176.6	-54	174.9	0	0	0	110	L813 L818 D819 Q820 M839 L841	L813-I816 HydrophobicContact CD2-CD1 4.3Å; L813-I816 WeakPolarHBondContact O-CB 3.27Å; L813-I816 PolarHBondContact O-N 3.01Å; I816-L818 VanDerWaalsContact C-N 3.3Å; I816-L818 PolarHBondContact O-N 3.26Å; I816-D819 PolarHBondContact O-N 3.13Å; I816-Q820 HydrophobicContact CG2-CG 4.07Å; I816-Q820 VanDerWaalsContact O-CB 3.24Å; I816-Q820 WeakPolarHBondContact O-CB 3.38Å; I816-Q820 WeakPolarHBondContact O-CG 3.36Å; I816-Q820 PolarHBondContact O-N 3.31Å; I816-M839 HydrophobicContact CG2-CB 4.11Å; I816-M839 HydrophobicContact CG2-CG 4Å; I816-M839 HydrophobicContact CG2-SD 4.2Å; I816-L841 HydrophobicContact CD1-CD2 4.08Å
817	F	91.4	Very high	89.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-35.4	175.7	-75.6	-96.7	0	0	0	112.8	V801 V802 I805 R815 E821 I822 L827 L830 M839 L849	V801-F817 HydrophobicContact CG1-CB 4.41Å; V801-F817 HydrophobicContact CG1-CD1 3.62Å; V801-F817 HydrophobicContact CG1-CE1 4.33Å; V801-F817 HydrophobicContact CG1-CG 4.28Å; V802-F817 HydrophobicContact CG2-CB 3.94Å; I805-F817 HydrophobicContact CD1-CE2 4.47Å; I805-F817 HydrophobicContact CD1-CZ 4.41Å; I805-F817 HydrophobicContact CG1-CD1 4.45Å; I805-F817 HydrophobicContact CG1-CD2 4.21Å; I805-F817 HydrophobicContact CG1-CE2 4.35Å; I805-F817 HydrophobicContact CG1-CG 4.29Å; I805-F817 HydrophobicContact CG2-CD2 4.46Å; R815-F817 VanDerWaalsContact C-N 3.32Å; R815-F817 PolarHBondContact O-N 2.8Å; F817-E821 PolarHBondContact O-N 2.87Å; F817-I822 HydrophobicContact CB-CB 4.42Å; F817-I822 HydrophobicContact CD1-CB 3.71Å; F817-I822 HydrophobicContact CD1-CD1 3.89Å; F817-I822 HydrophobicContact CD1-CG1 4.34Å; F817-I822 HydrophobicContact CD1-CG2 3.61Å; F817-I822 HydrophobicContact CE1-CB 4.39Å; F817-I822 HydrophobicContact CE1-CD1 4.08Å; F817-I822 HydrophobicContact CE1-CG2 3.87Å; F817-I822 HydrophobicContact CG-CB 4.45Å; F817-I822 HydrophobicContact CG-CD1 4.36Å; F817-I822 PolarHBondContact O-N 3.41Å; F817-L827 HydrophobicContact CD1-CD1 4.23Å; F817-L827 HydrophobicContact CE1-CD1 3.51Å; F817-L827 HydrophobicContact CZ-CD1 4.27Å; F817-L830 HydrophobicContact CE1-CD1 3.62Å; F817-L830 HydrophobicContact CZ-CD1 3.84Å; F817-M839 HydrophobicContact CE1-CE 4.29Å; F817-M839 HydrophobicContact CE2-CE 4.36Å; F817-M839 HydrophobicContact CE2-SD 4.22Å; F817-M839 HydrophobicContact CZ-CE 3.93Å; F817-M839 HydrophobicContact CZ-SD 4.28Å; F817-L849 HydrophobicContact CE2-CD1 3.84Å; F817-L849 HydrophobicContact CE2-CD2 3.66Å; F817-L849 HydrophobicContact CE2-CG 4.35Å; F817-L849 HydrophobicContact CZ-CD1 3.77Å; F817-L849 HydrophobicContact CZ-CD2 3.78Å; F817-L849 HydrophobicContact CZ-CG 4.2Å
818	L	90.9	Very high	89.3	Confident	82 Å²	82	57.7 Å²	57.7	43%	0.429	30%	0.299	S	S	.	.	H	α-helix	trans	-73.1	-51	173.3	-171.9	63.9	0	0	0	112	V798 V802 A814 R815 I816 Q820 E821	V798-L818 HydrophobicContact CG1-CD1 4.14Å; V802-L818 HydrophobicContact CG2-CB 3.85Å; V802-L818 HydrophobicContact CG2-CD1 4.38Å; A814-L818 PolarHBondContact O-N 3.17Å; R815-L818 PolarHBondContact O-N 3.08Å; I816-L818 VanDerWaalsContact C-N 3.3Å; I816-L818 PolarHBondContact O-N 3.26Å; L818-Q820 PolarHBondContact O-N 3.3Å; L818-Q820 VanDerWaalsContact O-N 3.16Å; L818-E821 PolarHBondContact O-N 3.12Å; L818-E821 VanDerWaalsContact O-N 3.1Å
819	D	86.5	Confident	88.9	Confident	87 Å²	87	63.4 Å²	63.4	47%	0.465	33%	0.328	S	S	.	.	H	α-helix	trans	-70.6	-6.8	-176.2	-64.9	-3	0	0	0	112.5	R815 I816	R815-D819 VanDerWaalsContact CG-OD2 3.3Å; R815-D819 WeakPolarHBondContact CG-OD2 3.1Å; R815-D819 IonicContact NE-OD1 3.93Å; R815-D819 IonicContact NE-OD2 3.06Å; R815-D819 PolarHBondContact NE-OD2 3.01Å; R815-D819 VanDerWaalsContact O-CB 3.31Å; R815-D819 WeakPolarHBondContact O-CB 3.25Å; R815-D819 VanDerWaalsContact O-CG 3.23Å; R815-D819 PolarHBondContact O-N 3.2Å; I816-D819 PolarHBondContact O-N 3.13Å
820	Q	86.1	Confident	88.8	Confident	121 Å²	121	59.8 Å²	59.8	57%	0.565	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	11.6	173.3	-61.1	-65.7	-91.9	0	0	113.2	I816 L818 I822	I816-Q820 HydrophobicContact CG2-CG 4.07Å; I816-Q820 VanDerWaalsContact O-CB 3.24Å; I816-Q820 WeakPolarHBondContact O-CB 3.38Å; I816-Q820 WeakPolarHBondContact O-CG 3.36Å; I816-Q820 PolarHBondContact O-N 3.31Å; L818-Q820 PolarHBondContact O-N 3.3Å; L818-Q820 VanDerWaalsContact O-N 3.16Å; Q820-I822 VanDerWaalsContact C-N 3.27Å; Q820-I822 HydrophobicContact CB-CD1 4.04Å; Q820-I822 HydrophobicContact CB-CG1 3.89Å; Q820-I822 PolarHBondContact O-N 3.19Å
821	E	89.3	Confident	88.3	Confident	162 Å²	162	62.3 Å²	62.3	76%	0.757	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	38.6	174.8	-59.1	-176.8	164.3	0	0	114.4	V798 F817 L818 D823	V798-E821 HydrophobicContact CG2-CB 4.47Å; V798-E821 WeakPolarHBondContact CG2-O 3.33Å; F817-E821 PolarHBondContact O-N 2.87Å; L818-E821 PolarHBondContact O-N 3.12Å; L818-E821 VanDerWaalsContact O-N 3.1Å; E821-D823 PolarHBondContact O-N 3.1Å
822	I	90.1	Very high	87.4	Confident	16 Å²	16	63.4 Å²	63.4	8%	0.082	32%	0.324	C	S	.	.			trans	-81.3	103	-174.7	-55.5	-178.1	0	0	0	110.3	F817 Q820 A826 L827 M839	F817-I822 HydrophobicContact CB-CB 4.42Å; F817-I822 HydrophobicContact CD1-CB 3.71Å; F817-I822 HydrophobicContact CD1-CD1 3.89Å; F817-I822 HydrophobicContact CD1-CG1 4.34Å; F817-I822 HydrophobicContact CD1-CG2 3.61Å; F817-I822 HydrophobicContact CE1-CB 4.39Å; F817-I822 HydrophobicContact CE1-CD1 4.08Å; F817-I822 HydrophobicContact CE1-CG2 3.87Å; F817-I822 HydrophobicContact CG-CB 4.45Å; F817-I822 HydrophobicContact CG-CD1 4.36Å; F817-I822 PolarHBondContact O-N 3.41Å; Q820-I822 VanDerWaalsContact C-N 3.27Å; Q820-I822 HydrophobicContact CB-CD1 4.04Å; Q820-I822 HydrophobicContact CB-CG1 3.89Å; Q820-I822 PolarHBondContact O-N 3.19Å; I822-A826 HydrophobicContact CG2-CB 3.85Å; I822-L827 HydrophobicContact CG2-CB 4.39Å; I822-M839 HydrophobicContact CD1-CE 3.41Å; I822-M839 VanDerWaalsContact CD1-CE 3.41Å
823	D	90.9	Very high	86.7	Confident	60 Å²	60	61.8 Å²	61.8	32%	0.321	31%	0.314	S	S	.	.			trans	-78.9	-179.8	170.4	73	23.4	0	0	0	112.7	V798 V801 E821 Q825 A826 L827	V798-D823 HydrophobicContact CG2-CB 4.2Å; V801-D823 VanDerWaalsContact CG2-C 3.45Å; E821-D823 PolarHBondContact O-N 3.1Å; D823-Q825 VanDerWaalsContact C-N 3.31Å; D823-Q825 PolarHBondContact O-N 3.26Å; D823-Q825 WeakPolarHBondContact OD1-CA 3.25Å; D823-Q825 WeakPolarHBondContact OD1-CB 3.48Å; D823-Q825 PolarHBondContact OD1-N 3.34Å; D823-A826 PolarHBondContact O-N 3.27Å; D823-A826 PolarHBondContact OD1-N 3.39Å; D823-L827 VanDerWaalsContact O-CB 3.27Å; D823-L827 WeakPolarHBondContact O-CB 3.03Å; D823-L827 PolarHBondContact O-N 3.16Å
824	G	89	Confident	86.2	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-23.9	-177.4	0	0	0	0	0	114.9	P793 W796 L828	P793-G824 CarbonylContact O-C 3.38Å; P793-G824 VanDerWaalsContact O-CA 3.29Å; P793-G824 WeakPolarHBondContact O-CA 3.14Å; W796-G824 PolarHBondContact O-N 2.85Å; G824-L828 WeakPolarHBondContact O-CG 3.19Å; G824-L828 PolarHBondContact O-N 3.18Å
825	Q	87.1	Confident	85.7	Confident	110 Å²	110	63 Å²	63	51%	0.514	32%	0.323	S	S	.	.	H	α-helix	trans	-76.2	-47.5	175.6	-55.7	-172.9	11	0	0	109.5	L794 D823 L827 L828 L829	L794-Q825 HydrophobicContact CD2-CG 4.04Å; L794-Q825 WeakPolarHBondContact O-CG 3.39Å; L794-Q825 PolarHBondContact O-NE2 2.88Å; D823-Q825 VanDerWaalsContact C-N 3.31Å; D823-Q825 PolarHBondContact O-N 3.26Å; D823-Q825 WeakPolarHBondContact OD1-CA 3.25Å; D823-Q825 WeakPolarHBondContact OD1-CB 3.48Å; D823-Q825 PolarHBondContact OD1-N 3.34Å; Q825-L827 VanDerWaalsContact C-N 3.31Å; Q825-L827 PolarHBondContact O-N 3.04Å; Q825-L828 PolarHBondContact O-N 3.1Å; Q825-L829 WeakPolarHBondContact O-CG 3.36Å; Q825-L829 PolarHBondContact O-N 3.28Å
826	A	89.7	Confident	85.3	Confident	38 Å²	38	57.7 Å²	57.7	31%	0.314	31%	0.305	S	S	.	.	H	α-helix	trans	-59.4	-40.2	172.8	0	0	0	0	0	112	I822 D823 L828 L829 L830	I822-A826 HydrophobicContact CG2-CB 3.85Å; D823-A826 PolarHBondContact O-N 3.27Å; D823-A826 PolarHBondContact OD1-N 3.39Å; A826-L828 PolarHBondContact O-N 3.48Å; A826-L829 PolarHBondContact O-N 3.4Å; A826-L829 VanDerWaalsContact O-N 3.11Å; A826-L830 PolarHBondContact O-N 2.96Å
827	L	89.4	Confident	84.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-56.9	-44.9	174.7	-179.3	71.1	0	0	0	112.4	W796 V801 F817 I822 D823 Q825 L829 L830 I853 I856	W796-L827 HydrophobicContact CE3-CD2 4.22Å; W796-L827 HydrophobicContact CZ3-CD2 4.19Å; V801-L827 HydrophobicContact CG1-CB 4.47Å; V801-L827 HydrophobicContact CG1-CD1 4.03Å; V801-L827 HydrophobicContact CG1-CD2 3.98Å; V801-L827 HydrophobicContact CG1-CG 4.4Å; V801-L827 HydrophobicContact CG2-CB 4.41Å; V801-L827 HydrophobicContact CG2-CD2 4.02Å; F817-L827 HydrophobicContact CD1-CD1 4.23Å; F817-L827 HydrophobicContact CE1-CD1 3.51Å; F817-L827 HydrophobicContact CZ-CD1 4.27Å; I822-L827 HydrophobicContact CG2-CB 4.39Å; D823-L827 VanDerWaalsContact O-CB 3.27Å; D823-L827 WeakPolarHBondContact O-CB 3.03Å; D823-L827 PolarHBondContact O-N 3.16Å; Q825-L827 VanDerWaalsContact C-N 3.31Å; Q825-L827 PolarHBondContact O-N 3.04Å; L827-L829 VanDerWaalsContact C-N 3.28Å; L827-L829 PolarHBondContact O-N 2.85Å; L827-L830 HydrophobicContact CD1-CD1 4.37Å; L827-L830 WeakPolarHBondContact O-CB 3.39Å; L827-L830 PolarHBondContact O-N 3.25Å; L827-I853 HydrophobicContact CD1-CD1 4.15Å; L827-I853 HydrophobicContact CD1-CG1 3.8Å; L827-I853 HydrophobicContact CG-CG1 4.49Å; L827-I853 WeakPolarHBondContact O-CG2 3.42Å; L827-I856 HydrophobicContact CD2-CD1 3.74Å; L827-I856 HydrophobicContact CG-CD1 4.45Å
828	L	88.5	Confident	83.6	Confident	24 Å²	24	67.6 Å²	67.6	13%	0.126	36%	0.359	C	S	.	.	H	α-helix	trans	-70	-22.1	177.3	-69.4	174.2	0	0	0	112.8	P793 L794 G824 Q825 A826 I856 K857 F860	P793-L828 HydrophobicContact CB-CD1 4.19Å; L794-L828 HydrophobicContact CD2-CD1 3.79Å; L794-L828 HydrophobicContact CG-CD1 4.23Å; G824-L828 WeakPolarHBondContact O-CG 3.19Å; G824-L828 PolarHBondContact O-N 3.18Å; Q825-L828 PolarHBondContact O-N 3.1Å; A826-L828 PolarHBondContact O-N 3.48Å; L828-I856 HydrophobicContact CD2-CG2 4.22Å; L828-K857 HydrophobicContact CD2-CB 4.29Å; L828-K857 HydrophobicContact CD2-CG 3.53Å; L828-K857 WeakPolarHBondContact O-CE 3.28Å; L828-F860 HydrophobicContact CD1-CD1 4.23Å; L828-F860 HydrophobicContact CD1-CE1 4.46Å; L828-F860 HydrophobicContact CD1-CG 4.4Å
829	L	84.4	Confident	83	Confident	140 Å²	140	64.7 Å²	64.7	73%	0.733	34%	0.344	S	S	*	.	H	α-helix	trans	-85.9	-7.9	175.7	-65.5	174.7	0	0	0	113.8	Q825 A826 L827	Q825-L829 WeakPolarHBondContact O-CG 3.36Å; Q825-L829 PolarHBondContact O-N 3.28Å; A826-L829 PolarHBondContact O-N 3.4Å; A826-L829 VanDerWaalsContact O-N 3.11Å; L827-L829 VanDerWaalsContact C-N 3.28Å; L827-L829 PolarHBondContact O-N 2.85Å
830	L	83.9	Confident	82.7	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.073	36%	0.361	C	S	.	.			trans	-67.1	138.6	178.1	-70.5	178.1	0	0	0	112.4	F817 A826 L827 T834 V835 M839 I853 K857	F817-L830 HydrophobicContact CE1-CD1 3.62Å; F817-L830 HydrophobicContact CZ-CD1 3.84Å; A826-L830 PolarHBondContact O-N 2.96Å; L827-L830 HydrophobicContact CD1-CD1 4.37Å; L827-L830 WeakPolarHBondContact O-CB 3.39Å; L827-L830 PolarHBondContact O-N 3.25Å; L830-T834 HydrophobicContact CD2-CG2 4.04Å; L830-V835 HydrophobicContact CB-CG2 3.99Å; L830-V835 HydrophobicContact CD1-CG2 4.25Å; L830-V835 HydrophobicContact CD2-CG2 4.27Å; L830-V835 HydrophobicContact CG-CG2 4.4Å; L830-M839 HydrophobicContact CD1-CE 3.56Å; L830-M839 HydrophobicContact CD2-CE 3.8Å; L830-M839 HydrophobicContact CG-CE 4.36Å; L830-I853 HydrophobicContact CB-CD1 4Å; L830-I853 HydrophobicContact CD1-CD1 3.82Å; L830-K857 PolarHBondContact O-NZ 3.41Å
831	T	80.8	Confident	82.3	Confident	60 Å²	60	63 Å²	63	37%	0.368	34%	0.339	S	S	.	.			trans	-130.6	161.6	175.4	73.1	0	0	0	0	110.3	T834 V835	T831-T834 WeakPolarHBondContact O-CB 3.47Å; T831-T834 PolarHBondContact O-N 2.95Å; T831-T834 PolarHBondContact OG1-OG1 2.88Å; T831-V835 WeakPolarHBondContact O-CG2 3.27Å; T831-V835 PolarHBondContact O-N 2.96Å
832	L	70.3	Confident	81.7	Confident	59 Å²	59	63.6 Å²	63.6	31%	0.309	34%	0.339	S	S	.	.	H	α-helix	trans	-55.4	-45.1	-177.3	-179	63.8	0	0	0	113.8	T834 V835 Q836 L843 A846 I847 C850	L832-T834 PolarHBondContact O-N 2.83Å; L832-V835 PolarHBondContact O-N 2.82Å; L832-Q836 HydrophobicContact CD1-CG 4.13Å; L832-Q836 WeakPolarHBondContact O-CG 3.21Å; L832-Q836 PolarHBondContact O-N 2.83Å; L832-L843 HydrophobicContact CD2-CD1 4.42Å; L832-A846 HydrophobicContact CD1-CB 3.69Å; L832-I847 HydrophobicContact CD1-CG1 3.98Å; L832-I847 HydrophobicContact CD2-CG1 4.04Å; L832-C850 VanDerWaalsContact CA-SG 3.54Å
833	P	75.4	Confident	80.7	Confident	79 Å²	79	67.4 Å²	67.4	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-57.2	-47.5	171.9	-26.3	35.5	0	0	0	113.1	V835 Q836 E837	P833-V835 VanDerWaalsContact C-N 3.33Å; P833-V835 PolarHBondContact O-N 3.44Å; P833-Q836 PolarHBondContact O-N 3.46Å; P833-E837 WeakPolarHBondContact O-CB 3.46Å; P833-E837 WeakPolarHBondContact O-CG 3.38Å; P833-E837 PolarHBondContact O-N 3.27Å
834	T	78.5	Confident	79.7	Confident	52 Å²	52	66.6 Å²	66.6	32%	0.319	36%	0.364	S	S	.	.	H	α-helix	trans	-59.7	-43.5	178.2	-40	0	0	0	0	111.8	L830 T831 L832 Q836 C838	L830-T834 HydrophobicContact CD2-CG2 4.04Å; T831-T834 WeakPolarHBondContact O-CB 3.47Å; T831-T834 PolarHBondContact O-N 2.95Å; T831-T834 PolarHBondContact OG1-OG1 2.88Å; L832-T834 PolarHBondContact O-N 2.83Å; T834-Q836 VanDerWaalsContact C-N 3.34Å; T834-Q836 PolarHBondContact O-N 3.26Å; T834-C838 HydrophobicContact CG2-CB 4.43Å; T834-C838 WeakPolarHBondContact O-CB 3.41Å; T834-C838 PolarHBondContact O-N 3.16Å
835	V	81.8	Confident	79.3	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-68.5	-33.1	-179.8	172.6	0	0	0	0	111.5	L830 T831 L832 P833 M839 L841 A846 L849	L830-V835 HydrophobicContact CB-CG2 3.99Å; L830-V835 HydrophobicContact CD1-CG2 4.25Å; L830-V835 HydrophobicContact CD2-CG2 4.27Å; L830-V835 HydrophobicContact CG-CG2 4.4Å; T831-V835 WeakPolarHBondContact O-CG2 3.27Å; T831-V835 PolarHBondContact O-N 2.96Å; L832-V835 PolarHBondContact O-N 2.82Å; P833-V835 VanDerWaalsContact C-N 3.33Å; P833-V835 PolarHBondContact O-N 3.44Å; V835-M839 HydrophobicContact CG1-SD 4.35Å; V835-M839 HydrophobicContact CG2-CE 4.48Å; V835-M839 WeakPolarHBondContact O-CB 3.41Å; V835-L841 HydrophobicContact CG1-CD1 3.78Å; V835-A846 HydrophobicContact CG1-CB 3.93Å; V835-L849 HydrophobicContact CG1-CB 4.44Å; V835-L849 HydrophobicContact CG1-CD2 3.7Å; V835-L849 HydrophobicContact CG1-CG 4.27Å
836	Q	78.9	Confident	78.9	Confident	62 Å²	62	64.2 Å²	64.2	29%	0.29	36%	0.359	S	S	.	.	H	α-helix	trans	-76.2	-46.7	173.9	-69.8	-169.1	-108.1	0	0	112.9	L832 P833 T834 D840 L841 L843 A846	L832-Q836 HydrophobicContact CD1-CG 4.13Å; L832-Q836 WeakPolarHBondContact O-CG 3.21Å; L832-Q836 PolarHBondContact O-N 2.83Å; P833-Q836 PolarHBondContact O-N 3.46Å; T834-Q836 VanDerWaalsContact C-N 3.34Å; T834-Q836 PolarHBondContact O-N 3.26Å; Q836-D840 WeakPolarHBondContact O-CA 3.42Å; Q836-D840 PolarHBondContact O-N 3.04Å; Q836-L841 PolarHBondContact O-N 3.43Å; Q836-L843 VanDerWaalsContact OE1-CD1 3.27Å; Q836-A846 HydrophobicContact CG-CB 3.48Å; Q836-A846 VanDerWaalsContact CG-CB 3.48Å
837	E	74.3	Confident	78.1	Confident	166 Å²	166	66.6 Å²	66.6	78%	0.776	37%	0.365	S	S	*	.	H	α-helix	trans	-83.9	-33.3	-171	-66.6	-173.2	-171.4	0	0	114.2	P833	P833-E837 WeakPolarHBondContact O-CB 3.46Å; P833-E837 WeakPolarHBondContact O-CG 3.38Å; P833-E837 PolarHBondContact O-N 3.27Å
838	C	70.3	Confident	77.7	Confident	88 Å²	88	71.9 Å²	71.9	60%	0.595	39%	0.388	S	S	*	.	H	α-helix	trans	-92	-26.8	-178.4	-59.1	0	0	0	0	113.1	T834	T834-C838 HydrophobicContact CG2-CB 4.43Å; T834-C838 WeakPolarHBondContact O-CB 3.41Å; T834-C838 PolarHBondContact O-N 3.16Å
839	M	77.4	Confident	77.6	Confident	21 Å²	21	70.8 Å²	70.8	10%	0.103	38%	0.382	C	S	.	.	S	Bend	trans	-105.5	2.8	179.3	-50.9	-176.4	-175.8	0	0	113.9	I816 F817 I822 L830 V835 L841 L849	I816-M839 HydrophobicContact CG2-CB 4.11Å; I816-M839 HydrophobicContact CG2-CG 4Å; I816-M839 HydrophobicContact CG2-SD 4.2Å; F817-M839 HydrophobicContact CE1-CE 4.29Å; F817-M839 HydrophobicContact CE2-CE 4.36Å; F817-M839 HydrophobicContact CE2-SD 4.22Å; F817-M839 HydrophobicContact CZ-CE 3.93Å; F817-M839 HydrophobicContact CZ-SD 4.28Å; I822-M839 HydrophobicContact CD1-CE 3.41Å; I822-M839 VanDerWaalsContact CD1-CE 3.41Å; L830-M839 HydrophobicContact CD1-CE 3.56Å; L830-M839 HydrophobicContact CD2-CE 3.8Å; L830-M839 HydrophobicContact CG-CE 4.36Å; V835-M839 HydrophobicContact CG1-SD 4.35Å; V835-M839 HydrophobicContact CG2-CE 4.48Å; V835-M839 WeakPolarHBondContact O-CB 3.41Å; M839-L841 HydrophobicContact CB-CD1 3.91Å; M839-L841 HydrophobicContact CB-CG 3.79Å; M839-L841 PolarHBondContact O-N 3.49Å; M839-L841 HydrophobicContact SD-CD1 4.16Å; M839-L849 HydrophobicContact SD-CD2 4.08Å
840	D	80.1	Confident	77.5	Confident	152 Å²	152	64.7 Å²	64.7	81%	0.813	35%	0.352	S	S	*	.			trans	53.4	33.9	-176.8	-158	23.5	0	0	0	113.5	Q836	Q836-D840 WeakPolarHBondContact O-CA 3.42Å; Q836-D840 PolarHBondContact O-N 3.04Å
841	L	78.9	Confident	77.5	Confident	21 Å²	21	69.2 Å²	69.2	11%	0.11	37%	0.372	C	S	.	.			trans	-87.3	128.1	-175.7	-65.8	178.2	0	0	0	112.1	L813 I816 V835 Q836 M839 A846 L849	L813-L841 HydrophobicContact CD1-CD1 3.93Å; L813-L841 HydrophobicContact CD2-CD1 4.46Å; L813-L841 HydrophobicContact CD2-CD2 3.72Å; I816-L841 HydrophobicContact CD1-CD2 4.08Å; V835-L841 HydrophobicContact CG1-CD1 3.78Å; Q836-L841 PolarHBondContact O-N 3.43Å; M839-L841 HydrophobicContact CB-CD1 3.91Å; M839-L841 HydrophobicContact CB-CG 3.79Å; M839-L841 PolarHBondContact O-N 3.49Å; M839-L841 HydrophobicContact SD-CD1 4.16Å; L841-A846 HydrophobicContact CB-CB 4.02Å; L841-L849 HydrophobicContact CD1-CD2 3.74Å
842	K	77.1	Confident	77.9	Confident	174 Å²	174	67.4 Å²	67.4	76%	0.757	36%	0.359	S	S	*	.			trans	-58.7	146.9	169.5	-64.1	-179.1	-178.9	178.1	0	110	G844 P845 A846	K842-G844 VanDerWaalsContact C-N 3.3Å; K842-G844 PolarHBondContact O-N 2.92Å; K842-G844 VanDerWaalsContact O-N 3.11Å; K842-P845 WeakPolarHBondContact O-CD 3.3Å; K842-A846 PolarHBondContact O-N 3.26Å
843	L	67.8	Low	78.8	Confident	95 Å²	95	64.6 Å²	64.6	50%	0.497	35%	0.345	S	S	.	.	H	α-helix	trans	-48.5	-44	-171.5	-177.1	62.7	0	0	0	114.3	L832 Q836 A846 I847	L832-L843 HydrophobicContact CD2-CD1 4.42Å; Q836-L843 VanDerWaalsContact OE1-CD1 3.27Å; L843-A846 PolarHBondContact O-N 3.5Å; L843-I847 HydrophobicContact CD1-CD1 3.75Å; L843-I847 HydrophobicContact CD1-CG1 4.08Å; L843-I847 HydrophobicContact CG-CD1 3.78Å; L843-I847 HydrophobicContact CG-CG1 4.46Å; L843-I847 WeakPolarHBondContact O-CB 3.32Å; L843-I847 VanDerWaalsContact O-CG1 3.26Å; L843-I847 WeakPolarHBondContact O-CG1 3.27Å; L843-I847 PolarHBondContact O-N 3.17Å
844	G	71.4	Confident	79.3	Confident	43 Å²	43	65.3 Å²	65.3	44%	0.443	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-60.9	178.5	0	0	0	0	0	113.8	K842 A846 I847 K848	K842-G844 VanDerWaalsContact C-N 3.3Å; K842-G844 PolarHBondContact O-N 2.92Å; K842-G844 VanDerWaalsContact O-N 3.11Å; G844-A846 VanDerWaalsContact C-N 3.27Å; G844-A846 PolarHBondContact O-N 3.29Å; G844-I847 PolarHBondContact O-N 2.81Å; G844-K848 PolarHBondContact O-N 3.1Å; G844-K848 VanDerWaalsContact O-N 3.08Å
845	P	79.9	Confident	79.7	Confident	61 Å²	61	66.4 Å²	66.4	40%	0.396	34%	0.339	S	S	.	.	H	α-helix	trans	-53	-38.7	171.3	-30.9	35.6	0	0	0	114.7	K842 K848 L849	K842-P845 WeakPolarHBondContact O-CD 3.3Å; P845-K848 PolarHBondContact O-N 3.26Å; P845-L849 WeakPolarHBondContact O-CB 3.46Å; P845-L849 PolarHBondContact O-N 2.87Å
846	A	78.4	Confident	80	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-65.5	-44.9	177.8	0	0	0	0	0	112.3	L832 V835 Q836 L841 K842 L843 G844 K848 L849 C850	L832-A846 HydrophobicContact CD1-CB 3.69Å; V835-A846 HydrophobicContact CG1-CB 3.93Å; Q836-A846 HydrophobicContact CG-CB 3.48Å; Q836-A846 VanDerWaalsContact CG-CB 3.48Å; L841-A846 HydrophobicContact CB-CB 4.02Å; K842-A846 PolarHBondContact O-N 3.26Å; L843-A846 PolarHBondContact O-N 3.5Å; G844-A846 VanDerWaalsContact C-N 3.27Å; G844-A846 PolarHBondContact O-N 3.29Å; A846-K848 VanDerWaalsContact C-N 3.34Å; A846-K848 PolarHBondContact O-N 2.98Å; A846-L849 PolarHBondContact O-N 3.04Å; A846-C850 WeakPolarHBondContact O-CB 3.37Å; A846-C850 PolarHBondContact O-N 2.86Å; A846-C850 PolarHBondContact O-SG 3.44Å; A846-C850 VanDerWaalsContact O-SG 3.36Å
847	I	73.1	Confident	80.3	Confident	87 Å²	87	65 Å²	65	45%	0.446	33%	0.332	S	S	.	.	H	α-helix	trans	-60.4	-42.6	174.8	-72.3	168	0	0	0	111.1	L832 L843 G844 C850 H851	L832-I847 HydrophobicContact CD1-CG1 3.98Å; L832-I847 HydrophobicContact CD2-CG1 4.04Å; L843-I847 HydrophobicContact CD1-CD1 3.75Å; L843-I847 HydrophobicContact CD1-CG1 4.08Å; L843-I847 HydrophobicContact CG-CD1 3.78Å; L843-I847 HydrophobicContact CG-CG1 4.46Å; L843-I847 WeakPolarHBondContact O-CB 3.32Å; L843-I847 VanDerWaalsContact O-CG1 3.26Å; L843-I847 WeakPolarHBondContact O-CG1 3.27Å; L843-I847 PolarHBondContact O-N 3.17Å; G844-I847 PolarHBondContact O-N 2.81Å; I847-C850 PolarHBondContact O-N 2.86Å; I847-H851 WeakPolarHBondContact O-CB 3.4Å; I847-H851 PolarHBondContact O-N 3.09Å
848	K	80.5	Confident	80.6	Confident	112 Å²	112	63.5 Å²	63.5	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-46	176.2	-75.8	-169.4	161.6	-152	0	112.4	D809 G844 P845 A846 H851 H852	D809-K848 WeakPolarHBondContact OD2-CD 3.41Å; D809-K848 WeakPolarHBondContact OD2-CE 3.5Å; D809-K848 IonicContact OD2-NZ 4Å; D809-K848 PolarHBondContact OD2-NZ 2.86Å; G844-K848 PolarHBondContact O-N 3.1Å; G844-K848 VanDerWaalsContact O-N 3.08Å; P845-K848 PolarHBondContact O-N 3.26Å; A846-K848 VanDerWaalsContact C-N 3.34Å; A846-K848 PolarHBondContact O-N 2.98Å; K848-H851 WeakPolarHBondContact O-CB 3.12Å; K848-H851 PolarHBondContact O-N 3.32Å; K848-H852 PolarHBondContact O-CD2 3.07Å; K848-H852 VanDerWaalsContact O-CD2 3.25Å; K848-H852 PolarHBondContact O-N 3.32Å
849	L	86.4	Confident	81.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-45.8	178.5	177.7	55.3	0	0	0	111.3	I805 C810 L813 F817 V835 M839 L841 P845 A846 H851 H852 I853	I805-L849 HydrophobicContact CD1-CD1 3.82Å; C810-L849 HydrophobicContact CB-CD1 4.31Å; L813-L849 HydrophobicContact CD1-CB 4.09Å; L813-L849 HydrophobicContact CD1-CD2 3.8Å; L813-L849 HydrophobicContact CD1-CG 4.4Å; F817-L849 HydrophobicContact CE2-CD1 3.84Å; F817-L849 HydrophobicContact CE2-CD2 3.66Å; F817-L849 HydrophobicContact CE2-CG 4.35Å; F817-L849 HydrophobicContact CZ-CD1 3.77Å; F817-L849 HydrophobicContact CZ-CD2 3.78Å; F817-L849 HydrophobicContact CZ-CG 4.2Å; V835-L849 HydrophobicContact CG1-CB 4.44Å; V835-L849 HydrophobicContact CG1-CD2 3.7Å; V835-L849 HydrophobicContact CG1-CG 4.27Å; M839-L849 HydrophobicContact SD-CD2 4.08Å; L841-L849 HydrophobicContact CD1-CD2 3.74Å; P845-L849 WeakPolarHBondContact O-CB 3.46Å; P845-L849 PolarHBondContact O-N 2.87Å; A846-L849 PolarHBondContact O-N 3.04Å; L849-H851 VanDerWaalsContact C-N 3.33Å; L849-H851 PolarHBondContact O-N 2.91Å; L849-H852 PolarHBondContact O-N 3Å; L849-I853 HydrophobicContact CD1-CD1 4.05Å; L849-I853 HydrophobicContact CG-CD1 3.92Å; L849-I853 WeakPolarHBondContact O-CG1 3.49Å; L849-I853 PolarHBondContact O-N 2.59Å
850	C	83	Confident	81.6	Confident	13 Å²	13	59.3 Å²	59.3	9%	0.088	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-39	173.9	-70.1	0	0	0	0	112.5	L832 A846 I847 H852 I853 E854	L832-C850 VanDerWaalsContact CA-SG 3.54Å; A846-C850 WeakPolarHBondContact O-CB 3.37Å; A846-C850 PolarHBondContact O-N 2.86Å; A846-C850 PolarHBondContact O-SG 3.44Å; A846-C850 VanDerWaalsContact O-SG 3.36Å; I847-C850 PolarHBondContact O-N 2.86Å; C850-H852 VanDerWaalsContact C-N 3.34Å; C850-H852 PolarHBondContact O-N 3.08Å; C850-I853 CarbonylContact O-C 3.53Å; C850-I853 PolarHBondContact O-N 3.08Å; C850-I853 VanDerWaalsContact O-N 3.12Å; C850-E854 WeakPolarHBondContact O-CG 3.43Å; C850-E854 PolarHBondContact O-N 3.47Å
851	H	84	Confident	81.5	Confident	109 Å²	109	59.3 Å²	59.3	51%	0.505	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-41.2	177	176.8	70.7	0	0	0	112.6	I847 K848 L849 R855	I847-H851 WeakPolarHBondContact O-CB 3.4Å; I847-H851 PolarHBondContact O-N 3.09Å; K848-H851 WeakPolarHBondContact O-CB 3.12Å; K848-H851 PolarHBondContact O-N 3.32Å; L849-H851 VanDerWaalsContact C-N 3.33Å; L849-H851 PolarHBondContact O-N 2.91Å; H851-R855 WeakPolarHBondContact O-CG 3.39Å; H851-R855 PolarHBondContact O-N 3.29Å; H851-R855 VanDerWaalsContact O-N 3.12Å
852	H	87.8	Confident	81.6	Confident	22 Å²	22	61.6 Å²	61.6	10%	0.102	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-40.7	172.8	-66.6	-62.2	0	0	0	111.9	T808 D809 K848 L849 C850 E854 R855 I856	T808-H852 HydrophobicContact CG2-CB 4.39Å; D809-H852 IonicContact OD1-CD2 3.95Å; D809-H852 IonicContact OD1-CE1 3.2Å; D809-H852 IonicContact OD1-NE2 2.75Å; D809-H852 PolarHBondContact OD1-NE2 3.25Å; K848-H852 PolarHBondContact O-CD2 3.07Å; K848-H852 VanDerWaalsContact O-CD2 3.25Å; K848-H852 PolarHBondContact O-N 3.32Å; L849-H852 PolarHBondContact O-N 3Å; C850-H852 VanDerWaalsContact C-N 3.34Å; C850-H852 PolarHBondContact O-N 3.08Å; H852-E854 PolarHBondContact O-N 3.38Å; H852-R855 WeakPolarHBondContact O-CB 3.42Å; H852-R855 PolarHBondContact O-N 2.84Å; H852-R855 VanDerWaalsContact O-N 3.13Å; H852-I856 WeakPolarHBondContact O-CG1 3.16Å; H852-I856 PolarHBondContact O-N 3.05Å
853	I	89.8	Confident	81.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.5	-42.3	176.4	-68.2	162.4	0	0	0	111.4	L827 L830 L849 C850 R855 I856 K857	L827-I853 HydrophobicContact CD1-CD1 4.15Å; L827-I853 HydrophobicContact CD1-CG1 3.8Å; L827-I853 HydrophobicContact CG-CG1 4.49Å; L827-I853 WeakPolarHBondContact O-CG2 3.42Å; L830-I853 HydrophobicContact CB-CD1 4Å; L830-I853 HydrophobicContact CD1-CD1 3.82Å; L849-I853 HydrophobicContact CD1-CD1 4.05Å; L849-I853 HydrophobicContact CG-CD1 3.92Å; L849-I853 WeakPolarHBondContact O-CG1 3.49Å; L849-I853 PolarHBondContact O-N 2.59Å; C850-I853 CarbonylContact O-C 3.53Å; C850-I853 PolarHBondContact O-N 3.08Å; C850-I853 VanDerWaalsContact O-N 3.12Å; I853-R855 VanDerWaalsContact C-N 3.35Å; I853-R855 PolarHBondContact O-N 3.2Å; I853-I856 PolarHBondContact O-N 2.74Å; I853-K857 HydrophobicContact CG2-CD 4.15Å; I853-K857 WeakPolarHBondContact O-CG 3.37Å; I853-K857 PolarHBondContact O-N 2.99Å
854	E	85.9	Confident	82.2	Confident	94 Å²	94	54.8 Å²	54.8	44%	0.439	26%	0.262	S	S	.	.	H	α-helix	trans	-66.1	-33.8	174.4	-62.1	-45.8	131.4	0	0	112.5	C850 H852 K857 F858	C850-E854 WeakPolarHBondContact O-CG 3.43Å; C850-E854 PolarHBondContact O-N 3.47Å; H852-E854 PolarHBondContact O-N 3.38Å; E854-K857 PolarHBondContact O-N 3.1Å; E854-K857 IonicContact OE1-NZ 3.97Å; E854-K857 PolarHBondContact OE1-NZ 2.86Å; E854-K857 WeakPolarHBondContact OE2-CD 3.4Å; E854-K857 IonicContact OE2-NZ 2.9Å; E854-F858 WeakPolarHBondContact O-CB 3.32Å; E854-F858 PolarHBondContact O-N 2.92Å
855	R	87.3	Confident	81.8	Confident	75 Å²	75	55.1 Å²	55.1	28%	0.283	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-37.2	171.3	-70.8	177.1	76.6	-156.6	8.4	112.2	E785 L787 H851 H852 I853 A859	E785-R855 PolarHBondContact O-NH2 3.46Å; L787-R855 HydrophobicContact CB-CB 4.49Å; L787-R855 HydrophobicContact CD2-CB 3.94Å; H851-R855 WeakPolarHBondContact O-CG 3.39Å; H851-R855 PolarHBondContact O-N 3.29Å; H851-R855 VanDerWaalsContact O-N 3.12Å; H852-R855 WeakPolarHBondContact O-CB 3.42Å; H852-R855 PolarHBondContact O-N 2.84Å; H852-R855 VanDerWaalsContact O-N 3.13Å; I853-R855 VanDerWaalsContact C-N 3.35Å; I853-R855 PolarHBondContact O-N 3.2Å; R855-A859 VanDerWaalsContact O-CB 3.27Å; R855-A859 WeakPolarHBondContact O-CB 3.33Å; R855-A859 PolarHBondContact O-N 3.24Å
856	I	87.9	Confident	80.1	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-45.9	173.7	-58.1	163.5	0	0	0	110.3	L787 L789 P793 W796 F804 L827 L828 H852 I853 F858 A859 F860	L787-I856 HydrophobicContact CD2-CG1 4.11Å; L789-I856 HydrophobicContact CD1-CG2 4.23Å; P793-I856 HydrophobicContact CB-CG2 4.1Å; P793-I856 HydrophobicContact CG-CG2 3.68Å; W796-I856 HydrophobicContact CH2-CG2 4.29Å; W796-I856 HydrophobicContact CZ3-CD1 4.33Å; W796-I856 HydrophobicContact CZ3-CG2 4.26Å; F804-I856 HydrophobicContact CD1-CD1 3.72Å; F804-I856 HydrophobicContact CD1-CG1 4.47Å; F804-I856 HydrophobicContact CE1-CD1 3.36Å; F804-I856 HydrophobicContact CE1-CG1 3.8Å; F804-I856 HydrophobicContact CE2-CD1 4.43Å; F804-I856 HydrophobicContact CE2-CG1 4.19Å; F804-I856 HydrophobicContact CG-CD1 4.43Å; F804-I856 HydrophobicContact CZ-CD1 3.76Å; F804-I856 HydrophobicContact CZ-CG1 3.63Å; L827-I856 HydrophobicContact CD2-CD1 3.74Å; L827-I856 HydrophobicContact CG-CD1 4.45Å; L828-I856 HydrophobicContact CD2-CG2 4.22Å; H852-I856 WeakPolarHBondContact O-CG1 3.16Å; H852-I856 PolarHBondContact O-N 3.05Å; I853-I856 PolarHBondContact O-N 2.74Å; I856-F858 PolarHBondContact O-N 2.73Å; I856-A859 PolarHBondContact O-N 2.9Å; I856-F860 VanDerWaalsContact O-CB 3.27Å; I856-F860 WeakPolarHBondContact O-CB 3.25Å; I856-F860 PolarHBondContact O-N 2.72Å
857	K	85.3	Confident	80.2	Confident	31 Å²	31	65.2 Å²	65.2	14%	0.135	31%	0.309	C	S	.	.	H	α-helix	trans	-55.4	-52.1	175.8	-74	163.8	174.9	174.5	0	111.1	L828 L830 I853 E854 A859 F860 Y861	L828-K857 HydrophobicContact CD2-CB 4.29Å; L828-K857 HydrophobicContact CD2-CG 3.53Å; L828-K857 WeakPolarHBondContact O-CE 3.28Å; L830-K857 PolarHBondContact O-NZ 3.41Å; I853-K857 HydrophobicContact CG2-CD 4.15Å; I853-K857 WeakPolarHBondContact O-CG 3.37Å; I853-K857 PolarHBondContact O-N 2.99Å; E854-K857 PolarHBondContact O-N 3.1Å; E854-K857 IonicContact OE1-NZ 3.97Å; E854-K857 PolarHBondContact OE1-NZ 2.86Å; E854-K857 WeakPolarHBondContact OE2-CD 3.4Å; E854-K857 IonicContact OE2-NZ 2.9Å; K857-A859 PolarHBondContact O-N 3.36Å; K857-F860 WeakPolarHBondContact O-CB 3.35Å; K857-F860 PolarHBondContact O-N 3.38Å; K857-Y861 WeakPolarHBondContact O-CD2 3.46Å; K857-Y861 PolarHBondContact O-N 2.92Å
858	F	81.2	Confident	80.6	Confident	136 Å²	136	64.1 Å²	64.1	60%	0.596	30%	0.302	S	S	*	.	H	α-helix	trans	-59.2	-47.8	179.3	-173.4	-86.4	0	0	0	111.9	E854 I856 F860 Y861 E862	E854-F858 WeakPolarHBondContact O-CB 3.32Å; E854-F858 PolarHBondContact O-N 2.92Å; I856-F858 PolarHBondContact O-N 2.73Å; F858-F860 VanDerWaalsContact C-N 3.35Å; F858-F860 PolarHBondContact O-N 2.93Å; F858-Y861 PolarHBondContact O-N 2.83Å; F858-E862 WeakPolarHBondContact O-CB 3.37Å; F858-E862 PolarHBondContact O-N 3.05Å
859	A	81.4	Confident	80.6	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-34.4	178.4	0	0	0	0	0	113	L787 L789 R855 I856 K857 E862 Q863	L787-A859 HydrophobicContact CB-CB 4.33Å; L787-A859 WeakPolarHBondContact O-CB 3.43Å; L789-A859 HydrophobicContact CD1-CB 3.56Å; L789-A859 HydrophobicContact CG-CB 3.75Å; R855-A859 VanDerWaalsContact O-CB 3.27Å; R855-A859 WeakPolarHBondContact O-CB 3.33Å; R855-A859 PolarHBondContact O-N 3.24Å; I856-A859 PolarHBondContact O-N 2.9Å; K857-A859 PolarHBondContact O-N 3.36Å; A859-E862 PolarHBondContact O-N 2.88Å; A859-Q863 WeakPolarHBondContact O-CB 3.4Å; A859-Q863 WeakPolarHBondContact O-CG 3.41Å; A859-Q863 PolarHBondContact O-N 3.05Å
860	F	86.6	Confident	80.2	Confident	20 Å²	20	65 Å²	65	9%	0.088	31%	0.309	C	S	.	.	H	α-helix	trans	-61.4	-48	171.4	160.8	-106.9	0	0	0	111.3	N792 P793 L794 L828 I856 K857 F858 Q863 F864 A865	N792-F860 WeakPolarHBondContact OD1-CE2 3.41Å; P793-F860 HydrophobicContact CG-CB 4.21Å; L794-F860 HydrophobicContact CD1-CE2 3.7Å; L794-F860 HydrophobicContact CD1-CZ 3.54Å; L794-F860 HydrophobicContact CG-CE2 3.85Å; L794-F860 HydrophobicContact CG-CZ 3.93Å; L828-F860 HydrophobicContact CD1-CD1 4.23Å; L828-F860 HydrophobicContact CD1-CE1 4.46Å; L828-F860 HydrophobicContact CD1-CG 4.4Å; I856-F860 VanDerWaalsContact O-CB 3.27Å; I856-F860 WeakPolarHBondContact O-CB 3.25Å; I856-F860 PolarHBondContact O-N 2.72Å; K857-F860 WeakPolarHBondContact O-CB 3.35Å; K857-F860 PolarHBondContact O-N 3.38Å; F858-F860 VanDerWaalsContact C-N 3.35Å; F858-F860 PolarHBondContact O-N 2.93Å; F860-Q863 PolarHBondContact O-N 3.11Å; F860-F864 HydrophobicContact CD2-CB 3.93Å; F860-F864 HydrophobicContact CE2-CB 4.11Å; F860-F864 WeakPolarHBondContact O-CA 3.48Å; F860-F864 PolarHBondContact O-N 3Å; F860-A865 HydrophobicContact CE1-CB 4.35Å; F860-A865 HydrophobicContact CZ-CB 4.22Å; F860-A865 PolarHBondContact O-N 2.93Å
861	Y	78.4	Confident	80	Confident	152 Å²	152	68.3 Å²	68.3	60%	0.596	32%	0.323	S	S	*	.	H	α-helix	trans	-64.2	-40.9	176.7	-72.6	-64.5	0	0	0	112.4	K857 F858 Q863 A865	K857-Y861 WeakPolarHBondContact O-CD2 3.46Å; K857-Y861 PolarHBondContact O-N 2.92Å; F858-Y861 PolarHBondContact O-N 2.83Å; Y861-Q863 PolarHBondContact O-N 2.71Å; Y861-A865 HydrophobicContact CD1-CB 3.77Å
862	E	79.7	Confident	79.8	Confident	69 Å²	69	65.5 Å²	65.5	32%	0.322	31%	0.31	S	S	.	.	H	α-helix	trans	-67	-32.4	178.8	-171.6	178.5	-147.2	0	0	113.1	R786 F858 A859	R786-E862 IonicContact CZ-OE1 3.69Å; R786-E862 IonicContact NH1-OE1 3.99Å; R786-E862 PolarHBondContact NH1-OE1 3.03Å; F858-E862 WeakPolarHBondContact O-CB 3.37Å; F858-E862 PolarHBondContact O-N 3.05Å; A859-E862 PolarHBondContact O-N 2.88Å
863	Q	81.8	Confident	79.2	Confident	51 Å²	51	68.6 Å²	68.6	24%	0.238	33%	0.325	C	S	.	.	H	α-helix	trans	-114.6	-18.3	-166.3	-62.8	156.8	45.7	0	0	114.6	L787 H788 A859 F860 Y861	L787-Q863 PolarHBondContact O-NE2 2.8Å; H788-Q863 PolarHBondContact ND1-OE1 3.24Å; A859-Q863 WeakPolarHBondContact O-CB 3.4Å; A859-Q863 WeakPolarHBondContact O-CG 3.41Å; A859-Q863 PolarHBondContact O-N 3.05Å; F860-Q863 PolarHBondContact O-N 3.11Å; Y861-Q863 PolarHBondContact O-N 2.71Å
864	F	76	Confident	78.4	Confident	75 Å²	75	73.9 Å²	73.9	33%	0.329	35%	0.35	S	S	.	.	H	α-helix	trans	-142.1	5.9	-171	-59.4	-70.9	0	0	0	116.1	L789 N792 F860	L789-F864 HydrophobicContact CB-CE2 4.01Å; N792-F864 HydrophobicContact CB-CB 4.25Å; N792-F864 HydrophobicContact CB-CD1 3.79Å; N792-F864 HydrophobicContact CB-CD2 4.12Å; N792-F864 HydrophobicContact CB-CE1 4.12Å; N792-F864 HydrophobicContact CB-CE2 4.42Å; N792-F864 HydrophobicContact CB-CG 3.79Å; N792-F864 HydrophobicContact CB-CZ 4.43Å; F860-F864 HydrophobicContact CD2-CB 3.93Å; F860-F864 HydrophobicContact CE2-CB 4.11Å; F860-F864 WeakPolarHBondContact O-CA 3.48Å; F860-F864 PolarHBondContact O-N 3Å
865	A	63.1	Low	77.8	Confident	50 Å²	50	72.3 Å²	72.3	41%	0.413	34%	0.343	S	S	.	.			trans	-123.1	27.1	-177	0	0	0	0	0	114.3	F860 Y861	F860-A865 HydrophobicContact CE1-CB 4.35Å; F860-A865 HydrophobicContact CZ-CB 4.22Å; F860-A865 PolarHBondContact O-N 2.93Å; Y861-A865 HydrophobicContact CD1-CB 3.77Å
866	N	44.4	Very low	76.9	Confident	207 Å²	207	72 Å²	72	100%	1.107	35%	0.348	S	S	*	.			trans	-110.3	0	167.4	-62.2	-74.5	0	0	0	109.5

Retrieved 866 of 866 residues in 399.9 ms (Link to these results)

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