A0A061IDV8_CRIGR Loading...

Tetratricopeptide repeat domain 13

AlphaFold DB , UniProt , Accession A0A061IDV8, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ttc13, Length 846 aa.

						>A0A061IDV8_CRIGR|A0A061IDV8|Ttc13
MAPAGRDCGCWGGSGAGVVLSLLLLLLGALACARATEHYSPLSLLKQELQHRQQQDASAGGGCSQSGDWADQYPECESSFLNFHESDCELRGSAPCDSLLSLNTEKILSQAKSIAEQKRFPFATDNDSTNEELAIAYVLVGSGLYDEAIRHFSTMLQEEPDLVSAIYGRGIAYGKKGLHDIKNAELALFELSRVIALEPDRPEVFEQRAEILSPLGRINEAVNDLTKAIQLQPSARLYRHRGTLYFISEDYATAHEDFEQSLELNRNQPTAMLYKGLTFFHRGLLKEAIEAFKEALKQKVDFIDAYKSLGQAYRELGNFEAATESFQKALLLNQNHVQTLQLRGMMLYHHGSLQEALKNFKRCLQLEPYNEVCQYMKGLSHVAMGQFYEGIKAQTKVMLNDPLPGQKASPEYLRVKYLREYSRYLHAHLDTPLTEYNIDTDLPGSFKDHWAKNLPFLIDGYEEQPGLQPHIKDVLHQNFEGYRPEVQEMICVADRLGSLMQYETPGFLPNKRIHRAMGLAALEVMQAVHRTWTNSKVRMNGKTRLMQWRDMFDIAVKWRRIADPDQPVLWLDQMPARSLSRGFNNHINLIRGQVINMRYLEYFEKILHFIKDRILVYHGANNPKGLLEVREALEKVHKVEDLLPIMKQFNTKTKDGFTVNTKVPSLKDQGKEYDGFTITITGDKVGNILFSVETQTTEERTQLYHAEIDALYKDLTAKGKVLILSSEFGEADAVCNLILSLVYYFYNLMPLSRGSSVIAYSVIVGALMASGKEVAGKIPKGKLVDFEAMTAPGSEAFSKIAKSWMNLKSISPSYKTLPSVSETFPTLRSMMEVLNTDSTPRCLKKL
					

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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	29.2	Very low	23.7	Very low	251 Å²	251	152.6 Å²	152.6	100%	1.236	90%	0.903	S	S	*	*				0	108	0	-82.2	171.7	165.9	0	0	107.8
2	A	26.6	Very low	23.6	Very low	94 Å²	94	146.5 Å²	146.5	78%	0.777	90%	0.895	S	S	*	*			trans	-92.7	159.2	161	0	0	0	0	0	108.4
3	P	31	Very low	23.9	Very low	126 Å²	126	141.5 Å²	141.5	82%	0.818	89%	0.891	S	S	*	*				-139.3	151.1	91	28.5	-9.3	0	0	0	112
4	A	22.5	Very low	24.1	Very low	102 Å²	102	140.4 Å²	140.4	84%	0.843	89%	0.89	S	S	*	*			cis	93.4	120.2	41.6	0	0	0	0	0	115
5	G	23	Very low	24.2	Very low	80 Å²	80	135.9 Å²	135.9	83%	0.825	88%	0.882	S	S	*	*			trans	117.3	127.4	161	0	0	0	0	0	114.2
6	R	22	Very low	24.4	Very low	251 Å²	251	132.2 Å²	132.2	95%	0.947	87%	0.866	S	S	*	*			cis	-159.9	150.8	15.1	-101.4	176	173	177	-1.9	110.3
7	D	21.3	Very low	24.6	Very low	162 Å²	162	127.4 Å²	127.4	87%	0.866	85%	0.845	S	S	*	*			trans	-67.3	149.1	170.8	-71.4	-53.1	0	0	0	114.4
8	C	21.8	Very low	24.7	Very low	137 Å²	137	126.3 Å²	126.3	93%	0.926	84%	0.835	S	S	*	*			trans	-157.4	117.3	139.9	-113.6	0	0	0	0	108.4
9	G	20.1	Very low	25	Very low	74 Å²	74	124.3 Å²	124.3	76%	0.763	82%	0.819	S	S	*	*			trans	-86.1	158	-176.1	0	0	0	0	0	114.5
10	C	21.7	Very low	25.1	Very low	136 Å²	136	124 Å²	124	92%	0.919	81%	0.809	S	S	*	*			trans	-156.3	130.4	147.3	-103.2	0	0	0	0	108.8
11	W	22.1	Very low	25.2	Very low	266 Å²	266	121.4 Å²	121.4	100%	1.008	79%	0.794	S	S	*	*			trans	-60.6	147.2	176	-76.6	-6.1	0	0	0	113.3
12	G	22.7	Very low	25	Very low	79 Å²	79	114.4 Å²	114.4	81%	0.814	76%	0.761	S	S	*	*			trans	160.9	84.2	160.5	0	0	0	0	0	115.8
13	G	27.6	Very low	25	Very low	82 Å²	82	114.6 Å²	114.6	85%	0.845	75%	0.748	S	S	*	*			trans	67.2	99	145.1	0	0	0	0	0	119.7
14	S	25.5	Very low	24.8	Very low	125 Å²	125	114.2 Å²	114.2	87%	0.874	74%	0.739	S	S	*	*			trans	-150.4	66.7	155.8	65.5	0	0	0	0	111.6
15	G	26.9	Very low	24.9	Very low	74 Å²	74	115.5 Å²	115.5	76%	0.763	73%	0.731	S	S	*	*			trans	-102.2	12.1	174.2	0	0	0	0	0	114.8
16	A	26.9	Very low	25	Very low	76 Å²	76	117 Å²	117	63%	0.628	72%	0.719	S	S	*	*	S	Bend	trans	-112.8	-15.5	-171.9	0	0	0	0	0	115.2
17	G	27.1	Very low	25.1	Very low	50 Å²	50	110.5 Å²	110.5	52%	0.515	70%	0.703	S	S	.	*	H	α-helix	trans	-84.1	-26.3	-174.2	0	0	0	0	0	115.7	S21	G17-S21 PolarHBondContact O-OG 3.27Å
18	V	27.5	Very low	25.2	Very low	108 Å²	108	104.6 Å²	104.6	66%	0.655	68%	0.68	S	S	*	*	H	α-helix	trans	-87.1	-28	-176.2	-178.1	0	0	0	0	111.8	L22	V18-L22 HydrophobicContact CG1-CD1 4.17Å; V18-L22 PolarHBondContact O-N 3.48Å
19	V	29	Very low	25.2	Very low	88 Å²	88	101.5 Å²	101.5	53%	0.533	66%	0.664	S	S	.	*	H	α-helix	trans	-75.4	-35.6	177.7	179.7	0	0	0	0	111.5	S21 L23	V19-S21 PolarHBondContact O-N 3.12Å; V19-L23 HydrophobicContact CG1-CD1 3.78Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 PolarHBondContact O-N 3.11Å
20	L	28.2	Very low	25.4	Very low	118 Å²	118	105 Å²	105	62%	0.618	66%	0.664	S	S	*	*	H	α-helix	trans	-67.3	-36.7	176.2	-126.6	88.7	0	0	0	112.4	L23 L24	L20-L23 PolarHBondContact O-N 2.98Å; L20-L24 WeakPolarHBondContact O-CB 3.37Å; L20-L24 WeakPolarHBondContact O-CD1 3.44Å; L20-L24 PolarHBondContact O-N 3.39Å
21	S	26.1	Very low	25.5	Very low	71 Å²	71	100.7 Å²	100.7	50%	0.497	64%	0.639	S	S	.	*	H	α-helix	trans	-71.6	-34.8	-179.6	-54.6	0	0	0	0	112.3	G17 V19 L25	G17-S21 PolarHBondContact O-OG 3.27Å; V19-S21 PolarHBondContact O-N 3.12Å; S21-L25 WeakPolarHBondContact O-CD1 3.49Å; S21-L25 PolarHBondContact O-N 3.18Å
22	L	25.6	Very low	25.4	Very low	103 Å²	103	93.4 Å²	93.4	54%	0.539	63%	0.628	S	S	.	*	H	α-helix	trans	-75.5	-33.4	174.1	-94.5	143.3	0	0	0	112.8	V18 L25 L26	V18-L22 HydrophobicContact CG1-CD1 4.17Å; V18-L22 PolarHBondContact O-N 3.48Å; L22-L25 PolarHBondContact O-N 3.19Å; L22-L26 WeakPolarHBondContact O-CB 3.49Å; L22-L26 PolarHBondContact O-N 3.01Å
23	L	26.6	Very low	25.5	Very low	98 Å²	98	92.1 Å²	92.1	51%	0.513	61%	0.609	S	S	.	*	H	α-helix	trans	-70.1	-36.1	172.5	-98.9	135.7	0	0	0	112.7	V19 L20 L26 L27	V19-L23 HydrophobicContact CG1-CD1 3.78Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 PolarHBondContact O-N 3.11Å; L20-L23 PolarHBondContact O-N 2.98Å; L23-L26 PolarHBondContact O-N 3.41Å; L23-L27 WeakPolarHBondContact O-CB 3.1Å; L23-L27 WeakPolarHBondContact O-CD1 3.36Å; L23-L27 WeakPolarHBondContact O-CG 3.36Å; L23-L27 PolarHBondContact O-N 3.29Å
24	L	27	Very low	25.5	Very low	118 Å²	118	96.1 Å²	96.1	62%	0.618	60%	0.599	S	S	*	*	H	α-helix	trans	-68.9	-32.7	173.3	-84.9	154.7	0	0	0	112.7	L20 G28	L20-L24 WeakPolarHBondContact O-CB 3.37Å; L20-L24 WeakPolarHBondContact O-CD1 3.44Å; L20-L24 PolarHBondContact O-N 3.39Å; L24-G28 PolarHBondContact O-N 3.01Å
25	L	24.8	Very low	25.4	Very low	129 Å²	129	93.2 Å²	93.2	68%	0.675	58%	0.582	S	S	*	*	H	α-helix	trans	-73.3	-34.7	172.9	-85.1	158.7	0	0	0	112.8	S21 L22 G28 A29	S21-L25 WeakPolarHBondContact O-CD1 3.49Å; S21-L25 PolarHBondContact O-N 3.18Å; L22-L25 PolarHBondContact O-N 3.19Å; L25-G28 PolarHBondContact O-N 3.31Å; L25-A29 PolarHBondContact O-N 2.73Å; L25-A29 VanDerWaalsContact O-N 3.08Å
26	L	23.8	Very low	25.3	Very low	112 Å²	112	94.3 Å²	94.3	59%	0.586	57%	0.574	S	S	*	*	H	α-helix	trans	-72.6	-36.6	174	-89	152.3	0	0	0	112.5	L22 L23 A29 L30	L22-L26 WeakPolarHBondContact O-CB 3.49Å; L22-L26 PolarHBondContact O-N 3.01Å; L23-L26 PolarHBondContact O-N 3.41Å; L26-A29 PolarHBondContact O-N 3.11Å; L26-L30 PolarHBondContact O-N 3.12Å
27	L	25.4	Very low	25.3	Very low	115 Å²	115	94.7 Å²	94.7	60%	0.602	56%	0.563	S	S	*	*	H	α-helix	trans	-71.1	-30.2	171.4	-76.3	160.6	0	0	0	112.4	L23	L23-L27 WeakPolarHBondContact O-CB 3.1Å; L23-L27 WeakPolarHBondContact O-CD1 3.36Å; L23-L27 WeakPolarHBondContact O-CG 3.36Å; L23-L27 PolarHBondContact O-N 3.29Å
28	G	23.2	Very low	25.6	Very low	38 Å²	38	96.1 Å²	96.1	39%	0.392	56%	0.556	S	S	.	*	H	α-helix	trans	-70.9	-30.7	172.9	0	0	0	0	0	114.3	L24 L25 C32	L24-G28 PolarHBondContact O-N 3.01Å; L25-G28 PolarHBondContact O-N 3.31Å; G28-C32 PolarHBondContact O-SG 3.28Å; G28-C32 VanDerWaalsContact O-SG 3.34Å
29	A	21.9	Very low	26.1	Very low	72 Å²	72	95.3 Å²	95.3	60%	0.595	54%	0.542	S	S	*	.	H	α-helix	trans	-75.1	-32.4	179.2	0	0	0	0	0	113.2	L25 L26 A31	L25-A29 PolarHBondContact O-N 2.73Å; L25-A29 VanDerWaalsContact O-N 3.08Å; L26-A29 PolarHBondContact O-N 3.11Å; A29-A31 VanDerWaalsContact C-N 3.3Å; A29-A31 PolarHBondContact O-N 3.05Å
30	L	23.5	Very low	26.1	Very low	146 Å²	146	94 Å²	94	76%	0.764	54%	0.537	S	S	*	.	H	α-helix	trans	-71.5	-20.3	178	-87.8	145.6	0	0	0	113.7	L26	L26-L30 PolarHBondContact O-N 3.12Å
31	A	23.9	Very low	26.3	Very low	46 Å²	46	88.9 Å²	88.9	38%	0.38	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-6.8	-177.3	0	0	0	0	0	115	A29 A33	A29-A31 VanDerWaalsContact C-N 3.3Å; A29-A31 PolarHBondContact O-N 3.05Å; A31-A33 VanDerWaalsContact C-N 3.34Å; A31-A33 PolarHBondContact O-N 3.12Å
32	C	21.1	Very low	26.4	Very low	114 Å²	114	90.5 Å²	90.5	77%	0.77	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	3.2	-167.1	-87.2	0	0	0	0	116.7	G28	G28-C32 PolarHBondContact O-SG 3.28Å; G28-C32 VanDerWaalsContact O-SG 3.34Å
33	A	23.4	Very low	26.7	Very low	51 Å²	51	87.7 Å²	87.7	42%	0.421	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	10.4	-174.1	0	0	0	0	0	115.5	A31 A35 R591	A31-A33 VanDerWaalsContact C-N 3.34Å; A31-A33 PolarHBondContact O-N 3.12Å; A33-A35 PolarHBondContact O-N 3.37Å; A33-R591 VanDerWaalsContact C-NH2 3.31Å; A33-R591 VanDerWaalsContact CB-NH1 3.33Å; A33-R591 PolarHBondContact O-NH1 3.49Å; A33-R591 PolarHBondContact O-NH2 2.65Å
34	R	28.8	Very low	27.1	Very low	167 Å²	167	84.7 Å²	84.7	63%	0.63	49%	0.486	S	S	*	.			trans	-75.9	62.6	-179.2	-73.8	-176.5	164.6	161	-8	113.8	E249	R34-E249 IonicContact CZ-OE2 3.68Å; R34-E249 IonicContact NE-OE2 2.81Å; R34-E249 IonicContact NH2-OE1 2.77Å; R34-E249 IonicContact NH2-OE2 2.65Å; R34-E249 PolarHBondContact NH2-OE2 3.34Å
35	A	22.9	Very low	27.4	Very low	64 Å²	64	80.2 Å²	80.2	53%	0.529	46%	0.462	S	S	.	.			trans	-120.7	75.5	174.5	0	0	0	0	0	111	A33	A33-A35 PolarHBondContact O-N 3.37Å
36	T	24.7	Very low	27.6	Very low	97 Å²	97	80.6 Å²	80.6	60%	0.595	46%	0.459	S	S	*	.	S	Bend	trans	-126.3	146.8	149.2	45.1	0	0	0	0	106.5	H38	T36-H38 PolarHBondContact O-N 3.35Å; T36-H38 PolarHBondContact OG1-CD2 2.81Å
37	E	27.6	Very low	28.1	Very low	84 Å²	84	78.1 Å²	78.1	39%	0.393	44%	0.444	S	S	.	.	S	Bend	trans	-62.4	73.1	177.2	-66.3	179.6	162.3	0	0	110.5	R314 M345	E37-R314 IonicContact OE2-CZ 3.9Å; E37-R314 IonicContact OE2-NH1 3.12Å; E37-R314 IonicContact OE2-NH2 3.68Å; E37-R314 PolarHBondContact OE2-NH2 3.49Å; E37-R314 VanDerWaalsContact OE2-NH2 3.09Å; E37-M345 VanDerWaalsContact CD-CE 3.46Å; E37-M345 VanDerWaalsContact OE1-CE 3.29Å; E37-M345 WeakPolarHBondContact OE1-CE 3.49Å; E37-M345 WeakPolarHBondContact OE2-CE 3.45Å
38	H	31.6	Very low	28.3	Very low	79 Å²	79	75.6 Å²	75.6	37%	0.366	43%	0.429	S	S	.	.			trans	-121.8	113.1	177.2	-68.8	-6.3	0	0	0	107.3	T36	T36-H38 PolarHBondContact O-N 3.35Å; T36-H38 PolarHBondContact OG1-CD2 2.81Å
39	Y	37.9	Very low	28.8	Very low	92 Å²	92	76.7 Å²	76.7	36%	0.361	43%	0.426	S	S	.	.			trans	-55.6	139.5	168.1	-71.7	-91.3	0	0	0	109.1	Q341 L342	Y39-Q341 PolarHBondContact OH-NE2 3.24Å; Y39-Q341 PolarHBondContact OH-OE1 3.4Å; Y39-L342 HydrophobicContact CE2-CD2 4.18Å
40	S	30.3	Very low	29.1	Very low	61 Å²	61	78.5 Å²	78.5	43%	0.427	42%	0.422	S	S	.	.			trans	-60.7	131	179.3	63.4	0	0	0	0	110.2	L42 S43	S40-L42 PolarHBondContact O-N 3.35Å; S40-S43 PolarHBondContact O-N 3.03Å; S40-S43 PolarHBondContact O-OG 2.87Å; S40-S43 PolarHBondContact OG-N 2.59Å
41	P	31.8	Very low	29.4	Very low	10 Å²	10	77 Å²	77	7%	0.065	41%	0.411	C	S	.	.	H	α-helix	trans	-50.2	-26.3	169.5	-28.4	35	0	0	0	113.5	S43 L44 L45 F246 I247	P41-S43 VanDerWaalsContact C-N 3.33Å; P41-S43 PolarHBondContact O-N 3.01Å; P41-L44 WeakPolarHBondContact O-CB 3.36Å; P41-L44 PolarHBondContact O-N 3.21Å; P41-L45 PolarHBondContact O-N 3.31Å; P41-F246 HydrophobicContact CB-CD1 4.2Å; P41-F246 HydrophobicContact CB-CE1 4.11Å; P41-F246 HydrophobicContact CG-CE1 4.45Å; P41-I247 HydrophobicContact CB-CB 4.35Å; P41-I247 HydrophobicContact CB-CG1 4.17Å
42	L	27.7	Very low	29.7	Very low	105 Å²	105	80.2 Å²	80.2	55%	0.55	41%	0.413	S	S	.	.	H	α-helix	trans	-59.2	-30.5	172.9	-90.2	146.4	0	0	0	115.2	S40 K46	S40-L42 PolarHBondContact O-N 3.35Å; L42-K46 WeakPolarHBondContact O-CG 3.24Å; L42-K46 PolarHBondContact O-N 2.68Å
43	S	31.8	Very low	30	Very low	43 Å²	43	80 Å²	80	30%	0.301	40%	0.401	S	S	.	.	H	α-helix	trans	-76.3	-32	177	60.4	0	0	0	0	111.9	S40 P41 K46 Q47	S40-S43 PolarHBondContact O-N 3.03Å; S40-S43 PolarHBondContact O-OG 2.87Å; S40-S43 PolarHBondContact OG-N 2.59Å; P41-S43 VanDerWaalsContact C-N 3.33Å; P41-S43 PolarHBondContact O-N 3.01Å; S43-K46 PolarHBondContact O-N 3.4Å; S43-Q47 PolarHBondContact O-N 3.17Å
44	L	36.2	Very low	30.2	Very low	35 Å²	35	84.3 Å²	84.3	18%	0.183	41%	0.412	C	S	.	.	H	α-helix	trans	-69.8	-42.3	172.9	-78.8	154.7	0	0	0	110.9	P41 K46 Q47 E48 F246	P41-L44 WeakPolarHBondContact O-CB 3.36Å; P41-L44 PolarHBondContact O-N 3.21Å; L44-K46 VanDerWaalsContact C-N 3.32Å; L44-K46 PolarHBondContact O-N 3.47Å; L44-Q47 WeakPolarHBondContact O-CB 3.11Å; L44-Q47 PolarHBondContact O-N 2.94Å; L44-Q47 VanDerWaalsContact O-N 3.1Å; L44-E48 PolarHBondContact O-N 2.89Å; L44-F246 HydrophobicContact CD1-CE1 4.44Å
45	L	32.3	Very low	30.1	Very low	24 Å²	24	82.3 Å²	82.3	13%	0.126	41%	0.41	C	S	.	.	H	α-helix	trans	-58.9	-43.3	170.6	-176.5	74.9	0	0	0	111.2	P41 Q47 E48 L49 I247	P41-L45 PolarHBondContact O-N 3.31Å; L45-Q47 VanDerWaalsContact C-N 3.29Å; L45-Q47 PolarHBondContact O-N 3.21Å; L45-E48 PolarHBondContact O-N 3.24Å; L45-L49 HydrophobicContact CD1-CD1 4.48Å; L45-L49 HydrophobicContact CD2-CD1 4.23Å; L45-L49 HydrophobicContact CG-CD1 3.87Å; L45-L49 HydrophobicContact CG-CG 4.37Å; L45-L49 VanDerWaalsContact O-CB 3.29Å; L45-L49 WeakPolarHBondContact O-CB 3.36Å; L45-L49 WeakPolarHBondContact O-CD1 3.37Å; L45-L49 WeakPolarHBondContact O-CG 3.43Å; L45-L49 PolarHBondContact O-N 3.39Å; L45-I247 HydrophobicContact CB-CD1 3.83Å; L45-I247 HydrophobicContact CB-CG1 4.49Å; L45-I247 HydrophobicContact CD1-CD1 3.55Å; L45-I247 HydrophobicContact CD2-CD1 4Å; L45-I247 HydrophobicContact CG-CD1 3.95Å
46	K	29.4	Very low	30.3	Very low	137 Å²	137	84.3 Å²	84.3	60%	0.596	41%	0.412	S	S	*	.	H	α-helix	trans	-60.7	-36.9	174.6	-81.1	-177.7	179	-175.8	0	112.5	L42 S43 L44 Q50	L42-K46 WeakPolarHBondContact O-CG 3.24Å; L42-K46 PolarHBondContact O-N 2.68Å; S43-K46 PolarHBondContact O-N 3.4Å; L44-K46 VanDerWaalsContact C-N 3.32Å; L44-K46 PolarHBondContact O-N 3.47Å; K46-Q50 VanDerWaalsContact O-CB 3.32Å; K46-Q50 WeakPolarHBondContact O-CB 3.16Å; K46-Q50 WeakPolarHBondContact O-CG 3.46Å; K46-Q50 PolarHBondContact O-N 3.24Å
47	Q	34.1	Very low	30.3	Very low	61 Å²	61	83.3 Å²	83.3	29%	0.285	41%	0.414	S	S	.	.	H	α-helix	trans	-70.7	-42.3	174.8	-92.7	-177.9	-44.8	0	0	112.8	S43 L44 L45 L49 Q50 H51	S43-Q47 PolarHBondContact O-N 3.17Å; L44-Q47 WeakPolarHBondContact O-CB 3.11Å; L44-Q47 PolarHBondContact O-N 2.94Å; L44-Q47 VanDerWaalsContact O-N 3.1Å; L45-Q47 VanDerWaalsContact C-N 3.29Å; L45-Q47 PolarHBondContact O-N 3.21Å; Q47-L49 VanDerWaalsContact C-N 3.28Å; Q47-L49 PolarHBondContact O-N 3.09Å; Q47-Q50 PolarHBondContact O-N 3.07Å; Q47-H51 VanDerWaalsContact O-CB 3.28Å; Q47-H51 WeakPolarHBondContact O-CB 3.45Å; Q47-H51 PolarHBondContact O-N 3.23Å
48	E	31.2	Very low	30	Very low	62 Å²	62	84.1 Å²	84.1	29%	0.29	43%	0.428	S	S	.	.	H	α-helix	trans	-62.7	-38	174.9	-157.4	100.1	-163.8	0	0	110.8	L44 L45 H51 R52 Y274	L44-E48 PolarHBondContact O-N 2.89Å; L45-E48 PolarHBondContact O-N 3.24Å; E48-H51 PolarHBondContact O-N 3.39Å; E48-R52 WeakPolarHBondContact O-CB 3.19Å; E48-R52 PolarHBondContact O-N 3.15Å; E48-Y274 WeakPolarHBondContact OE2-CE2 3.29Å; E48-Y274 PolarHBondContact OE2-OH 3.34Å
49	L	32.7	Very low	29.7	Very low	60 Å²	60	85 Å²	85	31%	0.314	45%	0.449	S	S	.	.	H	α-helix	trans	-68.5	-41.6	173.6	-72.2	167.4	0	0	0	112.1	L45 Q47 H51 R52 Q53 P214	L45-L49 HydrophobicContact CD1-CD1 4.48Å; L45-L49 HydrophobicContact CD2-CD1 4.23Å; L45-L49 HydrophobicContact CG-CD1 3.87Å; L45-L49 HydrophobicContact CG-CG 4.37Å; L45-L49 VanDerWaalsContact O-CB 3.29Å; L45-L49 WeakPolarHBondContact O-CB 3.36Å; L45-L49 WeakPolarHBondContact O-CD1 3.37Å; L45-L49 WeakPolarHBondContact O-CG 3.43Å; L45-L49 PolarHBondContact O-N 3.39Å; Q47-L49 VanDerWaalsContact C-N 3.28Å; Q47-L49 PolarHBondContact O-N 3.09Å; L49-H51 VanDerWaalsContact C-N 3.34Å; L49-R52 PolarHBondContact O-N 3.33Å; L49-Q53 VanDerWaalsContact O-CB 3.31Å; L49-Q53 WeakPolarHBondContact O-CB 3.37Å; L49-Q53 VanDerWaalsContact O-CG 3.3Å; L49-Q53 WeakPolarHBondContact O-CG 3.27Å; L49-Q53 PolarHBondContact O-N 2.88Å; L49-P214 HydrophobicContact CD1-CB 4.27Å
50	Q	28	Very low	29	Very low	111 Å²	111	83.9 Å²	83.9	52%	0.519	47%	0.465	S	S	.	.	H	α-helix	trans	-66.1	-35.6	174.1	-79.7	173	-16.1	0	0	112	K46 Q47 Q53 Q54	K46-Q50 VanDerWaalsContact O-CB 3.32Å; K46-Q50 WeakPolarHBondContact O-CB 3.16Å; K46-Q50 WeakPolarHBondContact O-CG 3.46Å; K46-Q50 PolarHBondContact O-N 3.24Å; Q47-Q50 PolarHBondContact O-N 3.07Å; Q50-Q53 PolarHBondContact O-N 3.33Å; Q50-Q54 WeakPolarHBondContact O-CB 3.34Å; Q50-Q54 WeakPolarHBondContact O-CG 3.32Å; Q50-Q54 PolarHBondContact O-N 3.48Å
51	H	29.4	Very low	28.6	Very low	115 Å²	115	85.1 Å²	85.1	53%	0.532	49%	0.488	S	S	.	.	H	α-helix	trans	-73.4	-36.9	177	-160.6	-56.5	0	0	0	111.7	Q47 E48 L49 Q55	Q47-H51 VanDerWaalsContact O-CB 3.28Å; Q47-H51 WeakPolarHBondContact O-CB 3.45Å; Q47-H51 PolarHBondContact O-N 3.23Å; E48-H51 PolarHBondContact O-N 3.39Å; L49-H51 VanDerWaalsContact C-N 3.34Å; H51-Q55 PolarHBondContact O-N 3.43Å; H51-Q55 VanDerWaalsContact O-N 3.12Å
52	R	31.1	Very low	28.1	Very low	113 Å²	113	88.6 Å²	88.6	43%	0.426	53%	0.526	S	S	.	.	H	α-helix	trans	-64.9	-40	167.3	-88.1	-163.1	172	-170.8	-2.9	111.8	E48 L49 Q55 D56 E210	E48-R52 WeakPolarHBondContact O-CB 3.19Å; E48-R52 PolarHBondContact O-N 3.15Å; L49-R52 PolarHBondContact O-N 3.33Å; R52-Q55 PolarHBondContact O-N 3.04Å; R52-D56 PolarHBondContact O-N 2.65Å; R52-E210 IonicContact CZ-OE1 3.02Å; R52-E210 IonicContact NH1-OE1 3.45Å; R52-E210 PolarHBondContact NH1-OE1 2.87Å; R52-E210 IonicContact NH2-OE1 2.71Å
53	Q	28.3	Very low	27.7	Very low	109 Å²	109	90.2 Å²	90.2	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-69.3	-34	176.9	-80.4	177.4	-21.4	0	0	113.1	L49 Q50 D56 A57	L49-Q53 VanDerWaalsContact O-CB 3.31Å; L49-Q53 WeakPolarHBondContact O-CB 3.37Å; L49-Q53 VanDerWaalsContact O-CG 3.3Å; L49-Q53 WeakPolarHBondContact O-CG 3.27Å; L49-Q53 PolarHBondContact O-N 2.88Å; Q50-Q53 PolarHBondContact O-N 3.33Å; Q53-D56 PolarHBondContact O-N 3.42Å; Q53-A57 WeakPolarHBondContact O-CB 3.34Å; Q53-A57 PolarHBondContact O-N 2.82Å
54	Q	26.3	Very low	27.1	Very low	141 Å²	141	94 Å²	94	66%	0.659	57%	0.571	S	S	*	*	H	α-helix	trans	-73.5	-30.7	174.8	-84	175.6	-20.5	0	0	112.7	Q50 S58	Q50-Q54 WeakPolarHBondContact O-CB 3.34Å; Q50-Q54 WeakPolarHBondContact O-CG 3.32Å; Q50-Q54 PolarHBondContact O-N 3.48Å; Q54-S58 PolarHBondContact O-N 2.96Å; Q54-S58 PolarHBondContact O-OG 2.86Å
55	Q	26.8	Very low	26.4	Very low	126 Å²	126	101.5 Å²	101.5	59%	0.589	61%	0.605	S	S	*	*	H	α-helix	trans	-66.8	-39.9	168.1	-79.1	178.3	-27.1	0	0	111.7	H51 R52 S58	H51-Q55 PolarHBondContact O-N 3.43Å; H51-Q55 VanDerWaalsContact O-N 3.12Å; R52-Q55 PolarHBondContact O-N 3.04Å; Q55-S58 PolarHBondContact O-OG 2.78Å
56	D	28	Very low	25.9	Very low	106 Å²	106	106.3 Å²	106.3	57%	0.567	64%	0.641	S	S	*	*	H	α-helix	trans	-75.6	-22.7	175.8	-79.6	-4.2	0	0	0	113.4	R52 Q53 K175	R52-D56 PolarHBondContact O-N 2.65Å; Q53-D56 PolarHBondContact O-N 3.42Å; D56-K175 IonicContact OD2-NZ 3.13Å; D56-K175 PolarHBondContact OD2-NZ 3.35Å
57	A	24	Very low	25.5	Very low	76 Å²	76	103.3 Å²	103.3	63%	0.628	65%	0.649	S	S	*	*	H	α-helix	trans	-93.8	-6.2	-177.5	0	0	0	0	0	115	Q53 A59	Q53-A57 WeakPolarHBondContact O-CB 3.34Å; Q53-A57 PolarHBondContact O-N 2.82Å; A57-A59 VanDerWaalsContact C-N 3.32Å
58	S	22.5	Very low	24.8	Very low	101 Å²	101	107.6 Å²	107.6	71%	0.706	67%	0.673	S	S	*	*	S	Bend	trans	-84.3	-2.8	178.7	53.5	0	0	0	0	114.1	Q54 Q55 G60	Q54-S58 PolarHBondContact O-N 2.96Å; Q54-S58 PolarHBondContact O-OG 2.86Å; Q55-S58 PolarHBondContact O-OG 2.78Å; S58-G60 PolarHBondContact O-N 3.18Å
59	A	24.7	Very low	24.4	Very low	97 Å²	97	116.9 Å²	116.9	80%	0.802	71%	0.706	S	S	*	*	S	Bend	trans	-93.8	69.9	168.1	0	0	0	0	0	110.8	A57	A57-A59 VanDerWaalsContact C-N 3.32Å
60	G	22.6	Very low	23.8	Very low	68 Å²	68	117.9 Å²	117.9	70%	0.701	72%	0.723	S	S	*	*	S	Bend	trans	-176.2	69	-176.6	0	0	0	0	0	114.2	S58	S58-G60 PolarHBondContact O-N 3.18Å
61	G	21.7	Very low	23.5	Very low	88 Å²	88	119.9 Å²	119.9	91%	0.907	74%	0.737	S	S	*	*			trans	0.8	130.3	173.4	0	0	0	0	0	123.1
62	G	20.8	Very low	23	Very low	83 Å²	83	122.5 Å²	122.5	86%	0.856	75%	0.75	S	S	*	*			trans	168.5	96.5	154.1	0	0	0	0	0	114.3
63	C	19.4	Very low	22.6	Very low	138 Å²	138	127.9 Å²	127.9	93%	0.932	77%	0.771	S	S	*	*			trans	-63.9	140.1	-171.9	-74.7	0	0	0	0	117.2
64	S	20.5	Very low	22.4	Very low	123 Å²	123	128.2 Å²	128.2	86%	0.86	78%	0.783	S	S	*	*			trans	-154.1	132.9	133.9	61.8	0	0	0	0	110.9
65	Q	20.8	Very low	22.3	Very low	192 Å²	192	127.5 Å²	127.5	90%	0.897	78%	0.78	S	S	*	*			trans	-71.7	145.5	-159.3	-65.2	169.9	-24.2	0	0	117.1
66	S	21.3	Very low	22.1	Very low	126 Å²	126	127.1 Å²	127.1	88%	0.881	79%	0.79	S	S	*	*			trans	134.3	124.8	141.7	74.8	0	0	0	0	111.1
67	G	21.8	Very low	21.9	Very low	74 Å²	74	131 Å²	131	76%	0.763	80%	0.804	S	S	*	*			cis	-162	159.6	-0.4	0	0	0	0	0	108.2
68	D	19.8	Very low	21.9	Very low	150 Å²	150	130.3 Å²	130.3	80%	0.802	80%	0.795	S	S	*	*			trans	-49.4	148.1	-168.3	-58.5	-56.7	0	0	0	116
69	W	21.8	Very low	22.2	Very low	258 Å²	258	128.5 Å²	128.5	98%	0.977	78%	0.782	S	S	*	*				179.1	85.6	126.4	-82	105	0	0	0	108.8
70	A	19.8	Very low	22.6	Very low	81 Å²	81	130.4 Å²	130.4	67%	0.669	77%	0.773	S	S	*	*			trans	-89.4	144.2	151.6	0	0	0	0	0	106.4
71	D	22.4	Very low	23	Very low	152 Å²	152	129 Å²	129	81%	0.813	75%	0.749	S	S	*	*				-170.6	174.7	51.2	-99.5	-42.3	0	0	0	111.5
72	Q	20	Very low	23.3	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.794	73%	0.732	S	S	*	*			trans	105.4	89.1	148.5	-54.3	-170.5	2.2	0	0	117.7
73	Y	22.4	Very low	23.7	Very low	226 Å²	226	128.9 Å²	128.9	89%	0.886	71%	0.705	S	S	*	*				-153.1	138.9	125.9	-85	-69.1	0	0	0	110.2
74	P	23.3	Very low	23.9	Very low	117 Å²	117	131.1 Å²	131.1	76%	0.76	70%	0.702	S	S	*	*			trans	-88.2	116.2	180	33.4	-27	0	0	0	110
75	E	24.4	Very low	24.1	Very low	125 Å²	125	134 Å²	134	58%	0.584	70%	0.701	S	S	*	*			trans	-163.6	71.4	148.5	-110.1	175.2	-144.6	0	0	107.3	N265	E75-N265 PolarHBondContact OE2-ND2 3.17Å
76	C	22.2	Very low	24.2	Very low	118 Å²	118	130 Å²	130	80%	0.797	69%	0.694	S	S	*	*			trans	-105.8	83.8	159.8	-109.5	0	0	0	0	107
77	E	23.3	Very low	24.5	Very low	187 Å²	187	131.7 Å²	131.7	87%	0.874	69%	0.694	S	S	*	*			trans	-124.8	128.2	159.3	-66.6	-172.9	165.7	0	0	107.6
78	S	25	Very low	24.7	Very low	63 Å²	63	134.3 Å²	134.3	44%	0.441	70%	0.699	S	S	.	*			cis	-156.1	111	-19.6	44.8	0	0	0	0	103.9	F80	S78-F80 PolarHBondContact O-N 3.32Å
79	S	27.4	Very low	24.8	Very low	62 Å²	62	136.7 Å²	136.7	43%	0.434	71%	0.705	S	S	.	*			trans	-65.1	120.3	144.2	33.8	0	0	0	0	104.3	L81 N82	S79-L81 PolarHBondContact O-N 2.89Å; S79-N82 PolarHBondContact O-N 3.43Å; S79-N82 PolarHBondContact OG-ND2 2.88Å; S79-N82 PolarHBondContact OG-OD1 3.3Å
80	F	33.9	Very low	25.2	Very low	137 Å²	137	132.7 Å²	132.7	60%	0.601	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	4.5	-174.6	-99.3	-91.7	0	0	0	114.9	S78 E203	S78-F80 PolarHBondContact O-N 3.32Å; F80-E203 HydrophobicContact CE2-CG 4.39Å
81	L	30.8	Very low	25.4	Very low	39 Å²	39	140.7 Å²	140.7	20%	0.204	72%	0.715	C	S	.	*	T	Hydrogen-bonded Turn	trans	-128.3	19.9	-176.1	-65.1	173.2	0	0	0	114.2	S79 F83 Y137 V140	S79-L81 PolarHBondContact O-N 2.89Å; L81-F83 PolarHBondContact O-N 3.4Å; L81-Y137 HydrophobicContact CD1-CD1 4.45Å; L81-Y137 HydrophobicContact CD2-CD1 4.02Å; L81-Y137 HydrophobicContact CD2-CG 4.49Å; L81-V140 HydrophobicContact CD1-CG1 4.39Å
82	N	27.4	Very low	25.7	Very low	101 Å²	101	137.4 Å²	137.4	54%	0.54	72%	0.717	S	S	.	*			trans	-84.4	109	174.6	-77.4	11.3	0	0	0	111.6	S79	S79-N82 PolarHBondContact O-N 3.43Å; S79-N82 PolarHBondContact OG-ND2 2.88Å; S79-N82 PolarHBondContact OG-OD1 3.3Å
83	F	30.8	Very low	26.6	Very low	67 Å²	67	135.3 Å²	135.3	29%	0.294	72%	0.721	S	S	.	*	P	Polyproline II helix	trans	-90	125.7	171.5	-57.7	-66.4	0	0	0	109.9	L81 I114	L81-F83 PolarHBondContact O-N 3.4Å; F83-I114 HydrophobicContact CD1-CD1 3.9Å; F83-I114 HydrophobicContact CD1-CG1 4.14Å; F83-I114 HydrophobicContact CE1-CD1 3.16Å; F83-I114 HydrophobicContact CE1-CG1 3.39Å; F83-I114 HydrophobicContact CE2-CD1 3.89Å; F83-I114 HydrophobicContact CZ-CD1 3.14Å; F83-I114 HydrophobicContact CZ-CG1 3.86Å
84	H	23.3	Very low	26.8	Very low	186 Å²	186	129 Å²	129	86%	0.861	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-73.6	131	176	-83.4	-79.5	0	0	0	111.3
85	E	23.5	Very low	27.3	Very low	183 Å²	183	129.1 Å²	129.1	86%	0.855	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-80.3	132.7	166.3	-77.3	-173.1	142	0	0	110.5
86	S	24.1	Very low	27.9	Very low	107 Å²	107	129.3 Å²	129.3	75%	0.748	73%	0.73	S	S	*	*			trans	-113.4	126.3	168.7	58.7	0	0	0	0	110.3
87	D	26.5	Very low	28	Very low	162 Å²	162	130.1 Å²	130.1	87%	0.866	73%	0.727	S	S	*	*			trans	3.9	126.6	166.8	-56.5	-36.2	0	0	0	120
88	C	25.7	Very low	28.5	Very low	130 Å²	130	124.6 Å²	124.6	88%	0.878	71%	0.709	S	S	*	*			trans	-136.3	112.3	158.7	-89.4	0	0	0	0	110.9
89	E	23.5	Very low	28.9	Very low	199 Å²	199	129.1 Å²	129.1	93%	0.93	73%	0.727	S	S	*	*			trans	-69.4	139.9	169.5	-71.2	-174.2	151.8	0	0	111.7
90	L	30.1	Very low	29.5	Very low	175 Å²	175	133.6 Å²	133.6	92%	0.916	75%	0.745	S	S	*	*			trans	-77.7	118.7	179.4	-84.3	148.6	0	0	0	112.5
91	R	23.7	Very low	29.9	Very low	249 Å²	249	129.5 Å²	129.5	94%	0.94	73%	0.733	S	S	*	*			trans	-142.7	123.7	149.7	-87.7	-165.5	-178.3	-165.3	2.1	112.5
92	G	27.6	Very low	30.6	Very low	82 Å²	82	133 Å²	133	85%	0.845	75%	0.752	S	S	*	*			trans	90.5	112.1	144.7	0	0	0	0	0	117.4
93	S	39.3	Very low	32.2	Very low	127 Å²	127	132.6 Å²	132.6	89%	0.888	75%	0.75	S	S	*	*			trans	-70.2	136.8	175.6	52.4	0	0	0	0	115
94	A	26.5	Very low	34	Very low	94 Å²	94	133.1 Å²	133.1	78%	0.777	76%	0.758	S	S	*	*			trans	-153.9	159.9	158.5	0	0	0	0	0	110.3
95	P	35.4	Very low	36.5	Very low	118 Å²	118	131 Å²	131	77%	0.766	75%	0.749	S	S	*	*			trans	-82.4	161.4	-147.9	33.9	-34.5	0	0	0	115.1	D97	P95-D97 PolarHBondContact O-N 3.48Å
96	C	35.1	Very low	39.1	Very low	130 Å²	130	127.9 Å²	127.9	88%	0.878	73%	0.733	S	S	*	*			trans	-55.9	98.6	-177.3	-64.3	0	0	0	0	114.1
97	D	26	Very low	41.7	Very low	135 Å²	135	123.5 Å²	123.5	72%	0.722	70%	0.7	S	S	*	*			trans	-97.3	139.8	153	-82	-35.8	0	0	0	109.9	P95 L99	P95-D97 PolarHBondContact O-N 3.48Å; D97-L99 PolarHBondContact O-N 2.94Å
98	S	33.2	Very low	44.3	Very low	71 Å²	71	120 Å²	120	50%	0.497	68%	0.681	S	S	.	*			trans	3.4	93	174.1	49.1	0	0	0	0	119	L100 S101	S98-L100 PolarHBondContact O-N 3.29Å; S98-S101 PolarHBondContact O-N 3.46Å; S98-S101 VanDerWaalsContact O-N 3.12Å; S98-S101 PolarHBondContact O-OG 2.91Å; S98-S101 VanDerWaalsContact O-OG 3.11Å; S98-S101 PolarHBondContact OG-OG 3.02Å
99	L	33.1	Very low	47	Very low	157 Å²	157	117.4 Å²	117.4	82%	0.822	67%	0.665	S	S	*	*	H	α-helix	trans	-54.6	-21.8	169.5	-96.3	153.8	0	0	0	114.9	D97	D97-L99 PolarHBondContact O-N 2.94Å
100	L	39.3	Very low	49.8	Very low	156 Å²	156	110.8 Å²	110.8	82%	0.817	63%	0.634	S	S	*	*	H	α-helix	trans	-81.5	-33.6	177.3	-87.4	155	0	0	0	113.5	S98 T104	S98-L100 PolarHBondContact O-N 3.29Å; L100-T104 PolarHBondContact O-OG1 3.45Å; L100-T104 VanDerWaalsContact O-OG1 3.12Å
101	S	44	Very low	52.3	Low	51 Å²	51	102.6 Å²	102.6	36%	0.357	59%	0.591	S	S	.	*	H	α-helix	trans	-77.4	-37.4	-175.8	67	0	0	0	0	112.4	S98 N103 T104 E105	S98-S101 PolarHBondContact O-N 3.46Å; S98-S101 VanDerWaalsContact O-N 3.12Å; S98-S101 PolarHBondContact O-OG 2.91Å; S98-S101 VanDerWaalsContact O-OG 3.11Å; S98-S101 PolarHBondContact OG-OG 3.02Å; S101-N103 VanDerWaalsContact C-N 3.26Å; S101-N103 PolarHBondContact O-N 3.26Å; S101-T104 WeakPolarHBondContact CA-OG1 3.19Å; S101-T104 PolarHBondContact O-N 3.3Å; S101-T104 PolarHBondContact O-OG1 2.83Å; S101-E105 PolarHBondContact O-N 3.42Å
102	L	44	Very low	55.2	Low	114 Å²	114	96.2 Å²	96.2	60%	0.597	57%	0.57	S	S	*	*	H	α-helix	trans	-63.2	-31	176.8	-87.6	144.6	0	0	0	112.4	K106	L102-K106 WeakPolarHBondContact O-CB 3.41Å; L102-K106 PolarHBondContact O-N 2.92Å
103	N	62.2	Low	57.9	Low	92 Å²	92	94.8 Å²	94.8	49%	0.492	55%	0.547	S	S	.	.	H	α-helix	trans	-76.8	-36.7	179.5	-135.5	11.7	0	0	0	111.8	S101 K106 I107	S101-N103 VanDerWaalsContact C-N 3.26Å; S101-N103 PolarHBondContact O-N 3.26Å; N103-K106 PolarHBondContact O-N 3.41Å; N103-I107 WeakPolarHBondContact O-CB 3.37Å; N103-I107 WeakPolarHBondContact O-CD1 3.16Å; N103-I107 WeakPolarHBondContact O-CG1 3.35Å; N103-I107 PolarHBondContact O-N 3.44Å
104	T	68.3	Low	60	Low	77 Å²	77	89 Å²	89	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-43.7	175.3	22	0	0	0	0	113.2	L100 S101 K106 I107 L108	L100-T104 PolarHBondContact O-OG1 3.45Å; L100-T104 VanDerWaalsContact O-OG1 3.12Å; S101-T104 WeakPolarHBondContact CA-OG1 3.19Å; S101-T104 PolarHBondContact O-N 3.3Å; S101-T104 PolarHBondContact O-OG1 2.83Å; T104-K106 VanDerWaalsContact C-N 3.32Å; T104-K106 PolarHBondContact O-N 3.34Å; T104-I107 PolarHBondContact O-N 2.88Å; T104-L108 WeakPolarHBondContact O-CB 3.22Å; T104-L108 WeakPolarHBondContact O-CD1 3.42Å; T104-L108 WeakPolarHBondContact O-CG 3.39Å; T104-L108 PolarHBondContact O-N 3.46Å
105	E	74.8	Confident	62.8	Low	142 Å²	142	84.9 Å²	84.9	66%	0.664	47%	0.472	S	S	*	.	H	α-helix	trans	-64.5	-39.4	176.7	-75.8	-176.5	169.4	0	0	111.5	S101 L108 S109	S101-E105 PolarHBondContact O-N 3.42Å; E105-L108 PolarHBondContact O-N 3.41Å; E105-S109 WeakPolarHBondContact O-CB 3.49Å; E105-S109 PolarHBondContact O-N 3.47Å; E105-S109 PolarHBondContact O-OG 2.87Å
106	K	78.8	Confident	65	Low	118 Å²	118	85.9 Å²	85.9	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-63.1	-49.5	174.9	-167.4	176.9	179	-176.5	0	111.4	L102 N103 T104 L108 S109 Q110	L102-K106 WeakPolarHBondContact O-CB 3.41Å; L102-K106 PolarHBondContact O-N 2.92Å; N103-K106 PolarHBondContact O-N 3.41Å; T104-K106 VanDerWaalsContact C-N 3.32Å; T104-K106 PolarHBondContact O-N 3.34Å; K106-L108 VanDerWaalsContact C-N 3.34Å; K106-L108 PolarHBondContact O-N 2.97Å; K106-S109 PolarHBondContact O-N 3.24Å; K106-S109 PolarHBondContact O-OG 3.09Å; K106-Q110 VanDerWaalsContact O-CB 3.32Å; K106-Q110 WeakPolarHBondContact O-CB 3.22Å; K106-Q110 PolarHBondContact O-N 3.43Å
107	I	78.8	Confident	67.2	Low	14 Å²	14	84.7 Å²	84.7	7%	0.072	45%	0.448	C	S	.	.	H	α-helix	trans	-57.4	-45.5	176.7	-73.6	166.3	0	0	0	111.2	N103 T104 Q110 A111 V138 L139 L144	N103-I107 WeakPolarHBondContact O-CB 3.37Å; N103-I107 WeakPolarHBondContact O-CD1 3.16Å; N103-I107 WeakPolarHBondContact O-CG1 3.35Å; N103-I107 PolarHBondContact O-N 3.44Å; T104-I107 PolarHBondContact O-N 2.88Å; I107-Q110 PolarHBondContact O-N 3.37Å; I107-A111 WeakPolarHBondContact O-CB 3.37Å; I107-A111 PolarHBondContact O-N 3.1Å; I107-V138 HydrophobicContact CB-CG1 4.13Å; I107-V138 HydrophobicContact CG1-CG1 4.06Å; I107-V138 HydrophobicContact CG2-CB 4.3Å; I107-V138 HydrophobicContact CG2-CG1 3.72Å; I107-L139 HydrophobicContact CD1-CD2 4.41Å; I107-L144 HydrophobicContact CD1-CD1 4.35Å
108	L	81.5	Confident	69.9	Low	89 Å²	89	82.4 Å²	82.4	47%	0.466	43%	0.432	S	S	.	.	H	α-helix	trans	-67.8	-41.5	179.8	-71.2	168.5	0	0	0	112.2	T104 E105 K106 Q110 A111 K112 I135	T104-L108 WeakPolarHBondContact O-CB 3.22Å; T104-L108 WeakPolarHBondContact O-CD1 3.42Å; T104-L108 WeakPolarHBondContact O-CG 3.39Å; T104-L108 PolarHBondContact O-N 3.46Å; E105-L108 PolarHBondContact O-N 3.41Å; K106-L108 VanDerWaalsContact C-N 3.34Å; K106-L108 PolarHBondContact O-N 2.97Å; L108-Q110 VanDerWaalsContact C-N 3.31Å; L108-Q110 PolarHBondContact O-N 3.14Å; L108-A111 PolarHBondContact O-N 3.07Å; L108-K112 WeakPolarHBondContact O-CB 3.5Å; L108-K112 PolarHBondContact O-N 2.93Å; L108-I135 HydrophobicContact CD2-CD1 3.78Å; L108-I135 HydrophobicContact CD2-CG1 4.09Å
109	S	81.6	Confident	72.2	Confident	75 Å²	75	86.2 Å²	86.2	52%	0.524	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-39.2	176	72.1	0	0	0	0	112	E105 K106 S113	E105-S109 WeakPolarHBondContact O-CB 3.49Å; E105-S109 PolarHBondContact O-N 3.47Å; E105-S109 PolarHBondContact O-OG 2.87Å; K106-S109 PolarHBondContact O-N 3.24Å; K106-S109 PolarHBondContact O-OG 3.09Å; S109-S113 PolarHBondContact O-N 3.04Å
110	Q	82.1	Confident	74.5	Confident	61 Å²	61	79.4 Å²	79.4	29%	0.285	40%	0.399	S	S	.	.	H	α-helix	trans	-71.1	-44.8	178.2	-162.2	171.1	5.5	0	0	110.8	K106 I107 L108 K112 S113 I114	K106-Q110 VanDerWaalsContact O-CB 3.32Å; K106-Q110 WeakPolarHBondContact O-CB 3.22Å; K106-Q110 PolarHBondContact O-N 3.43Å; I107-Q110 PolarHBondContact O-N 3.37Å; L108-Q110 VanDerWaalsContact C-N 3.31Å; L108-Q110 PolarHBondContact O-N 3.14Å; Q110-K112 VanDerWaalsContact C-N 3.32Å; Q110-K112 PolarHBondContact O-N 3.35Å; Q110-S113 PolarHBondContact O-N 3.31Å; Q110-I114 HydrophobicContact CG-CD1 4.04Å; Q110-I114 VanDerWaalsContact O-CD1 3.27Å; Q110-I114 WeakPolarHBondContact O-CD1 3.49Å; Q110-I114 WeakPolarHBondContact O-CG1 3.46Å; Q110-I114 PolarHBondContact O-N 3.41Å
111	A	83.8	Confident	76.6	Confident	2 Å²	2	72.8 Å²	72.8	2%	0.017	37%	0.366	C	S	.	.	H	α-helix	trans	-58.7	-42.4	175.1	0	0	0	0	0	111.9	I107 L108 S113 I114 A115 A134 I135 V138	I107-A111 WeakPolarHBondContact O-CB 3.37Å; I107-A111 PolarHBondContact O-N 3.1Å; L108-A111 PolarHBondContact O-N 3.07Å; A111-S113 PolarHBondContact O-N 2.93Å; A111-I114 PolarHBondContact O-N 3.04Å; A111-I114 VanDerWaalsContact O-N 3.17Å; A111-A115 WeakPolarHBondContact O-CB 3.38Å; A111-A115 PolarHBondContact O-N 3.36Å; A111-A134 HydrophobicContact CB-CB 4.17Å; A111-A134 VanDerWaalsContact O-CB 3.23Å; A111-A134 WeakPolarHBondContact O-CB 3.43Å; A111-I135 HydrophobicContact CB-CB 4.34Å; A111-I135 HydrophobicContact CB-CG1 3.68Å; A111-V138 HydrophobicContact CB-CG2 4.04Å
112	K	83.8	Confident	78.7	Confident	116 Å²	116	72.1 Å²	72.1	50%	0.504	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-45.2	177	-166.6	176.2	-176.8	179.1	0	112.1	L108 Q110 I114 A115 E116	L108-K112 WeakPolarHBondContact O-CB 3.5Å; L108-K112 PolarHBondContact O-N 2.93Å; Q110-K112 VanDerWaalsContact C-N 3.32Å; Q110-K112 PolarHBondContact O-N 3.35Å; K112-I114 VanDerWaalsContact C-N 3.28Å; K112-I114 PolarHBondContact O-N 3.1Å; K112-A115 PolarHBondContact O-N 3.46Å; K112-E116 WeakPolarHBondContact CE-OE1 3.43Å; K112-E116 WeakPolarHBondContact O-CG 3.25Å; K112-E116 PolarHBondContact O-N 3.48Å
113	S	84.4	Confident	80.7	Confident	51 Å²	51	68.5 Å²	68.5	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-35.2	175	180	0	0	0	0	112.6	S109 Q110 A111 Q117	S109-S113 PolarHBondContact O-N 3.04Å; Q110-S113 PolarHBondContact O-N 3.31Å; A111-S113 PolarHBondContact O-N 2.93Å; S113-Q117 WeakPolarHBondContact O-CB 3.23Å; S113-Q117 VanDerWaalsContact O-CG 3.25Å; S113-Q117 WeakPolarHBondContact O-CG 3.45Å; S113-Q117 PolarHBondContact O-N 2.92Å; S113-Q117 PolarHBondContact OG-NE2 3.34Å
114	I	83.5	Confident	81.9	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-73.7	-39.1	179	-68.1	159.6	0	0	0	111.4	F83 Q110 A111 K112 Q117 K118 R119 F120 A134 V138	F83-I114 HydrophobicContact CD1-CD1 3.9Å; F83-I114 HydrophobicContact CD1-CG1 4.14Å; F83-I114 HydrophobicContact CE1-CD1 3.16Å; F83-I114 HydrophobicContact CE1-CG1 3.39Å; F83-I114 HydrophobicContact CE2-CD1 3.89Å; F83-I114 HydrophobicContact CZ-CD1 3.14Å; F83-I114 HydrophobicContact CZ-CG1 3.86Å; Q110-I114 HydrophobicContact CG-CD1 4.04Å; Q110-I114 VanDerWaalsContact O-CD1 3.27Å; Q110-I114 WeakPolarHBondContact O-CD1 3.49Å; Q110-I114 WeakPolarHBondContact O-CG1 3.46Å; Q110-I114 PolarHBondContact O-N 3.41Å; A111-I114 PolarHBondContact O-N 3.04Å; A111-I114 VanDerWaalsContact O-N 3.17Å; K112-I114 VanDerWaalsContact C-N 3.28Å; K112-I114 PolarHBondContact O-N 3.1Å; I114-Q117 PolarHBondContact O-N 3.09Å; I114-K118 PolarHBondContact O-N 2.95Å; I114-R119 HydrophobicContact CG2-CB 4.46Å; I114-R119 PolarHBondContact O-N 3.42Å; I114-F120 HydrophobicContact CG2-CD1 3.8Å; I114-A134 HydrophobicContact CB-CB 4.26Å; I114-A134 HydrophobicContact CG2-CB 4.08Å; I114-V138 HydrophobicContact CD1-CG2 3.35Å
115	A	84.9	Confident	82.7	Confident	8 Å²	8	69.6 Å²	69.6	7%	0.066	35%	0.347	C	S	.	.	H	α-helix	trans	-62.7	-49.7	175.9	0	0	0	0	0	111.3	A111 K112 Q117 K118 E131 A134	A111-A115 WeakPolarHBondContact O-CB 3.38Å; A111-A115 PolarHBondContact O-N 3.36Å; K112-A115 PolarHBondContact O-N 3.46Å; A115-Q117 PolarHBondContact O-N 2.89Å; A115-K118 PolarHBondContact O-N 3.31Å; A115-E131 HydrophobicContact CB-CG 4Å; A115-A134 HydrophobicContact CB-CB 3.82Å
116	E	81.9	Confident	83.3	Confident	139 Å²	139	66.5 Å²	66.5	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-59.7	-34.9	178	-73.7	173.8	-173.1	0	0	112.3	K112	K112-E116 WeakPolarHBondContact CE-OE1 3.43Å; K112-E116 WeakPolarHBondContact O-CG 3.25Å; K112-E116 PolarHBondContact O-N 3.48Å
117	Q	81.7	Confident	83.6	Confident	105 Å²	105	66 Å²	66	49%	0.491	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-3.1	178.7	-63.6	173.8	19.8	0	0	113.3	S113 I114 A115 R119	S113-Q117 WeakPolarHBondContact O-CB 3.23Å; S113-Q117 VanDerWaalsContact O-CG 3.25Å; S113-Q117 WeakPolarHBondContact O-CG 3.45Å; S113-Q117 PolarHBondContact O-N 2.92Å; S113-Q117 PolarHBondContact OG-NE2 3.34Å; I114-Q117 PolarHBondContact O-N 3.09Å; A115-Q117 PolarHBondContact O-N 2.89Å; Q117-R119 HydrophobicContact CB-CB 4.41Å; Q117-R119 HydrophobicContact CB-CG 3.74Å; Q117-R119 PolarHBondContact O-N 2.96Å; Q117-R119 VanDerWaalsContact O-N 3.13Å
118	K	83.3	Confident	83.9	Confident	86 Å²	86	68.6 Å²	68.6	37%	0.374	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	36.5	-171.7	-60.8	-167.6	179.1	-161.9	0	113.4	I114 A115 F120 A123 T124	I114-K118 PolarHBondContact O-N 2.95Å; A115-K118 PolarHBondContact O-N 3.31Å; K118-F120 PolarHBondContact O-N 3.3Å; K118-A123 HydrophobicContact CB-CB 3.92Å; K118-A123 HydrophobicContact CD-CB 4.29Å; K118-A123 HydrophobicContact CG-CB 4.36Å; K118-T124 PolarHBondContact NZ-O 3.47Å
119	R	80.4	Confident	84.2	Confident	151 Å²	151	65.1 Å²	65.1	57%	0.57	34%	0.34	S	S	*	.			trans	-86.3	56.8	-175.4	-74.3	179	83.6	-176.6	4.8	112.2	I114 Q117	I114-R119 HydrophobicContact CG2-CB 4.46Å; I114-R119 PolarHBondContact O-N 3.42Å; Q117-R119 HydrophobicContact CB-CB 4.41Å; Q117-R119 HydrophobicContact CB-CG 3.74Å; Q117-R119 PolarHBondContact O-N 2.96Å; Q117-R119 VanDerWaalsContact O-N 3.13Å
120	F	80.6	Confident	84.5	Confident	14 Å²	14	61.6 Å²	61.6	6%	0.061	32%	0.315	C	S	.	.	S	Bend	trans	-153	159.3	173.5	56.5	-86.3	0	0	0	111.2	I114 K118 A123 N130 L133 A134 Y137	I114-F120 HydrophobicContact CG2-CD1 3.8Å; K118-F120 PolarHBondContact O-N 3.3Å; F120-A123 HydrophobicContact CD2-CB 4.34Å; F120-A123 HydrophobicContact CE1-CB 4.47Å; F120-A123 HydrophobicContact CE2-CB 3.8Å; F120-A123 HydrophobicContact CZ-CB 3.87Å; F120-N130 HydrophobicContact CE1-CB 4.37Å; F120-N130 HydrophobicContact CZ-CB 3.69Å; F120-N130 WeakPolarHBondContact CZ-OD1 3.18Å; F120-L133 HydrophobicContact CD2-CB 4.21Å; F120-L133 HydrophobicContact CE2-CB 3.72Å; F120-L133 HydrophobicContact CE2-CD1 3.74Å; F120-L133 HydrophobicContact CE2-CG 4.37Å; F120-L133 HydrophobicContact CZ-CB 4.19Å; F120-L133 HydrophobicContact CZ-CD1 4.49Å; F120-A134 HydrophobicContact CE1-CB 4.39Å; F120-Y137 HydrophobicContact CB-CD2 3.84Å; F120-Y137 HydrophobicContact CB-CE2 4.16Å; F120-Y137 HydrophobicContact CB-CG 4.27Å; F120-Y137 HydrophobicContact CD2-CD2 4.07Å; F120-Y137 AromaticContact CD2-CE2 3.95Å; F120-Y137 HydrophobicContact CD2-CE2 3.95Å; F120-Y137 HydrophobicContact CG-CD2 4.15Å; F120-Y137 HydrophobicContact CG-CE2 4.4Å
121	P	84.1	Confident	84.8	Confident	18 Å²	18	63.5 Å²	63.5	12%	0.117	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	137.2	-174.9	-21.9	33.4	0	0	0	112.5	A123 Y137 S164 Y167	P121-A123 VanDerWaalsContact C-N 3.33Å; P121-A123 PolarHBondContact O-N 2.98Å; P121-Y137 HydrophobicContact CG-CE1 4.19Å; P121-S164 WeakPolarHBondContact O-CB 3.39Å; P121-S164 PolarHBondContact O-OG 2.69Å; P121-Y167 HydrophobicContact CB-CD1 3.59Å; P121-Y167 HydrophobicContact CB-CE1 3.51Å; P121-Y167 HydrophobicContact CG-CD1 3.94Å; P121-Y167 HydrophobicContact CG-CE1 3.55Å
122	F	88.8	Confident	85.1	Confident	36 Å²	36	67.8 Å²	67.8	16%	0.158	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	39.8	174.1	-48.1	-74.4	0	0	0	114.3	V163 S164 Y167 V194 R201 V204	F122-V163 HydrophobicContact CB-CB 4.42Å; F122-V163 HydrophobicContact CB-CG1 4.21Å; F122-V163 HydrophobicContact CD1-CG1 3.84Å; F122-V163 HydrophobicContact CD2-CG1 4.07Å; F122-V163 HydrophobicContact CE1-CG1 4.26Å; F122-V163 HydrophobicContact CE2-CG1 4.47Å; F122-V163 HydrophobicContact CG-CB 4.48Å; F122-V163 HydrophobicContact CG-CG1 3.75Å; F122-S164 WeakPolarHBondContact O-CB 3.42Å; F122-Y167 AromaticContact CD2-CD1 3.99Å; F122-Y167 HydrophobicContact CD2-CD1 3.99Å; F122-Y167 AromaticContact CD2-CG 3.96Å; F122-Y167 HydrophobicContact CD2-CG 3.96Å; F122-Y167 AromaticContact CE2-CD1 3.76Å; F122-Y167 HydrophobicContact CE2-CD1 3.76Å; F122-Y167 AromaticContact CE2-CD2 3.83Å; F122-Y167 HydrophobicContact CE2-CD2 3.83Å; F122-Y167 HydrophobicContact CE2-CE1 4.14Å; F122-Y167 HydrophobicContact CE2-CE2 4.23Å; F122-Y167 AromaticContact CE2-CG 3.56Å; F122-Y167 HydrophobicContact CE2-CG 3.56Å; F122-V194 HydrophobicContact CE2-CG1 4.38Å; F122-V194 HydrophobicContact CZ-CG1 4.27Å; F122-R201 HydrophobicContact CE1-CB 4.34Å; F122-R201 HydrophobicContact CE1-CG 3.78Å; F122-R201 HydrophobicContact CZ-CB 4.33Å; F122-R201 HydrophobicContact CZ-CG 4.27Å; F122-V204 HydrophobicContact CE2-CG2 4.21Å; F122-V204 HydrophobicContact CZ-CG2 3.65Å
123	A	86.3	Confident	85.4	Confident	39 Å²	39	62.3 Å²	62.3	32%	0.322	32%	0.32	S	S	.	.			trans	-54.2	141.9	175.7	0	0	0	0	0	111.6	K118 F120 P121	K118-A123 HydrophobicContact CB-CB 3.92Å; K118-A123 HydrophobicContact CD-CB 4.29Å; K118-A123 HydrophobicContact CG-CB 4.36Å; F120-A123 HydrophobicContact CD2-CB 4.34Å; F120-A123 HydrophobicContact CE1-CB 4.47Å; F120-A123 HydrophobicContact CE2-CB 3.8Å; F120-A123 HydrophobicContact CZ-CB 3.87Å; P121-A123 VanDerWaalsContact C-N 3.33Å; P121-A123 PolarHBondContact O-N 2.98Å
124	T	86.9	Confident	85.7	Confident	32 Å²	32	59.9 Å²	59.9	20%	0.196	30%	0.303	C	S	.	.			trans	-97.4	173.5	-175.3	72.8	0	0	0	0	111.4	K118 N126 T129 N130 L133 L162	K118-T124 PolarHBondContact NZ-O 3.47Å; T124-N126 VanDerWaalsContact C-N 3.28Å; T124-N126 PolarHBondContact OG1-N 2.91Å; T124-N126 PolarHBondContact OG1-O 2.98Å; T124-T129 HydrophobicContact CG2-CG2 4.48Å; T124-N130 PolarHBondContact N-OD1 3.33Å; T124-N130 PolarHBondContact O-ND2 3.41Å; T124-N130 PolarHBondContact OG1-OD1 3.02Å; T124-L133 HydrophobicContact CG2-CD1 4.23Å; T124-L162 HydrophobicContact CG2-CD1 3.72Å
125	D	85	Confident	86	Confident	159 Å²	159	61.6 Å²	61.6	85%	0.85	31%	0.312	S	S	*	.	S	Bend	trans	-80.1	-11.3	170.9	-66.8	-33.2	0	0	0	112.9
126	N	87	Confident	86.4	Confident	78 Å²	78	61.2 Å²	61.2	42%	0.417	31%	0.309	S	S	.	.			trans	-92.7	114	178.8	-172.8	0.5	0	0	0	111.3	T124 S128 T129 N130	T124-N126 VanDerWaalsContact C-N 3.28Å; T124-N126 PolarHBondContact OG1-N 2.91Å; T124-N126 PolarHBondContact OG1-O 2.98Å; N126-S128 VanDerWaalsContact C-N 3.32Å; N126-S128 PolarHBondContact ND2-OG 3.49Å; N126-S128 PolarHBondContact O-N 2.89Å; N126-S128 PolarHBondContact OD1-N 3.24Å; N126-S128 VanDerWaalsContact OD1-N 3.15Å; N126-S128 PolarHBondContact OD1-OG 3.28Å; N126-S128 VanDerWaalsContact OD1-OG 3.07Å; N126-T129 PolarHBondContact ND2-OG1 3.17Å; N126-T129 PolarHBondContact O-N 2.96Å; N126-N130 WeakPolarHBondContact O-CB 3.26Å; N126-N130 PolarHBondContact O-N 3.41Å; N126-N130 PolarHBondContact O-ND2 3.38Å
127	D	84.8	Confident	86.8	Confident	107 Å²	107	54.6 Å²	54.6	57%	0.572	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-34.3	-178.9	-66.2	-27.3	0	0	0	112.6	N130 E131	D127-N130 PolarHBondContact O-N 2.91Å; D127-E131 WeakPolarHBondContact O-CG 3.42Å; D127-E131 PolarHBondContact O-N 3.43Å
128	S	86.1	Confident	87.3	Confident	69 Å²	69	49.7 Å²	49.7	48%	0.483	26%	0.255	S	S	.	.	H	α-helix	trans	-67.1	-42.4	177.5	71.8	0	0	0	0	111.8	N126 N130 E131 E132	N126-S128 VanDerWaalsContact C-N 3.32Å; N126-S128 PolarHBondContact ND2-OG 3.49Å; N126-S128 PolarHBondContact O-N 2.89Å; N126-S128 PolarHBondContact OD1-N 3.24Å; N126-S128 VanDerWaalsContact OD1-N 3.15Å; N126-S128 PolarHBondContact OD1-OG 3.28Å; N126-S128 VanDerWaalsContact OD1-OG 3.07Å; S128-N130 VanDerWaalsContact C-N 3.3Å; S128-N130 PolarHBondContact O-N 3.36Å; S128-E131 PolarHBondContact O-N 3.49Å; S128-E132 PolarHBondContact O-N 2.99Å
129	T	86.9	Confident	87.6	Confident	16 Å²	16	46 Å²	46	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-37.7	175.6	-52	0	0	0	0	110.6	T124 N126 E132 L133 M155 L162	T124-T129 HydrophobicContact CG2-CG2 4.48Å; N126-T129 PolarHBondContact ND2-OG1 3.17Å; N126-T129 PolarHBondContact O-N 2.96Å; T129-E132 PolarHBondContact O-N 2.87Å; T129-L133 HydrophobicContact CG2-CD1 4.11Å; T129-L133 HydrophobicContact CG2-CG 4.38Å; T129-L133 WeakPolarHBondContact O-CB 3.47Å; T129-L133 VanDerWaalsContact O-CG 3.26Å; T129-L133 WeakPolarHBondContact O-CG 3.38Å; T129-L133 PolarHBondContact O-N 2.87Å; T129-M155 HydrophobicContact CG2-CE 4.18Å; T129-L162 HydrophobicContact CG2-CD1 4.2Å; T129-L162 HydrophobicContact CG2-CD2 3.84Å
130	N	88.6	Confident	88.1	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-36.6	176.4	-71.8	-24.6	0	0	0	113	F120 T124 N126 D127 S128 A134	F120-N130 HydrophobicContact CE1-CB 4.37Å; F120-N130 HydrophobicContact CZ-CB 3.69Å; F120-N130 WeakPolarHBondContact CZ-OD1 3.18Å; T124-N130 PolarHBondContact N-OD1 3.33Å; T124-N130 PolarHBondContact O-ND2 3.41Å; T124-N130 PolarHBondContact OG1-OD1 3.02Å; N126-N130 WeakPolarHBondContact O-CB 3.26Å; N126-N130 PolarHBondContact O-N 3.41Å; N126-N130 PolarHBondContact O-ND2 3.38Å; D127-N130 PolarHBondContact O-N 2.91Å; S128-N130 VanDerWaalsContact C-N 3.3Å; S128-N130 PolarHBondContact O-N 3.36Å; N130-A134 VanDerWaalsContact O-CB 3.28Å; N130-A134 WeakPolarHBondContact O-CB 3.4Å; N130-A134 PolarHBondContact O-N 3.17Å
131	E	88.1	Confident	88.4	Confident	100 Å²	100	41 Å²	41	47%	0.467	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-46.5	172.6	-75.6	-176.8	171.9	0	0	111.4	A115 D127 S128 A134 I135	A115-E131 HydrophobicContact CB-CG 4Å; D127-E131 WeakPolarHBondContact O-CG 3.42Å; D127-E131 PolarHBondContact O-N 3.43Å; S128-E131 PolarHBondContact O-N 3.49Å; E131-A134 PolarHBondContact O-N 2.99Å; E131-I135 WeakPolarHBondContact O-CG1 3.49Å; E131-I135 PolarHBondContact O-N 3.2Å; E131-I135 VanDerWaalsContact O-N 3.09Å
132	E	89.9	Confident	88.6	Confident	93 Å²	93	42.9 Å²	42.9	44%	0.435	25%	0.25	S	S	.	.	H	α-helix	trans	-65.6	-41.5	177.4	-68.6	-162.4	177.8	0	0	113	S128 T129 A134 I135 A136 M155	S128-E132 PolarHBondContact O-N 2.99Å; T129-E132 PolarHBondContact O-N 2.87Å; E132-A134 VanDerWaalsContact C-N 3.33Å; E132-A134 PolarHBondContact O-N 2.9Å; E132-I135 PolarHBondContact O-N 3.2Å; E132-A136 PolarHBondContact O-N 3.42Å; E132-A136 VanDerWaalsContact O-N 3.07Å; E132-M155 HydrophobicContact CB-CE 3.56Å; E132-M155 HydrophobicContact CB-SD 4.17Å
133	L	91.3	Very high	88.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-44.9	175.2	-75.1	170.6	0	0	0	110.4	F120 T124 T129 I135 A136 Y137 F152 M155 L162 A165	F120-L133 HydrophobicContact CD2-CB 4.21Å; F120-L133 HydrophobicContact CE2-CB 3.72Å; F120-L133 HydrophobicContact CE2-CD1 3.74Å; F120-L133 HydrophobicContact CE2-CG 4.37Å; F120-L133 HydrophobicContact CZ-CB 4.19Å; F120-L133 HydrophobicContact CZ-CD1 4.49Å; T124-L133 HydrophobicContact CG2-CD1 4.23Å; T129-L133 HydrophobicContact CG2-CD1 4.11Å; T129-L133 HydrophobicContact CG2-CG 4.38Å; T129-L133 WeakPolarHBondContact O-CB 3.47Å; T129-L133 VanDerWaalsContact O-CG 3.26Å; T129-L133 WeakPolarHBondContact O-CG 3.38Å; T129-L133 PolarHBondContact O-N 2.87Å; L133-I135 VanDerWaalsContact C-N 3.32Å; L133-I135 PolarHBondContact O-N 3.25Å; L133-A136 PolarHBondContact O-N 3.22Å; L133-A136 VanDerWaalsContact O-N 3.14Å; L133-Y137 WeakPolarHBondContact O-CD2 3.47Å; L133-Y137 PolarHBondContact O-N 2.86Å; L133-F152 HydrophobicContact CD2-CD1 4.45Å; L133-F152 HydrophobicContact CD2-CE1 4.12Å; L133-M155 HydrophobicContact CB-CE 4.4Å; L133-M155 HydrophobicContact CD2-CE 3.59Å; L133-M155 HydrophobicContact CD2-SD 4.06Å; L133-M155 HydrophobicContact CG-CE 3.57Å; L133-L162 HydrophobicContact CD2-CD2 4.3Å; L133-A165 HydrophobicContact CD2-CB 3.98Å
134	A	90	Very high	88.8	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.1	-41	179	0	0	0	0	0	111.8	A111 I114 A115 F120 N130 E131 E132 A136 Y137 V138	A111-A134 HydrophobicContact CB-CB 4.17Å; A111-A134 VanDerWaalsContact O-CB 3.23Å; A111-A134 WeakPolarHBondContact O-CB 3.43Å; I114-A134 HydrophobicContact CB-CB 4.26Å; I114-A134 HydrophobicContact CG2-CB 4.08Å; A115-A134 HydrophobicContact CB-CB 3.82Å; F120-A134 HydrophobicContact CE1-CB 4.39Å; N130-A134 VanDerWaalsContact O-CB 3.28Å; N130-A134 WeakPolarHBondContact O-CB 3.4Å; N130-A134 PolarHBondContact O-N 3.17Å; E131-A134 PolarHBondContact O-N 2.99Å; E132-A134 VanDerWaalsContact C-N 3.33Å; E132-A134 PolarHBondContact O-N 2.9Å; A134-A136 VanDerWaalsContact C-N 3.34Å; A134-A136 PolarHBondContact O-N 3.49Å; A134-Y137 PolarHBondContact O-N 2.78Å; A134-V138 VanDerWaalsContact O-CG2 3.28Å; A134-V138 WeakPolarHBondContact O-CG2 3.5Å; A134-V138 PolarHBondContact O-N 2.87Å
135	I	90.6	Very high	89.1	Confident	42 Å²	42	45.5 Å²	45.5	22%	0.215	26%	0.263	C	S	.	.	H	α-helix	trans	-58.1	-49.2	173.4	-65.9	167.4	0	0	0	110	L108 A111 E131 E132 L133 Y137 V138 L139	L108-I135 HydrophobicContact CD2-CD1 3.78Å; L108-I135 HydrophobicContact CD2-CG1 4.09Å; A111-I135 HydrophobicContact CB-CB 4.34Å; A111-I135 HydrophobicContact CB-CG1 3.68Å; E131-I135 WeakPolarHBondContact O-CG1 3.49Å; E131-I135 PolarHBondContact O-N 3.2Å; E131-I135 VanDerWaalsContact O-N 3.09Å; E132-I135 PolarHBondContact O-N 3.2Å; L133-I135 VanDerWaalsContact C-N 3.32Å; L133-I135 PolarHBondContact O-N 3.25Å; I135-Y137 PolarHBondContact O-N 2.95Å; I135-V138 PolarHBondContact O-N 2.9Å; I135-L139 HydrophobicContact CG2-CD1 4.32Å; I135-L139 WeakPolarHBondContact O-CG 3.33Å; I135-L139 PolarHBondContact O-N 3.33Å
136	A	91.6	Very high	89.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-39.7	-179.2	0	0	0	0	0	112.8	E132 L133 A134 L139 V140 H151 F152	E132-A136 PolarHBondContact O-N 3.42Å; E132-A136 VanDerWaalsContact O-N 3.07Å; L133-A136 PolarHBondContact O-N 3.22Å; L133-A136 VanDerWaalsContact O-N 3.14Å; A134-A136 VanDerWaalsContact C-N 3.34Å; A134-A136 PolarHBondContact O-N 3.49Å; A136-L139 WeakPolarHBondContact O-CB 3.41Å; A136-L139 PolarHBondContact O-N 2.83Å; A136-V140 WeakPolarHBondContact O-CG2 3.2Å; A136-V140 PolarHBondContact O-N 3.02Å; A136-V140 VanDerWaalsContact O-N 3.1Å; A136-H151 HydrophobicContact CB-CB 4.18Å; A136-F152 HydrophobicContact CB-CD1 3.76Å; A136-F152 HydrophobicContact CB-CD2 4.24Å; A136-F152 HydrophobicContact CB-CE1 3.34Å; A136-F152 HydrophobicContact CB-CE2 3.85Å; A136-F152 HydrophobicContact CB-CG 4.2Å; A136-F152 HydrophobicContact CB-CZ 3.39Å
137	Y	91.8	Very high	89.7	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-35.1	174.9	-81.1	-72	0	0	0	113.2	L81 F120 P121 L133 A134 I135 L139 V140 G141 F152 S164 G168	L81-Y137 HydrophobicContact CD1-CD1 4.45Å; L81-Y137 HydrophobicContact CD2-CD1 4.02Å; L81-Y137 HydrophobicContact CD2-CG 4.49Å; F120-Y137 HydrophobicContact CB-CD2 3.84Å; F120-Y137 HydrophobicContact CB-CE2 4.16Å; F120-Y137 HydrophobicContact CB-CG 4.27Å; F120-Y137 HydrophobicContact CD2-CD2 4.07Å; F120-Y137 AromaticContact CD2-CE2 3.95Å; F120-Y137 HydrophobicContact CD2-CE2 3.95Å; F120-Y137 HydrophobicContact CG-CD2 4.15Å; F120-Y137 HydrophobicContact CG-CE2 4.4Å; P121-Y137 HydrophobicContact CG-CE1 4.19Å; L133-Y137 WeakPolarHBondContact O-CD2 3.47Å; L133-Y137 PolarHBondContact O-N 2.86Å; A134-Y137 PolarHBondContact O-N 2.78Å; I135-Y137 PolarHBondContact O-N 2.95Å; Y137-L139 VanDerWaalsContact C-N 3.33Å; Y137-V140 WeakPolarHBondContact O-CB 3.41Å; Y137-V140 PolarHBondContact O-N 3.47Å; Y137-G141 PolarHBondContact O-N 3Å; Y137-F152 HydrophobicContact CD1-CZ 4.41Å; Y137-F152 HydrophobicContact CD2-CE1 4.47Å; Y137-F152 HydrophobicContact CD2-CZ 4.27Å; Y137-F152 HydrophobicContact CE1-CZ 4.4Å; Y137-F152 HydrophobicContact CE2-CE1 4.23Å; Y137-F152 HydrophobicContact CE2-CZ 4.23Å; Y137-F152 HydrophobicContact CG-CZ 4.34Å; Y137-S164 WeakPolarHBondContact CE2-OG 3.32Å; Y137-S164 PolarHBondContact OH-O 2.99Å; Y137-S164 PolarHBondContact OH-OG 3.09Å; Y137-G168 PolarHBondContact OH-N 3.32Å
138	V	90.6	Very high	90.2	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-37.5	172.8	175.3	0	0	0	0	110.8	I107 A111 I114 A134 I135 V140 G141 S142	I107-V138 HydrophobicContact CB-CG1 4.13Å; I107-V138 HydrophobicContact CG1-CG1 4.06Å; I107-V138 HydrophobicContact CG2-CB 4.3Å; I107-V138 HydrophobicContact CG2-CG1 3.72Å; A111-V138 HydrophobicContact CB-CG2 4.04Å; I114-V138 HydrophobicContact CD1-CG2 3.35Å; A134-V138 VanDerWaalsContact O-CG2 3.28Å; A134-V138 WeakPolarHBondContact O-CG2 3.5Å; A134-V138 PolarHBondContact O-N 2.87Å; I135-V138 PolarHBondContact O-N 2.9Å; V138-V140 VanDerWaalsContact C-N 3.33Å; V138-V140 PolarHBondContact O-N 3.41Å; V138-G141 CarbonylContact O-C 3.27Å; V138-G141 PolarHBondContact O-N 3.15Å; V138-S142 WeakPolarHBondContact O-CB 3.48Å; V138-S142 PolarHBondContact O-N 3.25Å; V138-S142 PolarHBondContact O-OG 3.49Å
139	L	91.2	Very high	90.6	Very high	9 Å²	9	35.8 Å²	35.8	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-41.2	173	-68.6	171.8	0	0	0	111.6	I107 I135 A136 Y137 S142 G143 L144 E147 A148	I107-L139 HydrophobicContact CD1-CD2 4.41Å; I135-L139 HydrophobicContact CG2-CD1 4.32Å; I135-L139 WeakPolarHBondContact O-CG 3.33Å; I135-L139 PolarHBondContact O-N 3.33Å; A136-L139 WeakPolarHBondContact O-CB 3.41Å; A136-L139 PolarHBondContact O-N 2.83Å; Y137-L139 VanDerWaalsContact C-N 3.33Å; L139-S142 PolarHBondContact O-N 2.76Å; L139-G143 PolarHBondContact O-N 3.21Å; L139-L144 HydrophobicContact CB-CB 4.42Å; L139-L144 HydrophobicContact CD2-CB 4.15Å; L139-L144 HydrophobicContact CD2-CD1 3.78Å; L139-L144 PolarHBondContact O-N 2.93Å; L139-E147 HydrophobicContact CD1-CB 4.21Å; L139-A148 HydrophobicContact CB-CB 3.84Å
140	V	90	Very high	91	Very high	9 Å²	9	41.6 Å²	41.6	6%	0.055	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-47.7	172.2	176.2	0	0	0	0	111	L81 A136 Y137 V138 S142 G143 Y145 A148 F152 I171 A172	L81-V140 HydrophobicContact CD1-CG1 4.39Å; A136-V140 WeakPolarHBondContact O-CG2 3.2Å; A136-V140 PolarHBondContact O-N 3.02Å; A136-V140 VanDerWaalsContact O-N 3.1Å; Y137-V140 WeakPolarHBondContact O-CB 3.41Å; Y137-V140 PolarHBondContact O-N 3.47Å; V138-V140 VanDerWaalsContact C-N 3.33Å; V138-V140 PolarHBondContact O-N 3.41Å; V140-S142 PolarHBondContact O-N 3.21Å; V140-G143 PolarHBondContact O-N 3.17Å; V140-G143 VanDerWaalsContact O-N 3.15Å; V140-Y145 HydrophobicContact CG1-CE1 4.47Å; V140-Y145 WeakPolarHBondContact O-CE1 3.19Å; V140-A148 HydrophobicContact CG2-CB 3.6Å; V140-F152 HydrophobicContact CG2-CE2 3.95Å; V140-I171 HydrophobicContact CG1-CG2 4.14Å; V140-A172 HydrophobicContact CG2-CB 3.92Å
141	G	86.6	Confident	91.3	Very high	50 Å²	50	44.4 Å²	44.4	52%	0.515	24%	0.235	S	C	.	.	H	α-helix	trans	-62.8	-28.9	177.9	0	0	0	0	0	113.6	Y137 V138 G143	Y137-G141 PolarHBondContact O-N 3Å; V138-G141 CarbonylContact O-C 3.27Å; V138-G141 PolarHBondContact O-N 3.15Å; G141-G143 VanDerWaalsContact C-N 3.32Å
142	S	88.6	Confident	91.6	Very high	58 Å²	58	39.6 Å²	39.6	41%	0.406	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.7	178.3	-53.8	0	0	0	0	113.6	V138 L139 V140 L144	V138-S142 WeakPolarHBondContact O-CB 3.48Å; V138-S142 PolarHBondContact O-N 3.25Å; V138-S142 PolarHBondContact O-OG 3.49Å; L139-S142 PolarHBondContact O-N 2.76Å; V140-S142 PolarHBondContact O-N 3.21Å; S142-L144 VanDerWaalsContact C-N 3.31Å; S142-L144 PolarHBondContact O-N 3.28Å
143	G	88.5	Confident	91.9	Very high	34 Å²	34	36.5 Å²	36.5	35%	0.351	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	4.9	-178.7	0	0	0	0	0	115.2	L139 V140 G141 Y145	L139-G143 PolarHBondContact O-N 3.21Å; V140-G143 PolarHBondContact O-N 3.17Å; V140-G143 VanDerWaalsContact O-N 3.15Å; G141-G143 VanDerWaalsContact C-N 3.32Å; G143-Y145 WeakPolarHBondContact O-CD2 3.32Å; G143-Y145 PolarHBondContact O-N 2.87Å
144	L	91.3	Very high	92.1	Very high	63 Å²	63	39.2 Å²	39.2	33%	0.33	22%	0.218	S	C	.	.			trans	-85.3	62.5	-180	-64.2	172.5	0	0	0	110.8	I107 L139 S142 D146 E147 A148	I107-L144 HydrophobicContact CD1-CD1 4.35Å; L139-L144 HydrophobicContact CB-CB 4.42Å; L139-L144 HydrophobicContact CD2-CB 4.15Å; L139-L144 HydrophobicContact CD2-CD1 3.78Å; L139-L144 PolarHBondContact O-N 2.93Å; S142-L144 VanDerWaalsContact C-N 3.31Å; S142-L144 PolarHBondContact O-N 3.28Å; L144-D146 PolarHBondContact O-N 3.34Å; L144-E147 HydrophobicContact CB-CB 4.42Å; L144-E147 PolarHBondContact O-N 3.44Å; L144-A148 PolarHBondContact O-N 3.41Å
145	Y	93	Very high	92.3	Very high	65 Å²	65	39.5 Å²	39.5	26%	0.255	22%	0.22	S	C	.	.	H	α-helix	trans	-65.4	-37.7	-169.4	-50.9	-54.7	0	0	0	114	V140 G143 A148 I149 K175 K176	V140-Y145 HydrophobicContact CG1-CE1 4.47Å; V140-Y145 WeakPolarHBondContact O-CE1 3.19Å; G143-Y145 WeakPolarHBondContact O-CD2 3.32Å; G143-Y145 PolarHBondContact O-N 2.87Å; Y145-A148 PolarHBondContact O-N 3.28Å; Y145-I149 WeakPolarHBondContact O-CB 3.33Å; Y145-I149 WeakPolarHBondContact O-CD1 3.27Å; Y145-I149 WeakPolarHBondContact O-CG1 3.28Å; Y145-I149 PolarHBondContact O-N 3Å; Y145-K175 HydrophobicContact CD1-CB 3.94Å; Y145-K175 HydrophobicContact CE1-CB 3.52Å; Y145-K175 HydrophobicContact CE1-CG 4.39Å; Y145-K175 HydrophobicContact CE2-CB 4.4Å; Y145-K176 HydrophobicContact CD2-CB 4.22Å; Y145-K176 HydrophobicContact CG-CB 4.22Å
146	D	92.4	Very high	92.5	Very high	102 Å²	102	38.1 Å²	38.1	55%	0.545	21%	0.213	S	C	.	.	H	α-helix	trans	-64.5	-40.6	178.6	-79.4	-55.4	0	0	0	112.5	L144 R150 K176	L144-D146 PolarHBondContact O-N 3.34Å; D146-R150 WeakPolarHBondContact O-CB 3.49Å; D146-R150 PolarHBondContact O-N 2.82Å; D146-K176 WeakPolarHBondContact OD1-CE 3.49Å; D146-K176 IonicContact OD1-NZ 2.59Å; D146-K176 PolarHBondContact OD1-NZ 3.28Å; D146-K176 IonicContact OD2-NZ 3.97Å
147	E	92.6	Very high	92.7	Very high	93 Å²	93	45.5 Å²	45.5	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-69	-43.5	176.3	-64.4	-178.9	-176.2	0	0	110.8	L139 L144 I149 R150 H151	L139-E147 HydrophobicContact CD1-CB 4.21Å; L144-E147 HydrophobicContact CB-CB 4.42Å; L144-E147 PolarHBondContact O-N 3.44Å; E147-I149 PolarHBondContact O-N 3.06Å; E147-R150 WeakPolarHBondContact O-CB 3.28Å; E147-R150 PolarHBondContact O-N 3.01Å; E147-H151 PolarHBondContact O-CD2 3.17Å; E147-H151 VanDerWaalsContact O-CD2 3.31Å; E147-H151 PolarHBondContact O-N 3.36Å
148	A	94.2	Very high	92.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.4	-46.9	174.4	0	0	0	0	0	111.9	L139 V140 L144 Y145 R150 H151 F152 A172	L139-A148 HydrophobicContact CB-CB 3.84Å; V140-A148 HydrophobicContact CG2-CB 3.6Å; L144-A148 PolarHBondContact O-N 3.41Å; Y145-A148 PolarHBondContact O-N 3.28Å; A148-R150 VanDerWaalsContact C-N 3.3Å; A148-R150 PolarHBondContact O-N 2.85Å; A148-H151 PolarHBondContact O-N 3.49Å; A148-F152 HydrophobicContact CB-CD2 4.5Å; A148-F152 HydrophobicContact CB-CE2 4.33Å; A148-F152 WeakPolarHBondContact O-CD2 3.4Å; A148-F152 PolarHBondContact O-N 3.41Å; A148-A172 HydrophobicContact CB-CB 4.39Å
149	I	95.3	Very high	92.7	Very high	14 Å²	14	56.9 Å²	56.9	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-41.3	177.2	-70.3	160.4	0	0	0	110.7	Y145 E147 S153 R169 A172 Y173 K176	Y145-I149 WeakPolarHBondContact O-CB 3.33Å; Y145-I149 WeakPolarHBondContact O-CD1 3.27Å; Y145-I149 WeakPolarHBondContact O-CG1 3.28Å; Y145-I149 PolarHBondContact O-N 3Å; E147-I149 PolarHBondContact O-N 3.06Å; I149-S153 VanDerWaalsContact O-CB 3.24Å; I149-S153 WeakPolarHBondContact O-CB 3.34Å; I149-S153 PolarHBondContact O-N 3.01Å; I149-S153 PolarHBondContact O-OG 3.44Å; I149-R169 HydrophobicContact CG2-CG 4.49Å; I149-A172 HydrophobicContact CD1-CB 4.32Å; I149-A172 HydrophobicContact CG1-CB 3.63Å; I149-Y173 HydrophobicContact CD1-CD1 3.67Å; I149-Y173 HydrophobicContact CD1-CE1 3.8Å; I149-Y173 HydrophobicContact CD1-CG 4.3Å; I149-Y173 HydrophobicContact CG1-CD1 4.33Å; I149-Y173 HydrophobicContact CG1-CE1 4.29Å; I149-Y173 HydrophobicContact CG2-CE1 3.93Å; I149-Y173 HydrophobicContact CG2-CE2 4.45Å; I149-K176 HydrophobicContact CD1-CB 4.5Å; I149-K176 HydrophobicContact CD1-CD 3.71Å
150	R	95.3	Very high	92.8	Very high	137 Å²	137	60 Å²	60	52%	0.517	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-48.3	176.2	-171.7	-173.3	61.1	68.8	4	111	D146 E147 A148 S153 T154	D146-R150 WeakPolarHBondContact O-CB 3.49Å; D146-R150 PolarHBondContact O-N 2.82Å; E147-R150 WeakPolarHBondContact O-CB 3.28Å; E147-R150 PolarHBondContact O-N 3.01Å; A148-R150 VanDerWaalsContact C-N 3.3Å; A148-R150 PolarHBondContact O-N 2.85Å; R150-S153 PolarHBondContact O-N 3.12Å; R150-T154 PolarHBondContact O-N 3.39Å; R150-T154 PolarHBondContact O-OG1 3.04Å
151	H	93.9	Very high	92.9	Very high	60 Å²	60	65 Å²	65	28%	0.278	35%	0.347	S	S	.	.	H	α-helix	trans	-57.8	-54.2	177.7	-90.6	-86.8	0	0	0	111.6	A136 E147 A148 S153 T154 M155	A136-H151 HydrophobicContact CB-CB 4.18Å; E147-H151 PolarHBondContact O-CD2 3.17Å; E147-H151 VanDerWaalsContact O-CD2 3.31Å; E147-H151 PolarHBondContact O-N 3.36Å; A148-H151 PolarHBondContact O-N 3.49Å; H151-S153 PolarHBondContact O-N 2.98Å; H151-T154 PolarHBondContact O-N 2.88Å; H151-T154 VanDerWaalsContact O-N 3.12Å; H151-M155 WeakPolarHBondContact O-CG 3.45Å; H151-M155 PolarHBondContact O-N 2.91Å; H151-M155 VanDerWaalsContact O-N 3.09Å
152	F	96.1	Very high	93.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-34.3	176.3	-69.5	-56.3	0	0	0	112.7	L133 A136 Y137 V140 A148 M155 L156 A165 G168 R169	L133-F152 HydrophobicContact CD2-CD1 4.45Å; L133-F152 HydrophobicContact CD2-CE1 4.12Å; A136-F152 HydrophobicContact CB-CD1 3.76Å; A136-F152 HydrophobicContact CB-CD2 4.24Å; A136-F152 HydrophobicContact CB-CE1 3.34Å; A136-F152 HydrophobicContact CB-CE2 3.85Å; A136-F152 HydrophobicContact CB-CG 4.2Å; A136-F152 HydrophobicContact CB-CZ 3.39Å; Y137-F152 HydrophobicContact CD1-CZ 4.41Å; Y137-F152 HydrophobicContact CD2-CE1 4.47Å; Y137-F152 HydrophobicContact CD2-CZ 4.27Å; Y137-F152 HydrophobicContact CE1-CZ 4.4Å; Y137-F152 HydrophobicContact CE2-CE1 4.23Å; Y137-F152 HydrophobicContact CE2-CZ 4.23Å; Y137-F152 HydrophobicContact CG-CZ 4.34Å; V140-F152 HydrophobicContact CG2-CE2 3.95Å; A148-F152 HydrophobicContact CB-CD2 4.5Å; A148-F152 HydrophobicContact CB-CE2 4.33Å; A148-F152 WeakPolarHBondContact O-CD2 3.4Å; A148-F152 PolarHBondContact O-N 3.41Å; F152-M155 HydrophobicContact CD1-SD 4.34Å; F152-M155 PolarHBondContact O-N 2.63Å; F152-L156 WeakPolarHBondContact O-CB 3.44Å; F152-L156 WeakPolarHBondContact O-CD1 3.31Å; F152-L156 WeakPolarHBondContact O-CG 3.46Å; F152-L156 PolarHBondContact O-N 2.79Å; F152-A165 HydrophobicContact CD1-CB 3.87Å; F152-G168 WeakPolarHBondContact CE2-O 3.23Å; F152-R169 HydrophobicContact CB-CB 3.77Å; F152-R169 HydrophobicContact CB-CG 4.23Å; F152-R169 HydrophobicContact CD2-CB 4.19Å; F152-R169 HydrophobicContact CG-CB 4.17Å
153	S	95.9	Very high	93.5	Very high	28 Å²	28	61.6 Å²	61.6	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-69.7	-35.1	178	-61.1	0	0	0	0	113.2	I149 R150 H151 L156 Q157 R169	I149-S153 VanDerWaalsContact O-CB 3.24Å; I149-S153 WeakPolarHBondContact O-CB 3.34Å; I149-S153 PolarHBondContact O-N 3.01Å; I149-S153 PolarHBondContact O-OG 3.44Å; R150-S153 PolarHBondContact O-N 3.12Å; H151-S153 PolarHBondContact O-N 2.98Å; S153-L156 PolarHBondContact O-N 3.01Å; S153-Q157 WeakPolarHBondContact O-CG 3.32Å; S153-Q157 PolarHBondContact O-N 3.38Å; S153-Q157 VanDerWaalsContact O-N 3.11Å; S153-R169 WeakPolarHBondContact OG-CD 3.35Å; S153-R169 PolarHBondContact OG-NH1 2.97Å; S153-R169 VanDerWaalsContact OG-NH1 3.17Å
154	T	95.8	Very high	93.7	Very high	56 Å²	56	60 Å²	60	34%	0.344	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-46.9	171.8	-61	0	0	0	0	110.5	R150 H151 L156 Q157 E158	R150-T154 PolarHBondContact O-N 3.39Å; R150-T154 PolarHBondContact O-OG1 3.04Å; H151-T154 PolarHBondContact O-N 2.88Å; H151-T154 VanDerWaalsContact O-N 3.12Å; T154-L156 VanDerWaalsContact C-N 3.27Å; T154-L156 PolarHBondContact O-N 3.37Å; T154-Q157 WeakPolarHBondContact O-CB 3.31Å; T154-Q157 PolarHBondContact O-N 3.01Å; T154-E158 PolarHBondContact O-N 3.13Å
155	M	93.8	Very high	93.8	Very high	7 Å²	7	57 Å²	57	3%	0.034	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-40	177.1	-58.9	175.8	80.8	0	0	111.9	T129 E132 L133 H151 F152 Q157 E158 E159 L162 A165	T129-M155 HydrophobicContact CG2-CE 4.18Å; E132-M155 HydrophobicContact CB-CE 3.56Å; E132-M155 HydrophobicContact CB-SD 4.17Å; L133-M155 HydrophobicContact CB-CE 4.4Å; L133-M155 HydrophobicContact CD2-CE 3.59Å; L133-M155 HydrophobicContact CD2-SD 4.06Å; L133-M155 HydrophobicContact CG-CE 3.57Å; H151-M155 WeakPolarHBondContact O-CG 3.45Å; H151-M155 PolarHBondContact O-N 2.91Å; H151-M155 VanDerWaalsContact O-N 3.09Å; F152-M155 HydrophobicContact CD1-SD 4.34Å; F152-M155 PolarHBondContact O-N 2.63Å; M155-Q157 VanDerWaalsContact C-N 3.29Å; M155-Q157 PolarHBondContact O-N 3.48Å; M155-E158 PolarHBondContact O-N 2.97Å; M155-E159 PolarHBondContact O-N 3.36Å; M155-L162 HydrophobicContact CB-CD2 4.32Å; M155-L162 HydrophobicContact CE-CD2 4.04Å; M155-A165 HydrophobicContact CB-CB 4.29Å
156	L	95.1	Very high	94	Very high	13 Å²	13	54 Å²	54	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-75.8	-11.7	178.1	-67.7	168.4	0	0	0	114.2	F152 S153 T154 P160 L162 A165 I166	F152-L156 WeakPolarHBondContact O-CB 3.44Å; F152-L156 WeakPolarHBondContact O-CD1 3.31Å; F152-L156 WeakPolarHBondContact O-CG 3.46Å; F152-L156 PolarHBondContact O-N 2.79Å; S153-L156 PolarHBondContact O-N 3.01Å; T154-L156 VanDerWaalsContact C-N 3.27Å; T154-L156 PolarHBondContact O-N 3.37Å; L156-P160 WeakPolarHBondContact O-CA 3.46Å; L156-L162 HydrophobicContact CD2-CB 4.19Å; L156-A165 HydrophobicContact CD1-CB 4.26Å; L156-A165 HydrophobicContact CD2-CB 3.83Å; L156-A165 HydrophobicContact CG-CB 3.82Å; L156-I166 HydrophobicContact CD1-CG1 4.26Å; L156-I166 HydrophobicContact CD2-CD1 4.43Å; L156-I166 HydrophobicContact CD2-CG1 3.49Å; L156-I166 VanDerWaalsContact CD2-CG1 3.49Å
157	Q	94.1	Very high	94.1	Very high	154 Å²	154	49.7 Å²	49.7	72%	0.72	25%	0.246	S	C	*	.	H	α-helix	trans	-75.6	-34	167.2	-74.8	170.1	0.5	0	0	111	S153 T154 M155	S153-Q157 WeakPolarHBondContact O-CG 3.32Å; S153-Q157 PolarHBondContact O-N 3.38Å; S153-Q157 VanDerWaalsContact O-N 3.11Å; T154-Q157 WeakPolarHBondContact O-CB 3.31Å; T154-Q157 PolarHBondContact O-N 3.01Å; M155-Q157 VanDerWaalsContact C-N 3.29Å; M155-Q157 PolarHBondContact O-N 3.48Å
158	E	90.9	Very high	94.1	Very high	148 Å²	148	45.3 Å²	45.3	69%	0.692	23%	0.225	S	C	*	.	H	α-helix	trans	-81.1	-47.1	178.2	-60.6	-175.5	177.5	0	0	111.2	T154 M155	T154-E158 PolarHBondContact O-N 3.13Å; M155-E158 PolarHBondContact O-N 2.97Å
159	E	92.2	Very high	94.2	Very high	94 Å²	94	46.9 Å²	46.9	44%	0.439	23%	0.231	S	C	.	.			trans	-126.9	90.3	179.8	-67.6	-174.9	-175.7	0	0	111.1	M155 D161 L162	M155-E159 PolarHBondContact O-N 3.36Å; E159-D161 VanDerWaalsContact C-N 3.25Å; E159-D161 PolarHBondContact O-N 3.33Å; E159-D161 VanDerWaalsContact O-N 3.17Å; E159-L162 HydrophobicContact CB-CB 3.93Å; E159-L162 WeakPolarHBondContact O-CB 3.3Å; E159-L162 PolarHBondContact O-N 2.68Å
160	P	92.3	Very high	94.1	Very high	74 Å²	74	46.2 Å²	46.2	48%	0.481	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.6	-173.1	-27.5	36.1	0	0	0	115.8	L156 R193	L156-P160 WeakPolarHBondContact O-CA 3.46Å; P160-R193 PolarHBondContact O-NH2 2.86Å
161	D	92.1	Very high	94	Very high	114 Å²	114	40.7 Å²	40.7	61%	0.61	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.7	13.5	-176.5	-64.7	-28	0	0	0	112.7	E159 V163	E159-D161 VanDerWaalsContact C-N 3.25Å; E159-D161 PolarHBondContact O-N 3.33Å; E159-D161 VanDerWaalsContact O-N 3.17Å; D161-V163 PolarHBondContact O-N 3.33Å
162	L	94.2	Very high	94	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.073	20%	0.195	C	C	.	.			trans	-65.9	93.4	176.6	179.8	59.5	0	0	0	111	T124 T129 L133 M155 L156 E159 S164 A165 I166	T124-L162 HydrophobicContact CG2-CD1 3.72Å; T129-L162 HydrophobicContact CG2-CD1 4.2Å; T129-L162 HydrophobicContact CG2-CD2 3.84Å; L133-L162 HydrophobicContact CD2-CD2 4.3Å; M155-L162 HydrophobicContact CB-CD2 4.32Å; M155-L162 HydrophobicContact CE-CD2 4.04Å; L156-L162 HydrophobicContact CD2-CB 4.19Å; E159-L162 HydrophobicContact CB-CB 3.93Å; E159-L162 WeakPolarHBondContact O-CB 3.3Å; E159-L162 PolarHBondContact O-N 2.68Å; L162-S164 VanDerWaalsContact C-N 3.28Å; L162-S164 PolarHBondContact O-N 3.01Å; L162-S164 VanDerWaalsContact O-N 3.17Å; L162-A165 HydrophobicContact CB-CB 4.23Å; L162-A165 HydrophobicContact CD2-CB 3.68Å; L162-A165 HydrophobicContact CG-CB 3.82Å; L162-A165 PolarHBondContact O-N 2.91Å; L162-I166 WeakPolarHBondContact O-CG1 3.31Å; L162-I166 PolarHBondContact O-N 3.47Å
163	V	93.7	Very high	93.9	Very high	24 Å²	24	39.4 Å²	39.4	15%	0.145	20%	0.201	C	C	.	.	H	α-helix	trans	-51.9	-43.8	-172.3	-178.4	0	0	0	0	112.6	F122 D161 A165 I166 Y167 V194 L197 E198	F122-V163 HydrophobicContact CB-CB 4.42Å; F122-V163 HydrophobicContact CB-CG1 4.21Å; F122-V163 HydrophobicContact CD1-CG1 3.84Å; F122-V163 HydrophobicContact CD2-CG1 4.07Å; F122-V163 HydrophobicContact CE1-CG1 4.26Å; F122-V163 HydrophobicContact CE2-CG1 4.47Å; F122-V163 HydrophobicContact CG-CB 4.48Å; F122-V163 HydrophobicContact CG-CG1 3.75Å; D161-V163 PolarHBondContact O-N 3.33Å; V163-A165 PolarHBondContact O-N 3.08Å; V163-I166 PolarHBondContact O-N 3.15Å; V163-Y167 VanDerWaalsContact O-CB 3.3Å; V163-Y167 WeakPolarHBondContact O-CB 3.36Å; V163-Y167 PolarHBondContact O-N 3.11Å; V163-V194 HydrophobicContact CG1-CG1 3.89Å; V163-L197 HydrophobicContact CG2-CB 4.21Å; V163-L197 HydrophobicContact CG2-CD1 4.03Å; V163-E198 HydrophobicContact CG1-CG 4.06Å; V163-E198 HydrophobicContact CG2-CG 4.18Å
164	S	93.5	Very high	93.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-40.7	179.3	-166.6	0	0	0	0	112.9	P121 F122 Y137 L162 G168	P121-S164 WeakPolarHBondContact O-CB 3.39Å; P121-S164 PolarHBondContact O-OG 2.69Å; F122-S164 WeakPolarHBondContact O-CB 3.42Å; Y137-S164 WeakPolarHBondContact CE2-OG 3.32Å; Y137-S164 PolarHBondContact OH-O 2.99Å; Y137-S164 PolarHBondContact OH-OG 3.09Å; L162-S164 VanDerWaalsContact C-N 3.28Å; L162-S164 PolarHBondContact O-N 3.01Å; L162-S164 VanDerWaalsContact O-N 3.17Å; S164-G168 PolarHBondContact O-N 3.07Å
165	A	94.3	Very high	93.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-73	-37	178.4	0	0	0	0	0	111.8	L133 F152 M155 L156 L162 V163 R169	L133-A165 HydrophobicContact CD2-CB 3.98Å; F152-A165 HydrophobicContact CD1-CB 3.87Å; M155-A165 HydrophobicContact CB-CB 4.29Å; L156-A165 HydrophobicContact CD1-CB 4.26Å; L156-A165 HydrophobicContact CD2-CB 3.83Å; L156-A165 HydrophobicContact CG-CB 3.82Å; L162-A165 HydrophobicContact CB-CB 4.23Å; L162-A165 HydrophobicContact CD2-CB 3.68Å; L162-A165 HydrophobicContact CG-CB 3.82Å; L162-A165 PolarHBondContact O-N 2.91Å; V163-A165 PolarHBondContact O-N 3.08Å; A165-R169 WeakPolarHBondContact O-CB 3.34Å; A165-R169 PolarHBondContact O-N 3.44Å
166	I	95.9	Very high	92.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-50	172.6	-58.8	174.1	0	0	0	109.6	L156 L162 V163 R169 G170 E190 R193 V194 L197	L156-I166 HydrophobicContact CD1-CG1 4.26Å; L156-I166 HydrophobicContact CD2-CD1 4.43Å; L156-I166 HydrophobicContact CD2-CG1 3.49Å; L156-I166 VanDerWaalsContact CD2-CG1 3.49Å; L162-I166 WeakPolarHBondContact O-CG1 3.31Å; L162-I166 PolarHBondContact O-N 3.47Å; V163-I166 PolarHBondContact O-N 3.15Å; I166-R169 PolarHBondContact O-N 2.78Å; I166-G170 PolarHBondContact O-N 3.39Å; I166-E190 HydrophobicContact CG2-CB 4.11Å; I166-E190 WeakPolarHBondContact CG2-O 3.49Å; I166-E190 WeakPolarHBondContact CG2-OE2 3.48Å; I166-R193 HydrophobicContact CG2-CB 3.94Å; I166-V194 HydrophobicContact CB-CG2 3.93Å; I166-V194 HydrophobicContact CG2-CG2 3.53Å; I166-L197 HydrophobicContact CD1-CD1 3.7Å
167	Y	95.1	Very high	92.2	Very high	13 Å²	13	44.4 Å²	44.4	5%	0.051	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-49.8	-179.9	-176.7	-107.4	0	0	0	112.1	P121 F122 V163 R169 G170 I171 L191 V194 V204 Q207	P121-Y167 HydrophobicContact CB-CD1 3.59Å; P121-Y167 HydrophobicContact CB-CE1 3.51Å; P121-Y167 HydrophobicContact CG-CD1 3.94Å; P121-Y167 HydrophobicContact CG-CE1 3.55Å; F122-Y167 AromaticContact CD2-CD1 3.99Å; F122-Y167 HydrophobicContact CD2-CD1 3.99Å; F122-Y167 AromaticContact CD2-CG 3.96Å; F122-Y167 HydrophobicContact CD2-CG 3.96Å; F122-Y167 AromaticContact CE2-CD1 3.76Å; F122-Y167 HydrophobicContact CE2-CD1 3.76Å; F122-Y167 AromaticContact CE2-CD2 3.83Å; F122-Y167 HydrophobicContact CE2-CD2 3.83Å; F122-Y167 HydrophobicContact CE2-CE1 4.14Å; F122-Y167 HydrophobicContact CE2-CE2 4.23Å; F122-Y167 AromaticContact CE2-CG 3.56Å; F122-Y167 HydrophobicContact CE2-CG 3.56Å; V163-Y167 VanDerWaalsContact O-CB 3.3Å; V163-Y167 WeakPolarHBondContact O-CB 3.36Å; V163-Y167 PolarHBondContact O-N 3.11Å; Y167-R169 VanDerWaalsContact C-N 3.33Å; Y167-R169 PolarHBondContact O-N 2.97Å; Y167-G170 PolarHBondContact O-N 3.43Å; Y167-I171 HydrophobicContact CD1-CD1 3.69Å; Y167-I171 HydrophobicContact CE1-CD1 3.21Å; Y167-I171 HydrophobicContact CE1-CG1 4.31Å; Y167-I171 HydrophobicContact CE2-CD1 4.27Å; Y167-I171 HydrophobicContact CG-CD1 4.41Å; Y167-I171 PolarHBondContact O-N 2.95Å; Y167-L191 HydrophobicContact CD2-CD2 3.72Å; Y167-L191 HydrophobicContact CE2-CD2 3.87Å; Y167-V194 HydrophobicContact CD2-CG1 4.35Å; Y167-V194 HydrophobicContact CD2-CG2 4.37Å; Y167-V204 HydrophobicContact CD2-CG1 4.29Å; Y167-V204 HydrophobicContact CD2-CG2 4.18Å; Y167-V204 HydrophobicContact CE2-CB 4.36Å; Y167-V204 HydrophobicContact CE2-CG1 4.28Å; Y167-V204 HydrophobicContact CE2-CG2 3.97Å; Y167-Q207 HydrophobicContact CE2-CB 4.5Å; Y167-Q207 HydrophobicContact CE2-CG 4.18Å; Y167-Q207 WeakPolarHBondContact OH-CG 3.47Å
168	G	93.3	Very high	91.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-40.2	177.6	0	0	0	0	0	112.7	Y137 F152 S164 I171 A172	Y137-G168 PolarHBondContact OH-N 3.32Å; F152-G168 WeakPolarHBondContact CE2-O 3.23Å; S164-G168 PolarHBondContact O-N 3.07Å; G168-I171 PolarHBondContact O-N 3.15Å; G168-A172 WeakPolarHBondContact O-CB 3.49Å; G168-A172 PolarHBondContact O-N 2.72Å
169	R	95.3	Very high	90.5	Very high	34 Å²	34	40.7 Å²	40.7	13%	0.128	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-41.4	174.3	-167.8	166.1	73.7	-172.2	-5.6	112.2	I149 F152 S153 A165 I166 Y167 A172 Y173 E190	I149-R169 HydrophobicContact CG2-CG 4.49Å; F152-R169 HydrophobicContact CB-CB 3.77Å; F152-R169 HydrophobicContact CB-CG 4.23Å; F152-R169 HydrophobicContact CD2-CB 4.19Å; F152-R169 HydrophobicContact CG-CB 4.17Å; S153-R169 WeakPolarHBondContact OG-CD 3.35Å; S153-R169 PolarHBondContact OG-NH1 2.97Å; S153-R169 VanDerWaalsContact OG-NH1 3.17Å; A165-R169 WeakPolarHBondContact O-CB 3.34Å; A165-R169 PolarHBondContact O-N 3.44Å; I166-R169 PolarHBondContact O-N 2.78Å; Y167-R169 VanDerWaalsContact C-N 3.33Å; Y167-R169 PolarHBondContact O-N 2.97Å; R169-A172 PolarHBondContact O-N 3.39Å; R169-Y173 HydrophobicContact CG-CD2 3.97Å; R169-Y173 HydrophobicContact CG-CE2 3.6Å; R169-Y173 VanDerWaalsContact O-CD2 3.23Å; R169-Y173 WeakPolarHBondContact O-CD2 3.33Å; R169-Y173 PolarHBondContact O-N 2.84Å; R169-E190 IonicContact CZ-OE1 3.9Å; R169-E190 IonicContact NE-OE1 3.66Å; R169-E190 PolarHBondContact NE-OE1 2.99Å; R169-E190 IonicContact NH2-OE1 3.09Å; R169-E190 PolarHBondContact NH2-OE1 3.04Å; R169-E190 IonicContact NH2-OE2 3.11Å; R169-E190 PolarHBondContact NH2-OE2 3.14Å
170	G	93.9	Very high	90.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-46.9	174.4	0	0	0	0	0	112.5	I166 Y167 A172 Y173 G174 A187	I166-G170 PolarHBondContact O-N 3.39Å; Y167-G170 PolarHBondContact O-N 3.43Å; G170-A172 PolarHBondContact O-N 3.32Å; G170-Y173 PolarHBondContact O-N 3.17Å; G170-G174 PolarHBondContact O-N 3.13Å; G170-A187 VanDerWaalsContact O-CB 3.31Å; G170-A187 WeakPolarHBondContact O-CB 3.5Å
171	I	93	Very high	89.8	Confident	20 Å²	20	42 Å²	42	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-45.4	174.8	-67.9	171.9	0	0	0	110.8	V140 Y167 G168 Y173 G174 K175	V140-I171 HydrophobicContact CG1-CG2 4.14Å; Y167-I171 HydrophobicContact CD1-CD1 3.69Å; Y167-I171 HydrophobicContact CE1-CD1 3.21Å; Y167-I171 HydrophobicContact CE1-CG1 4.31Å; Y167-I171 HydrophobicContact CE2-CD1 4.27Å; Y167-I171 HydrophobicContact CG-CD1 4.41Å; Y167-I171 PolarHBondContact O-N 2.95Å; G168-I171 PolarHBondContact O-N 3.15Å; I171-Y173 VanDerWaalsContact C-N 3.33Å; I171-Y173 PolarHBondContact O-N 3.03Å; I171-G174 PolarHBondContact O-N 3.38Å; I171-G174 VanDerWaalsContact O-N 3.12Å; I171-K175 HydrophobicContact CG2-CG 4.18Å; I171-K175 WeakPolarHBondContact O-CB 3.13Å; I171-K175 PolarHBondContact O-N 3.13Å
172	A	93.6	Very high	89.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-41.7	-179.7	0	0	0	0	0	111.7	V140 A148 I149 G168 R169 G170 K175 K176	V140-A172 HydrophobicContact CG2-CB 3.92Å; A148-A172 HydrophobicContact CB-CB 4.39Å; I149-A172 HydrophobicContact CD1-CB 4.32Å; I149-A172 HydrophobicContact CG1-CB 3.63Å; G168-A172 WeakPolarHBondContact O-CB 3.49Å; G168-A172 PolarHBondContact O-N 2.72Å; R169-A172 PolarHBondContact O-N 3.39Å; G170-A172 PolarHBondContact O-N 3.32Å; A172-K175 PolarHBondContact O-N 3.28Å; A172-K176 VanDerWaalsContact O-CB 3.22Å; A172-K176 WeakPolarHBondContact O-CB 3.25Å; A172-K176 PolarHBondContact O-N 3.43Å
173	Y	93.9	Very high	89.5	Confident	34 Å²	34	43.7 Å²	43.7	13%	0.133	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-43.1	172.1	-79.5	-55.4	0	0	0	112.6	I149 R169 G170 I171 L186 E190	I149-Y173 HydrophobicContact CD1-CD1 3.67Å; I149-Y173 HydrophobicContact CD1-CE1 3.8Å; I149-Y173 HydrophobicContact CD1-CG 4.3Å; I149-Y173 HydrophobicContact CG1-CD1 4.33Å; I149-Y173 HydrophobicContact CG1-CE1 4.29Å; I149-Y173 HydrophobicContact CG2-CE1 3.93Å; I149-Y173 HydrophobicContact CG2-CE2 4.45Å; R169-Y173 HydrophobicContact CG-CD2 3.97Å; R169-Y173 HydrophobicContact CG-CE2 3.6Å; R169-Y173 VanDerWaalsContact O-CD2 3.23Å; R169-Y173 WeakPolarHBondContact O-CD2 3.33Å; R169-Y173 PolarHBondContact O-N 2.84Å; G170-Y173 PolarHBondContact O-N 3.17Å; I171-Y173 VanDerWaalsContact C-N 3.33Å; I171-Y173 PolarHBondContact O-N 3.03Å; Y173-L186 HydrophobicContact CD1-CB 4.16Å; Y173-L186 HydrophobicContact CD1-CD1 4.17Å; Y173-L186 HydrophobicContact CD2-CB 3.85Å; Y173-L186 HydrophobicContact CE1-CB 4.31Å; Y173-L186 HydrophobicContact CE1-CD1 3.7Å; Y173-L186 HydrophobicContact CE2-CB 3.99Å; Y173-L186 HydrophobicContact CE2-CD1 4.42Å; Y173-L186 HydrophobicContact CG-CB 3.96Å; Y173-E190 HydrophobicContact CD2-CG 4.34Å; Y173-E190 HydrophobicContact CE2-CG 4.46Å
174	G	88.6	Confident	89.4	Confident	11 Å²	11	42.5 Å²	42.5	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-62.5	-44.9	177.4	0	0	0	0	0	112.7	G170 I171 L178	G170-G174 PolarHBondContact O-N 3.13Å; I171-G174 PolarHBondContact O-N 3.38Å; I171-G174 VanDerWaalsContact O-N 3.12Å; G174-L178 WeakPolarHBondContact O-CD2 3.49Å
175	K	88.3	Confident	89.3	Confident	103 Å²	103	46.6 Å²	46.6	45%	0.448	23%	0.225	S	C	.	.	H	α-helix	trans	-73.2	-32.2	179.7	-74.4	-72.4	-169.4	172.6	0	113.3	D56 Y145 I171 A172 G177	D56-K175 IonicContact OD2-NZ 3.13Å; D56-K175 PolarHBondContact OD2-NZ 3.35Å; Y145-K175 HydrophobicContact CD1-CB 3.94Å; Y145-K175 HydrophobicContact CE1-CB 3.52Å; Y145-K175 HydrophobicContact CE1-CG 4.39Å; Y145-K175 HydrophobicContact CE2-CB 4.4Å; I171-K175 HydrophobicContact CG2-CG 4.18Å; I171-K175 WeakPolarHBondContact O-CB 3.13Å; I171-K175 PolarHBondContact O-N 3.13Å; A172-K175 PolarHBondContact O-N 3.28Å; K175-G177 PolarHBondContact O-N 3.36Å
176	K	88.2	Confident	89.3	Confident	76 Å²	76	49.1 Å²	49.1	33%	0.33	24%	0.238	S	C	.	.	H	α-helix	trans	-56.7	-30.2	175.3	-175.7	174.7	171.7	-176.2	0	112.8	Y145 D146 I149 A172	Y145-K176 HydrophobicContact CD2-CB 4.22Å; Y145-K176 HydrophobicContact CG-CB 4.22Å; D146-K176 WeakPolarHBondContact OD1-CE 3.49Å; D146-K176 IonicContact OD1-NZ 2.59Å; D146-K176 PolarHBondContact OD1-NZ 3.28Å; D146-K176 IonicContact OD2-NZ 3.97Å; I149-K176 HydrophobicContact CD1-CB 4.5Å; I149-K176 HydrophobicContact CD1-CD 3.71Å; A172-K176 VanDerWaalsContact O-CB 3.22Å; A172-K176 WeakPolarHBondContact O-CB 3.25Å; A172-K176 PolarHBondContact O-N 3.43Å
177	G	79.1	Confident	89.3	Confident	19 Å²	19	49.1 Å²	49.1	20%	0.196	24%	0.238	C	C	.	.			trans	147	120.6	165.3	0	0	0	0	0	113.1	K175 H179 D180	K175-G177 PolarHBondContact O-N 3.36Å; G177-H179 PolarHBondContact O-N 3.12Å; G177-D180 PolarHBondContact O-N 3.38Å
178	L	75.8	Confident	89.3	Confident	53 Å²	53	48.9 Å²	48.9	28%	0.277	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-7.2	176.6	-57.9	179.4	0	0	0	113.7	G174 D180 A184 I211 P214	G174-L178 WeakPolarHBondContact O-CD2 3.49Å; L178-D180 VanDerWaalsContact C-N 3.28Å; L178-A184 HydrophobicContact CD2-CB 4.24Å; L178-I211 HydrophobicContact CD2-CG1 4.31Å; L178-I211 HydrophobicContact CD2-CG2 3.88Å; L178-P214 HydrophobicContact CD1-CB 4.42Å; L178-P214 HydrophobicContact CD1-CG 3.48Å; L178-P214 VanDerWaalsContact CD1-CG 3.48Å
179	H	73.5	Confident	89.4	Confident	170 Å²	170	54.5 Å²	54.5	79%	0.787	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.3	174.6	-61.4	-56.7	0	0	0	112.5	G177	G177-H179 PolarHBondContact O-N 3.12Å
180	D	84.6	Confident	89.4	Confident	75 Å²	75	53.1 Å²	53.1	40%	0.401	26%	0.257	S	S	.	.	S	Bend	trans	-90.9	108.1	170.4	-177.9	-1.1	0	0	0	109	G177 L178 K182 N183 A184	G177-D180 PolarHBondContact O-N 3.38Å; L178-D180 VanDerWaalsContact C-N 3.28Å; D180-K182 PolarHBondContact O-N 3.3Å; D180-K182 VanDerWaalsContact O-N 3.1Å; D180-K182 VanDerWaalsContact OD1-CB 3.25Å; D180-K182 WeakPolarHBondContact OD1-CB 3.48Å; D180-K182 PolarHBondContact OD1-N 3.21Å; D180-N183 HydrophobicContact CB-CB 4.33Å; D180-N183 WeakPolarHBondContact CB-ND2 3.19Å; D180-N183 PolarHBondContact O-N 2.92Å; D180-N183 PolarHBondContact OD2-ND2 3.26Å; D180-A184 PolarHBondContact O-N 3.3Å; D180-A184 VanDerWaalsContact O-N 3.09Å
181	I	85.9	Confident	89.6	Confident	121 Å²	121	53.1 Å²	53.1	62%	0.621	26%	0.257	S	S	*	.	H	α-helix	trans	-53.5	-33.5	178.9	-62	173.4	0	0	0	110.6	A184 E185	I181-A184 PolarHBondContact O-N 3.3Å; I181-E185 HydrophobicContact CG2-CG 4.21Å; I181-E185 WeakPolarHBondContact O-CG 3.37Å; I181-E185 PolarHBondContact O-N 2.72Å
182	K	90.4	Very high	89.7	Confident	147 Å²	147	54.4 Å²	54.4	64%	0.639	27%	0.268	S	S	*	.	H	α-helix	trans	-65.3	-44.8	179.4	-171.9	-178	176.8	-175.4	0	111.8	D180 A184 E185 L186	D180-K182 PolarHBondContact O-N 3.3Å; D180-K182 VanDerWaalsContact O-N 3.1Å; D180-K182 VanDerWaalsContact OD1-CB 3.25Å; D180-K182 WeakPolarHBondContact OD1-CB 3.48Å; D180-K182 PolarHBondContact OD1-N 3.21Å; K182-A184 VanDerWaalsContact C-N 3.33Å; K182-E185 PolarHBondContact O-N 2.96Å; K182-L186 HydrophobicContact CG-CD1 4.29Å; K182-L186 WeakPolarHBondContact O-CB 3.35Å; K182-L186 VanDerWaalsContact O-CG 3.27Å; K182-L186 WeakPolarHBondContact O-CG 3.26Å; K182-L186 PolarHBondContact O-N 2.72Å
183	N	90.3	Very high	89.8	Confident	16 Å²	16	57.4 Å²	57.4	9%	0.086	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-39.1	177.9	-65.4	-35.6	0	0	0	110.7	D180 L186 A187	D180-N183 HydrophobicContact CB-CB 4.33Å; D180-N183 WeakPolarHBondContact CB-ND2 3.19Å; D180-N183 PolarHBondContact O-N 2.92Å; D180-N183 PolarHBondContact OD2-ND2 3.26Å; N183-L186 PolarHBondContact O-N 3.28Å; N183-A187 WeakPolarHBondContact O-CB 3.25Å; N183-A187 PolarHBondContact O-N 2.68Å
184	A	90.1	Very high	89.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-46.7	176.3	0	0	0	0	0	112.1	L178 D180 I181 K182 L186 A187 L188 L215	L178-A184 HydrophobicContact CD2-CB 4.24Å; D180-A184 PolarHBondContact O-N 3.3Å; D180-A184 VanDerWaalsContact O-N 3.09Å; I181-A184 PolarHBondContact O-N 3.3Å; K182-A184 VanDerWaalsContact C-N 3.33Å; A184-L186 PolarHBondContact O-N 3.2Å; A184-A187 WeakPolarHBondContact O-CB 3.48Å; A184-A187 PolarHBondContact O-N 3.3Å; A184-L188 VanDerWaalsContact O-CG 3.31Å; A184-L188 WeakPolarHBondContact O-CG 3.2Å; A184-L188 PolarHBondContact O-N 3.28Å; A184-L215 HydrophobicContact CB-CD1 3.99Å; A184-L215 HydrophobicContact CB-CD2 3.88Å; A184-L215 HydrophobicContact CB-CG 4.46Å
185	E	93.2	Very high	90.3	Very high	86 Å²	86	56.3 Å²	56.3	40%	0.402	27%	0.273	S	S	.	.	H	α-helix	trans	-65.9	-36.6	176.8	-70	-60.7	147.1	0	0	112.5	I181 K182 L188 F189 R217	I181-E185 HydrophobicContact CG2-CG 4.21Å; I181-E185 WeakPolarHBondContact O-CG 3.37Å; I181-E185 PolarHBondContact O-N 2.72Å; K182-E185 PolarHBondContact O-N 2.96Å; E185-L188 PolarHBondContact O-N 3.34Å; E185-F189 WeakPolarHBondContact O-CB 3.46Å; E185-F189 PolarHBondContact O-N 3.31Å; E185-R217 IonicContact OE1-NH1 3.6Å; E185-R217 PolarHBondContact OE1-NH1 3.22Å; E185-R217 VanDerWaalsContact OE1-NH1 3.13Å; E185-R217 IonicContact OE2-NH1 2.78Å; E185-R217 PolarHBondContact OE2-NH1 3.14Å
186	L	94.3	Very high	90.6	Very high	53 Å²	53	55.3 Å²	55.3	28%	0.277	28%	0.284	S	S	.	.	H	α-helix	trans	-63	-43.1	172.3	-73.6	170.7	0	0	0	111.5	Y173 K182 N183 A184 L188 F189 E190	Y173-L186 HydrophobicContact CD1-CB 4.16Å; Y173-L186 HydrophobicContact CD1-CD1 4.17Å; Y173-L186 HydrophobicContact CD2-CB 3.85Å; Y173-L186 HydrophobicContact CE1-CB 4.31Å; Y173-L186 HydrophobicContact CE1-CD1 3.7Å; Y173-L186 HydrophobicContact CE2-CB 3.99Å; Y173-L186 HydrophobicContact CE2-CD1 4.42Å; Y173-L186 HydrophobicContact CG-CB 3.96Å; K182-L186 HydrophobicContact CG-CD1 4.29Å; K182-L186 WeakPolarHBondContact O-CB 3.35Å; K182-L186 VanDerWaalsContact O-CG 3.27Å; K182-L186 WeakPolarHBondContact O-CG 3.26Å; K182-L186 PolarHBondContact O-N 2.72Å; N183-L186 PolarHBondContact O-N 3.28Å; A184-L186 PolarHBondContact O-N 3.2Å; L186-L188 PolarHBondContact O-N 3.31Å; L186-F189 WeakPolarHBondContact O-CB 3.34Å; L186-F189 PolarHBondContact O-N 3.04Å; L186-E190 WeakPolarHBondContact O-CG 3.37Å; L186-E190 PolarHBondContact O-N 2.77Å
187	A	94.9	Very high	90.9	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-46.2	176.2	0	0	0	0	0	111.8	G170 N183 A184 F189 E190 L191 I211	G170-A187 VanDerWaalsContact O-CB 3.31Å; G170-A187 WeakPolarHBondContact O-CB 3.5Å; N183-A187 WeakPolarHBondContact O-CB 3.25Å; N183-A187 PolarHBondContact O-N 2.68Å; A184-A187 WeakPolarHBondContact O-CB 3.48Å; A184-A187 PolarHBondContact O-N 3.3Å; A187-F189 VanDerWaalsContact C-N 3.32Å; A187-F189 PolarHBondContact O-N 3.18Å; A187-E190 PolarHBondContact O-N 3.5Å; A187-L191 WeakPolarHBondContact O-CG 3.37Å; A187-L191 PolarHBondContact O-N 2.99Å; A187-I211 HydrophobicContact CB-CD1 3.78Å
188	L	95.4	Very high	91.5	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-38.5	176.7	-66.9	177.2	0	0	0	112.3	A184 E185 L186 S192 R208 I211 L212 L215 R217	A184-L188 VanDerWaalsContact O-CG 3.31Å; A184-L188 WeakPolarHBondContact O-CG 3.2Å; A184-L188 PolarHBondContact O-N 3.28Å; E185-L188 PolarHBondContact O-N 3.34Å; L186-L188 PolarHBondContact O-N 3.31Å; L188-S192 VanDerWaalsContact O-CB 3.31Å; L188-S192 WeakPolarHBondContact O-CB 3.48Å; L188-S192 PolarHBondContact O-N 3.43Å; L188-S192 PolarHBondContact O-OG 3.47Å; L188-R208 HydrophobicContact CD2-CG 3.61Å; L188-I211 HydrophobicContact CD2-CB 4Å; L188-I211 HydrophobicContact CD2-CG2 3.64Å; L188-I211 HydrophobicContact CG-CG2 3.92Å; L188-L212 HydrophobicContact CD1-CD2 3.7Å; L188-L212 HydrophobicContact CD2-CD2 3.71Å; L188-L212 HydrophobicContact CD2-CG 3.68Å; L188-L212 HydrophobicContact CG-CD2 4.37Å; L188-L215 HydrophobicContact CD1-CD1 3.84Å; L188-R217 VanDerWaalsContact CD1-NH1 3.32Å
189	F	95.7	Very high	92.3	Very high	118 Å²	118	58.7 Å²	58.7	52%	0.518	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-50.5	175.8	174.8	-101.3	0	0	0	111.5	E185 L186 A187 L191 S192 R193	E185-F189 WeakPolarHBondContact O-CB 3.46Å; E185-F189 PolarHBondContact O-N 3.31Å; L186-F189 WeakPolarHBondContact O-CB 3.34Å; L186-F189 PolarHBondContact O-N 3.04Å; A187-F189 VanDerWaalsContact C-N 3.32Å; A187-F189 PolarHBondContact O-N 3.18Å; F189-L191 PolarHBondContact O-N 3.03Å; F189-S192 WeakPolarHBondContact O-CB 3.42Å; F189-S192 PolarHBondContact O-N 3.3Å; F189-R193 HydrophobicContact CE1-CG 4.3Å; F189-R193 HydrophobicContact CZ-CG 4.27Å; F189-R193 PolarHBondContact O-N 3.32Å
190	E	95.8	Very high	93.2	Very high	5 Å²	5	56.1 Å²	56.1	2%	0.023	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-44.5	178.8	-62.3	-59.8	176.1	0	0	112	I166 R169 Y173 L186 A187 S192 R193 V194	I166-E190 HydrophobicContact CG2-CB 4.11Å; I166-E190 WeakPolarHBondContact CG2-O 3.49Å; I166-E190 WeakPolarHBondContact CG2-OE2 3.48Å; R169-E190 IonicContact CZ-OE1 3.9Å; R169-E190 IonicContact NE-OE1 3.66Å; R169-E190 PolarHBondContact NE-OE1 2.99Å; R169-E190 IonicContact NH2-OE1 3.09Å; R169-E190 PolarHBondContact NH2-OE1 3.04Å; R169-E190 IonicContact NH2-OE2 3.11Å; R169-E190 PolarHBondContact NH2-OE2 3.14Å; Y173-E190 HydrophobicContact CD2-CG 4.34Å; Y173-E190 HydrophobicContact CE2-CG 4.46Å; L186-E190 WeakPolarHBondContact O-CG 3.37Å; L186-E190 PolarHBondContact O-N 2.77Å; A187-E190 PolarHBondContact O-N 3.5Å; E190-S192 VanDerWaalsContact C-N 3.26Å; E190-S192 PolarHBondContact O-N 3.17Å; E190-R193 WeakPolarHBondContact O-CB 3.46Å; E190-R193 PolarHBondContact O-N 3.24Å; E190-R193 IonicContact OE2-CZ 2.65Å; E190-R193 IonicContact OE2-NH1 2.88Å; E190-R193 PolarHBondContact OE2-NH1 3.38Å; E190-V194 WeakPolarHBondContact O-CG2 3.32Å; E190-V194 PolarHBondContact O-N 3.44Å
191	L	96.1	Very high	93.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-33.5	177.5	-67.6	173.3	0	0	0	112.2	Y167 A187 F189 R193 V194 I195 V204 Q207 R208 I211	Y167-L191 HydrophobicContact CD2-CD2 3.72Å; Y167-L191 HydrophobicContact CE2-CD2 3.87Å; A187-L191 WeakPolarHBondContact O-CG 3.37Å; A187-L191 PolarHBondContact O-N 2.99Å; F189-L191 PolarHBondContact O-N 3.03Å; L191-R193 VanDerWaalsContact C-N 3.33Å; L191-V194 PolarHBondContact O-N 3.12Å; L191-I195 WeakPolarHBondContact O-CG1 3.21Å; L191-I195 PolarHBondContact O-N 3.25Å; L191-V204 HydrophobicContact CB-CG1 4.43Å; L191-V204 HydrophobicContact CD2-CG1 4.05Å; L191-Q207 HydrophobicContact CD1-CB 4.23Å; L191-Q207 HydrophobicContact CD2-CB 4.34Å; L191-R208 HydrophobicContact CB-CB 4.2Å; L191-R208 HydrophobicContact CB-CG 4.22Å; L191-R208 HydrophobicContact CD1-CB 3.96Å; L191-R208 HydrophobicContact CD1-CG 4.3Å; L191-I211 HydrophobicContact CD1-CD1 3.54Å
192	S	96.8	Very high	93.9	Very high	48 Å²	48	52 Å²	52	34%	0.336	27%	0.267	S	S	.	.	H	α-helix	trans	-68.1	-33.3	173.7	-58.2	0	0	0	0	112.4	L188 F189 E190 I195 A196 R208	L188-S192 VanDerWaalsContact O-CB 3.31Å; L188-S192 WeakPolarHBondContact O-CB 3.48Å; L188-S192 PolarHBondContact O-N 3.43Å; L188-S192 PolarHBondContact O-OG 3.47Å; F189-S192 WeakPolarHBondContact O-CB 3.42Å; F189-S192 PolarHBondContact O-N 3.3Å; E190-S192 VanDerWaalsContact C-N 3.26Å; E190-S192 PolarHBondContact O-N 3.17Å; S192-I195 PolarHBondContact O-N 3.41Å; S192-A196 PolarHBondContact O-N 3.1Å; S192-A196 VanDerWaalsContact O-N 3.08Å; S192-R208 PolarHBondContact OG-NH1 2.82Å
193	R	96.1	Very high	93.9	Very high	63 Å²	63	47.2 Å²	47.2	24%	0.238	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-44.5	171.1	-68.4	175.7	64.9	-146.4	-0.3	111.3	P160 I166 F189 E190 L191 I195 A196 L197	P160-R193 PolarHBondContact O-NH2 2.86Å; I166-R193 HydrophobicContact CG2-CB 3.94Å; F189-R193 HydrophobicContact CE1-CG 4.3Å; F189-R193 HydrophobicContact CZ-CG 4.27Å; F189-R193 PolarHBondContact O-N 3.32Å; E190-R193 WeakPolarHBondContact O-CB 3.46Å; E190-R193 PolarHBondContact O-N 3.24Å; E190-R193 IonicContact OE2-CZ 2.65Å; E190-R193 IonicContact OE2-NH1 2.88Å; E190-R193 PolarHBondContact OE2-NH1 3.38Å; L191-R193 VanDerWaalsContact C-N 3.33Å; R193-I195 VanDerWaalsContact C-N 3.32Å; R193-I195 PolarHBondContact O-N 2.84Å; R193-A196 WeakPolarHBondContact O-CB 3.4Å; R193-A196 PolarHBondContact O-N 3.05Å; R193-A196 VanDerWaalsContact O-N 3.15Å; R193-L197 WeakPolarHBondContact O-CG 3.32Å; R193-L197 PolarHBondContact O-N 3.4Å; R193-L197 VanDerWaalsContact O-N 3.11Å
194	V	95.9	Very high	94.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-45.6	175.6	178.3	0	0	0	0	110.6	F122 V163 I166 Y167 E190 L191 A196 L197 E198 V204	F122-V194 HydrophobicContact CE2-CG1 4.38Å; F122-V194 HydrophobicContact CZ-CG1 4.27Å; V163-V194 HydrophobicContact CG1-CG1 3.89Å; I166-V194 HydrophobicContact CB-CG2 3.93Å; I166-V194 HydrophobicContact CG2-CG2 3.53Å; Y167-V194 HydrophobicContact CD2-CG1 4.35Å; Y167-V194 HydrophobicContact CD2-CG2 4.37Å; E190-V194 WeakPolarHBondContact O-CG2 3.32Å; E190-V194 PolarHBondContact O-N 3.44Å; L191-V194 PolarHBondContact O-N 3.12Å; V194-A196 VanDerWaalsContact C-N 3.27Å; V194-A196 PolarHBondContact O-N 3.18Å; V194-L197 PolarHBondContact O-N 2.89Å; V194-L197 VanDerWaalsContact O-N 3.15Å; V194-E198 PolarHBondContact O-N 3.39Å; V194-V204 HydrophobicContact CB-CG1 3.82Å; V194-V204 HydrophobicContact CG1-CB 4.25Å; V194-V204 HydrophobicContact CG1-CG1 3.65Å; V194-V204 HydrophobicContact CG1-CG2 3.6Å
195	I	95.4	Very high	94.4	Very high	21 Å²	21	47.1 Å²	47.1	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-33.7	177.9	-71	163.6	0	0	0	112.3	L191 S192 R193 P199 V204 F205	L191-I195 WeakPolarHBondContact O-CG1 3.21Å; L191-I195 PolarHBondContact O-N 3.25Å; S192-I195 PolarHBondContact O-N 3.41Å; R193-I195 VanDerWaalsContact C-N 3.32Å; R193-I195 PolarHBondContact O-N 2.84Å; I195-P199 WeakPolarHBondContact O-CA 3.31Å; I195-V204 HydrophobicContact CD1-CG1 4.11Å; I195-V204 HydrophobicContact CG1-CB 4.13Å; I195-V204 HydrophobicContact CG1-CG1 3.64Å; I195-F205 HydrophobicContact CD1-CD1 3.83Å; I195-F205 HydrophobicContact CD1-CE1 3.88Å; I195-F205 HydrophobicContact CD1-CG 4.3Å; I195-F205 HydrophobicContact CD1-CZ 4.39Å; I195-F205 HydrophobicContact CG1-CD1 4.4Å; I195-F205 HydrophobicContact CG1-CE1 4.16Å; I195-F205 HydrophobicContact CG1-CE2 4.41Å; I195-F205 HydrophobicContact CG1-CZ 4.16Å; I195-F205 HydrophobicContact CG2-CE1 3.76Å; I195-F205 HydrophobicContact CG2-CE2 4.45Å; I195-F205 HydrophobicContact CG2-CZ 3.59Å
196	A	95.4	Very high	94.4	Very high	83 Å²	83	44 Å²	44	69%	0.686	23%	0.231	S	C	*	.	H	α-helix	trans	-70.7	-33	176.9	0	0	0	0	0	112.7	S192 R193 V194	S192-A196 PolarHBondContact O-N 3.1Å; S192-A196 VanDerWaalsContact O-N 3.08Å; R193-A196 WeakPolarHBondContact O-CB 3.4Å; R193-A196 PolarHBondContact O-N 3.05Å; R193-A196 VanDerWaalsContact O-N 3.15Å; V194-A196 VanDerWaalsContact C-N 3.27Å; V194-A196 PolarHBondContact O-N 3.18Å
197	L	93.9	Very high	94.4	Very high	71 Å²	71	43.5 Å²	43.5	37%	0.372	23%	0.227	S	C	.	.	H	α-helix	trans	-82.2	-40.2	177.7	-66	171.4	0	0	0	111.9	V163 I166 R193 V194	V163-L197 HydrophobicContact CG2-CB 4.21Å; V163-L197 HydrophobicContact CG2-CD1 4.03Å; I166-L197 HydrophobicContact CD1-CD1 3.7Å; R193-L197 WeakPolarHBondContact O-CG 3.32Å; R193-L197 PolarHBondContact O-N 3.4Å; R193-L197 VanDerWaalsContact O-N 3.11Å; V194-L197 PolarHBondContact O-N 2.89Å; V194-L197 VanDerWaalsContact O-N 3.15Å
198	E	92.5	Very high	94.3	Very high	83 Å²	83	45.5 Å²	45.5	39%	0.388	24%	0.235	S	C	.	.			trans	-132	77.3	-172.5	-70.7	-67.4	166.1	0	0	110.8	V163 V194 D200 R201	V163-E198 HydrophobicContact CG1-CG 4.06Å; V163-E198 HydrophobicContact CG2-CG 4.18Å; V194-E198 PolarHBondContact O-N 3.39Å; E198-D200 VanDerWaalsContact C-N 3.28Å; E198-D200 PolarHBondContact O-N 2.47Å; E198-R201 HydrophobicContact CB-CG 3.81Å
199	P	92.4	Very high	94.3	Very high	64 Å²	64	45.1 Å²	45.1	42%	0.416	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.6	-171.7	29.3	-36.4	0	0	0	114.7	I195 F205	I195-P199 WeakPolarHBondContact O-CA 3.31Å; P199-F205 WeakPolarHBondContact O-CE2 3.24Å
200	D	92.9	Very high	94	Very high	116 Å²	116	41.3 Å²	41.3	62%	0.62	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.5	15.9	-174.2	-63.9	-33.7	0	0	0	113.1	E198 P202	E198-D200 VanDerWaalsContact C-N 3.28Å; E198-D200 PolarHBondContact O-N 2.47Å; D200-P202 WeakPolarHBondContact O-CD 3.3Å
201	R	91.6	Very high	93.8	Very high	95 Å²	95	41.7 Å²	41.7	36%	0.358	22%	0.219	S	C	.	.			trans	-103.5	100.2	-175.9	-61.2	-64.4	-50.7	-166	2.6	111.5	F122 E198 E203 V204 F205	F122-R201 HydrophobicContact CE1-CB 4.34Å; F122-R201 HydrophobicContact CE1-CG 3.78Å; F122-R201 HydrophobicContact CZ-CB 4.33Å; F122-R201 HydrophobicContact CZ-CG 4.27Å; E198-R201 HydrophobicContact CB-CG 3.81Å; R201-E203 VanDerWaalsContact C-N 3.27Å; R201-E203 IonicContact CZ-OE2 3.72Å; R201-E203 VanDerWaalsContact CZ-OE2 3.29Å; R201-E203 IonicContact NE-OE2 2.95Å; R201-E203 PolarHBondContact NE-OE2 3.25Å; R201-E203 IonicContact NH2-OE1 3.41Å; R201-E203 IonicContact NH2-OE2 2.72Å; R201-E203 PolarHBondContact NH2-OE2 2.87Å; R201-E203 PolarHBondContact O-N 3.46Å; R201-V204 HydrophobicContact CB-CG2 3.82Å; R201-V204 PolarHBondContact O-N 3.2Å; R201-F205 WeakPolarHBondContact O-CD2 3.43Å
202	P	92.7	Very high	93.6	Very high	15 Å²	15	41.8 Å²	41.8	10%	0.097	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-31.6	-175.3	24.6	-33	0	0	0	112.9	D200 V204 F205 E206 A228 L231 Q232	D200-P202 WeakPolarHBondContact O-CD 3.3Å; P202-V204 PolarHBondContact O-N 3.32Å; P202-F205 PolarHBondContact O-N 3.48Å; P202-E206 PolarHBondContact O-N 3.43Å; P202-A228 HydrophobicContact CB-CB 4.22Å; P202-L231 HydrophobicContact CB-CB 4.08Å; P202-L231 HydrophobicContact CB-CD1 4.42Å; P202-L231 HydrophobicContact CG-CB 4.45Å; P202-Q232 HydrophobicContact CB-CB 4.22Å; P202-Q232 HydrophobicContact CG-CB 3.77Å
203	E	91.4	Very high	93.3	Very high	46 Å²	46	39.9 Å²	39.9	22%	0.215	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-33.2	-178.3	-51.3	85.8	-144.8	0	0	112.2	F80 R201 E206 Q207	F80-E203 HydrophobicContact CE2-CG 4.39Å; R201-E203 VanDerWaalsContact C-N 3.27Å; R201-E203 IonicContact CZ-OE2 3.72Å; R201-E203 VanDerWaalsContact CZ-OE2 3.29Å; R201-E203 IonicContact NE-OE2 2.95Å; R201-E203 PolarHBondContact NE-OE2 3.25Å; R201-E203 IonicContact NH2-OE1 3.41Å; R201-E203 IonicContact NH2-OE2 2.72Å; R201-E203 PolarHBondContact NH2-OE2 2.87Å; R201-E203 PolarHBondContact O-N 3.46Å; E203-E206 PolarHBondContact O-N 2.8Å; E203-Q207 WeakPolarHBondContact O-CG 3.46Å; E203-Q207 PolarHBondContact O-N 2.86Å
204	V	94.4	Very high	92.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-74	-41.7	-176.7	-168.8	0	0	0	0	111.2	F122 Y167 L191 V194 I195 R201 P202 E206 Q207 R208	F122-V204 HydrophobicContact CE2-CG2 4.21Å; F122-V204 HydrophobicContact CZ-CG2 3.65Å; Y167-V204 HydrophobicContact CD2-CG1 4.29Å; Y167-V204 HydrophobicContact CD2-CG2 4.18Å; Y167-V204 HydrophobicContact CE2-CB 4.36Å; Y167-V204 HydrophobicContact CE2-CG1 4.28Å; Y167-V204 HydrophobicContact CE2-CG2 3.97Å; L191-V204 HydrophobicContact CB-CG1 4.43Å; L191-V204 HydrophobicContact CD2-CG1 4.05Å; V194-V204 HydrophobicContact CB-CG1 3.82Å; V194-V204 HydrophobicContact CG1-CB 4.25Å; V194-V204 HydrophobicContact CG1-CG1 3.65Å; V194-V204 HydrophobicContact CG1-CG2 3.6Å; I195-V204 HydrophobicContact CD1-CG1 4.11Å; I195-V204 HydrophobicContact CG1-CB 4.13Å; I195-V204 HydrophobicContact CG1-CG1 3.64Å; R201-V204 HydrophobicContact CB-CG2 3.82Å; R201-V204 PolarHBondContact O-N 3.2Å; P202-V204 PolarHBondContact O-N 3.32Å; V204-E206 VanDerWaalsContact C-N 3.32Å; V204-Q207 PolarHBondContact O-N 2.98Å; V204-R208 WeakPolarHBondContact O-CB 3.17Å; V204-R208 PolarHBondContact O-N 3.48Å
205	F	96	Very high	92.4	Very high	14 Å²	14	41.9 Å²	41.9	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-42.2	172.6	-68.6	-81.2	0	0	0	111	I195 P199 R201 P202 R208 A209 D224 K227 A228 L231	I195-F205 HydrophobicContact CD1-CD1 3.83Å; I195-F205 HydrophobicContact CD1-CE1 3.88Å; I195-F205 HydrophobicContact CD1-CG 4.3Å; I195-F205 HydrophobicContact CD1-CZ 4.39Å; I195-F205 HydrophobicContact CG1-CD1 4.4Å; I195-F205 HydrophobicContact CG1-CE1 4.16Å; I195-F205 HydrophobicContact CG1-CE2 4.41Å; I195-F205 HydrophobicContact CG1-CZ 4.16Å; I195-F205 HydrophobicContact CG2-CE1 3.76Å; I195-F205 HydrophobicContact CG2-CE2 4.45Å; I195-F205 HydrophobicContact CG2-CZ 3.59Å; P199-F205 WeakPolarHBondContact O-CE2 3.24Å; R201-F205 WeakPolarHBondContact O-CD2 3.43Å; P202-F205 PolarHBondContact O-N 3.48Å; F205-R208 PolarHBondContact O-N 2.94Å; F205-A209 WeakPolarHBondContact O-CB 3.05Å; F205-A209 PolarHBondContact O-N 2.64Å; F205-D224 HydrophobicContact CB-CB 4.25Å; F205-D224 HydrophobicContact CD1-CB 4.35Å; F205-K227 HydrophobicContact CD1-CB 4.19Å; F205-K227 HydrophobicContact CD1-CG 4.16Å; F205-K227 HydrophobicContact CD2-CG 4.35Å; F205-K227 HydrophobicContact CE1-CB 4.25Å; F205-K227 HydrophobicContact CE1-CG 3.79Å; F205-K227 HydrophobicContact CE2-CG 4.02Å; F205-K227 HydrophobicContact CG-CG 4.42Å; F205-K227 HydrophobicContact CZ-CG 3.72Å; F205-A228 HydrophobicContact CB-CB 3.95Å; F205-L231 HydrophobicContact CD2-CD1 4.03Å; F205-L231 HydrophobicContact CE2-CD1 3.81Å
206	E	93.8	Very high	91.9	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.098	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-49.1	175.2	-173.9	178.5	-168.5	0	0	111.7	P202 E203 V204 R208 A209 E210 L225 R236 L237	P202-E206 PolarHBondContact O-N 3.43Å; E203-E206 PolarHBondContact O-N 2.8Å; V204-E206 VanDerWaalsContact C-N 3.32Å; E206-R208 VanDerWaalsContact C-N 3.31Å; E206-R208 PolarHBondContact O-N 2.81Å; E206-A209 WeakPolarHBondContact O-CB 3.29Å; E206-A209 PolarHBondContact O-N 3.47Å; E206-E210 WeakPolarHBondContact O-CG 3.35Å; E206-E210 PolarHBondContact O-N 3.17Å; E206-L225 HydrophobicContact CG-CD2 4.45Å; E206-R236 WeakPolarHBondContact OE1-CD 3.26Å; E206-R236 WeakPolarHBondContact OE1-CG 3.21Å; E206-R236 IonicContact OE1-CZ 3.57Å; E206-R236 IonicContact OE1-NE 3.84Å; E206-R236 PolarHBondContact OE1-NE 3.17Å; E206-R236 IonicContact OE1-NH2 3.04Å; E206-L237 HydrophobicContact CB-CD2 3.81Å; E206-L237 HydrophobicContact CG-CD2 3.67Å
207	Q	92.6	Very high	91.7	Very high	42 Å²	42	43.1 Å²	43.1	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-40	178	-73.2	-50.8	-66.4	0	0	112.4	Y167 L191 E203 V204 E210 I211	Y167-Q207 HydrophobicContact CE2-CB 4.5Å; Y167-Q207 HydrophobicContact CE2-CG 4.18Å; Y167-Q207 WeakPolarHBondContact OH-CG 3.47Å; L191-Q207 HydrophobicContact CD1-CB 4.23Å; L191-Q207 HydrophobicContact CD2-CB 4.34Å; E203-Q207 WeakPolarHBondContact O-CG 3.46Å; E203-Q207 PolarHBondContact O-N 2.86Å; V204-Q207 PolarHBondContact O-N 2.98Å; Q207-E210 PolarHBondContact NE2-OE2 3.39Å; Q207-E210 PolarHBondContact O-N 3.41Å; Q207-E210 PolarHBondContact OE1-OE2 2.95Å; Q207-I211 PolarHBondContact O-N 3.19Å
208	R	94.4	Very high	91.6	Very high	43 Å²	43	41 Å²	41	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-40.7	177	-162.6	170.5	68.5	-179.3	-4.7	110.9	L188 L191 S192 V204 F205 E206 E210 I211 L212 D224	L188-R208 HydrophobicContact CD2-CG 3.61Å; L191-R208 HydrophobicContact CB-CB 4.2Å; L191-R208 HydrophobicContact CB-CG 4.22Å; L191-R208 HydrophobicContact CD1-CB 3.96Å; L191-R208 HydrophobicContact CD1-CG 4.3Å; S192-R208 PolarHBondContact OG-NH1 2.82Å; V204-R208 WeakPolarHBondContact O-CB 3.17Å; V204-R208 PolarHBondContact O-N 3.48Å; F205-R208 PolarHBondContact O-N 2.94Å; E206-R208 VanDerWaalsContact C-N 3.31Å; E206-R208 PolarHBondContact O-N 2.81Å; R208-E210 PolarHBondContact O-N 3.5Å; R208-I211 PolarHBondContact O-N 3.39Å; R208-L212 HydrophobicContact CG-CD1 4.11Å; R208-L212 HydrophobicContact CG-CG 4.47Å; R208-L212 WeakPolarHBondContact O-CB 3.44Å; R208-L212 VanDerWaalsContact O-CG 3.26Å; R208-L212 WeakPolarHBondContact O-CG 3.5Å; R208-L212 PolarHBondContact O-N 3.38Å; R208-D224 IonicContact CZ-OD1 3.93Å; R208-D224 IonicContact CZ-OD2 3.18Å; R208-D224 IonicContact NE-OD1 3.04Å; R208-D224 IonicContact NE-OD2 2.74Å; R208-D224 PolarHBondContact NE-OD2 3.09Å; R208-D224 VanDerWaalsContact NH2-CG 3.35Å; R208-D224 IonicContact NH2-OD1 3.53Å; R208-D224 PolarHBondContact NH2-OD1 3.48Å; R208-D224 IonicContact NH2-OD2 2.74Å; R208-D224 PolarHBondContact NH2-OD2 3.09Å
209	A	94	Very high	91.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-38.9	173.4	0	0	0	0	0	113	F205 E206 I211 L212 S213 A221 D224 L225	F205-A209 WeakPolarHBondContact O-CB 3.05Å; F205-A209 PolarHBondContact O-N 2.64Å; E206-A209 WeakPolarHBondContact O-CB 3.29Å; E206-A209 PolarHBondContact O-N 3.47Å; A209-I211 PolarHBondContact O-N 3.44Å; A209-L212 PolarHBondContact O-N 2.87Å; A209-S213 WeakPolarHBondContact O-CB 3.47Å; A209-S213 PolarHBondContact O-N 3.26Å; A209-S213 PolarHBondContact O-OG 3.38Å; A209-A221 HydrophobicContact CB-CB 4.15Å; A209-D224 HydrophobicContact CB-CB 4.07Å; A209-L225 HydrophobicContact CB-CD1 4.16Å; A209-L225 HydrophobicContact CB-CD2 3.87Å; A209-L225 HydrophobicContact CB-CG 3.61Å
210	E	90.4	Very high	91.7	Very high	37 Å²	37	44.2 Å²	44.2	17%	0.173	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-31.1	175.2	-76.1	-170.8	143.2	0	0	112.3	R52 E206 Q207 R208 P214 R236 H240	R52-E210 IonicContact CZ-OE1 3.02Å; R52-E210 IonicContact NH1-OE1 3.45Å; R52-E210 PolarHBondContact NH1-OE1 2.87Å; R52-E210 IonicContact NH2-OE1 2.71Å; E206-E210 WeakPolarHBondContact O-CG 3.35Å; E206-E210 PolarHBondContact O-N 3.17Å; Q207-E210 PolarHBondContact NE2-OE2 3.39Å; Q207-E210 PolarHBondContact O-N 3.41Å; Q207-E210 PolarHBondContact OE1-OE2 2.95Å; R208-E210 PolarHBondContact O-N 3.5Å; E210-P214 WeakPolarHBondContact O-CD 3.32Å; E210-R236 IonicContact OE1-CZ 3.39Å; E210-R236 IonicContact OE1-NH2 2.72Å; E210-R236 PolarHBondContact OE1-NH2 2.94Å; E210-R236 IonicContact OE2-NH2 3.28Å; E210-H240 VanDerWaalsContact CG-CE1 3.48Å; E210-H240 WeakPolarHBondContact CG-CE1 3.25Å
211	I	91	Very high	91.9	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.067	20%	0.198	C	C	.	.	H	α-helix	trans	-82.8	-42.8	175	-65.9	163.4	0	0	0	111.8	L178 A187 L188 L191 Q207 R208 A209 S213 P214 L215	L178-I211 HydrophobicContact CD2-CG1 4.31Å; L178-I211 HydrophobicContact CD2-CG2 3.88Å; A187-I211 HydrophobicContact CB-CD1 3.78Å; L188-I211 HydrophobicContact CD2-CB 4Å; L188-I211 HydrophobicContact CD2-CG2 3.64Å; L188-I211 HydrophobicContact CG-CG2 3.92Å; L191-I211 HydrophobicContact CD1-CD1 3.54Å; Q207-I211 PolarHBondContact O-N 3.19Å; R208-I211 PolarHBondContact O-N 3.39Å; A209-I211 PolarHBondContact O-N 3.44Å; I211-S213 VanDerWaalsContact C-N 3.28Å; I211-S213 PolarHBondContact O-N 2.94Å; I211-P214 VanDerWaalsContact O-CD 3.25Å; I211-P214 WeakPolarHBondContact O-CD 3.48Å; I211-P214 WeakPolarHBondContact O-CG 3.48Å; I211-L215 HydrophobicContact CG2-CD1 4.12Å; I211-L215 WeakPolarHBondContact O-CG 3.4Å
212	L	92.4	Very high	92.1	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-63.6	-33.6	179.6	-71.9	167.8	0	0	0	112.7	L188 R208 A209 L215 G216 R217 E220 A221	L188-L212 HydrophobicContact CD1-CD2 3.7Å; L188-L212 HydrophobicContact CD2-CD2 3.71Å; L188-L212 HydrophobicContact CD2-CG 3.68Å; L188-L212 HydrophobicContact CG-CD2 4.37Å; R208-L212 HydrophobicContact CG-CD1 4.11Å; R208-L212 HydrophobicContact CG-CG 4.47Å; R208-L212 WeakPolarHBondContact O-CB 3.44Å; R208-L212 VanDerWaalsContact O-CG 3.26Å; R208-L212 WeakPolarHBondContact O-CG 3.5Å; R208-L212 PolarHBondContact O-N 3.38Å; A209-L212 PolarHBondContact O-N 2.87Å; L212-L215 PolarHBondContact O-N 3.43Å; L212-G216 PolarHBondContact O-N 2.9Å; L212-R217 HydrophobicContact CB-CB 4.21Å; L212-R217 HydrophobicContact CD2-CB 3.74Å; L212-R217 HydrophobicContact CD2-CG 4.31Å; L212-R217 PolarHBondContact O-N 3.27Å; L212-R217 VanDerWaalsContact O-N 3.12Å; L212-E220 HydrophobicContact CD1-CB 3.81Å; L212-E220 HydrophobicContact CD2-CB 4.36Å; L212-A221 HydrophobicContact CB-CB 3.75Å; L212-A221 HydrophobicContact CD1-CB 4.49Å
213	S	89.1	Confident	92.3	Very high	7 Å²	7	39.1 Å²	39.1	5%	0.049	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-58.3	-177.7	-61.2	0	0	0	0	113.4	A209 I211 L215 G216 H240 L244	A209-S213 WeakPolarHBondContact O-CB 3.47Å; A209-S213 PolarHBondContact O-N 3.26Å; A209-S213 PolarHBondContact O-OG 3.38Å; I211-S213 VanDerWaalsContact C-N 3.28Å; I211-S213 PolarHBondContact O-N 2.94Å; S213-L215 VanDerWaalsContact C-N 3.27Å; S213-L215 PolarHBondContact O-N 3.39Å; S213-G216 PolarHBondContact O-N 3.06Å; S213-G216 VanDerWaalsContact O-N 3.13Å; S213-H240 PolarHBondContact OG-NE2 3.09Å; S213-H240 VanDerWaalsContact OG-NE2 3.17Å; S213-L244 WeakPolarHBondContact OG-CD2 3.31Å
214	P	85.8	Confident	92.5	Very high	50 Å²	50	37.6 Å²	37.6	33%	0.325	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.4	178.1	27.7	-36.7	0	0	0	113.9	L49 L178 E210 I211 G216	L49-P214 HydrophobicContact CD1-CB 4.27Å; L178-P214 HydrophobicContact CD1-CB 4.42Å; L178-P214 HydrophobicContact CD1-CG 3.48Å; L178-P214 VanDerWaalsContact CD1-CG 3.48Å; E210-P214 WeakPolarHBondContact O-CD 3.32Å; I211-P214 VanDerWaalsContact O-CD 3.25Å; I211-P214 WeakPolarHBondContact O-CD 3.48Å; I211-P214 WeakPolarHBondContact O-CG 3.48Å; P214-G216 PolarHBondContact O-N 3.29Å
215	L	87.5	Confident	92.7	Very high	55 Å²	55	37.6 Å²	37.6	29%	0.288	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.5	172.6	-62.9	174.4	0	0	0	112.9	A184 L188 I211 L212 S213 R217	A184-L215 HydrophobicContact CB-CD1 3.99Å; A184-L215 HydrophobicContact CB-CD2 3.88Å; A184-L215 HydrophobicContact CB-CG 4.46Å; L188-L215 HydrophobicContact CD1-CD1 3.84Å; I211-L215 HydrophobicContact CG2-CD1 4.12Å; I211-L215 WeakPolarHBondContact O-CG 3.4Å; L212-L215 PolarHBondContact O-N 3.43Å; S213-L215 VanDerWaalsContact C-N 3.27Å; S213-L215 PolarHBondContact O-N 3.39Å; L215-R217 VanDerWaalsContact C-N 3.25Å; L215-R217 HydrophobicContact CB-CG 4.38Å; L215-R217 PolarHBondContact O-N 2.94Å
216	G	86.1	Confident	92.8	Very high	52 Å²	52	38.7 Å²	38.7	54%	0.536	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	9.5	-176.6	0	0	0	0	0	114	L212 S213 P214 I218	L212-G216 PolarHBondContact O-N 2.9Å; S213-G216 PolarHBondContact O-N 3.06Å; S213-G216 VanDerWaalsContact O-N 3.13Å; P214-G216 PolarHBondContact O-N 3.29Å; G216-I218 PolarHBondContact O-N 2.95Å
217	R	91	Very high	92.9	Very high	78 Å²	78	41.4 Å²	41.4	29%	0.294	22%	0.22	S	C	.	.			trans	-81.2	55.2	174.8	-66.4	174	69	173.2	-3.6	110.3	E185 L188 L212 L215 N219 E220 A221	E185-R217 IonicContact OE1-NH1 3.6Å; E185-R217 PolarHBondContact OE1-NH1 3.22Å; E185-R217 VanDerWaalsContact OE1-NH1 3.13Å; E185-R217 IonicContact OE2-NH1 2.78Å; E185-R217 PolarHBondContact OE2-NH1 3.14Å; L188-R217 VanDerWaalsContact CD1-NH1 3.32Å; L212-R217 HydrophobicContact CB-CB 4.21Å; L212-R217 HydrophobicContact CD2-CB 3.74Å; L212-R217 HydrophobicContact CD2-CG 4.31Å; L212-R217 PolarHBondContact O-N 3.27Å; L212-R217 VanDerWaalsContact O-N 3.12Å; L215-R217 VanDerWaalsContact C-N 3.25Å; L215-R217 HydrophobicContact CB-CG 4.38Å; L215-R217 PolarHBondContact O-N 2.94Å; R217-N219 PolarHBondContact O-N 3.46Å; R217-E220 IonicContact CZ-OE1 3.79Å; R217-E220 IonicContact CZ-OE2 3.42Å; R217-E220 IonicContact NE-OE1 3.09Å; R217-E220 PolarHBondContact NE-OE1 2.96Å; R217-E220 IonicContact NE-OE2 2.69Å; R217-E220 VanDerWaalsContact NH2-CD 3.26Å; R217-E220 IonicContact NH2-OE1 3.48Å; R217-E220 PolarHBondContact NH2-OE1 3.36Å; R217-E220 VanDerWaalsContact NH2-OE1 3.09Å; R217-E220 IonicContact NH2-OE2 3.33Å; R217-E220 PolarHBondContact NH2-OE2 2.84Å; R217-E220 PolarHBondContact O-N 3.33Å; R217-A221 PolarHBondContact O-N 3.04Å; R217-A221 VanDerWaalsContact O-N 3.09Å
218	I	90.9	Very high	93.1	Very high	28 Å²	28	39.4 Å²	39.4	14%	0.144	21%	0.211	C	C	.	.	H	α-helix	trans	-60.4	-44	-167.9	-56.1	-60.4	0	0	0	112.2	G216 E220 A221 V222 L244	G216-I218 PolarHBondContact O-N 2.95Å; I218-E220 VanDerWaalsContact C-N 3.32Å; I218-E220 PolarHBondContact O-N 2.94Å; I218-A221 PolarHBondContact O-N 3.27Å; I218-V222 HydrophobicContact CG2-CG2 4.22Å; I218-V222 WeakPolarHBondContact O-CB 3.38Å; I218-V222 VanDerWaalsContact O-CG2 3.31Å; I218-V222 WeakPolarHBondContact O-CG2 3.33Å; I218-V222 PolarHBondContact O-N 3.47Å; I218-L244 HydrophobicContact CD1-CD2 4.07Å; I218-L244 HydrophobicContact CG2-CB 4.16Å
219	N	93.4	Very high	93.2	Very high	129 Å²	129	37.9 Å²	37.9	69%	0.69	21%	0.206	S	C	*	.	H	α-helix	trans	-62.7	-38.9	-178.8	-67.6	-22.5	0	0	0	112.5	R217 N223	R217-N219 PolarHBondContact O-N 3.46Å; N219-N223 PolarHBondContact O-N 2.91Å; N219-N223 PolarHBondContact O-ND2 3.42Å
220	E	95.3	Very high	93.4	Very high	84 Å²	84	44.4 Å²	44.4	39%	0.393	24%	0.236	S	C	.	.	H	α-helix	trans	-70	-42.5	177.6	-65.2	177.2	-97.6	0	0	110.9	L212 R217 I218 V222 N223 D224	L212-E220 HydrophobicContact CD1-CB 3.81Å; L212-E220 HydrophobicContact CD2-CB 4.36Å; R217-E220 IonicContact CZ-OE1 3.79Å; R217-E220 IonicContact CZ-OE2 3.42Å; R217-E220 IonicContact NE-OE1 3.09Å; R217-E220 PolarHBondContact NE-OE1 2.96Å; R217-E220 IonicContact NE-OE2 2.69Å; R217-E220 VanDerWaalsContact NH2-CD 3.26Å; R217-E220 IonicContact NH2-OE1 3.48Å; R217-E220 PolarHBondContact NH2-OE1 3.36Å; R217-E220 VanDerWaalsContact NH2-OE1 3.09Å; R217-E220 IonicContact NH2-OE2 3.33Å; R217-E220 PolarHBondContact NH2-OE2 2.84Å; R217-E220 PolarHBondContact O-N 3.33Å; I218-E220 VanDerWaalsContact C-N 3.32Å; I218-E220 PolarHBondContact O-N 2.94Å; E220-V222 VanDerWaalsContact C-N 3.33Å; E220-V222 PolarHBondContact O-N 3.33Å; E220-N223 PolarHBondContact O-N 3.43Å; E220-D224 PolarHBondContact O-N 3.16Å
221	A	95.7	Very high	93.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-42	174.7	0	0	0	0	0	112.1	A209 L212 R217 I218 D224 L225 L244	A209-A221 HydrophobicContact CB-CB 4.15Å; L212-A221 HydrophobicContact CB-CB 3.75Å; L212-A221 HydrophobicContact CD1-CB 4.49Å; R217-A221 PolarHBondContact O-N 3.04Å; R217-A221 VanDerWaalsContact O-N 3.09Å; I218-A221 PolarHBondContact O-N 3.27Å; A221-D224 PolarHBondContact O-N 3.01Å; A221-L225 WeakPolarHBondContact O-CG 3.49Å; A221-L225 PolarHBondContact O-N 3.12Å; A221-L244 HydrophobicContact CB-CD1 3.54Å
222	V	96.6	Very high	93.8	Very high	13 Å²	13	50 Å²	50	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-40	176.3	167.6	0	0	0	0	111.5	I218 E220 T226 R241 L244 Y245	I218-V222 HydrophobicContact CG2-CG2 4.22Å; I218-V222 WeakPolarHBondContact O-CB 3.38Å; I218-V222 VanDerWaalsContact O-CG2 3.31Å; I218-V222 WeakPolarHBondContact O-CG2 3.33Å; I218-V222 PolarHBondContact O-N 3.47Å; E220-V222 VanDerWaalsContact C-N 3.33Å; E220-V222 PolarHBondContact O-N 3.33Å; V222-T226 VanDerWaalsContact O-CB 3.29Å; V222-T226 WeakPolarHBondContact O-CB 3.42Å; V222-T226 PolarHBondContact O-N 3.03Å; V222-T226 PolarHBondContact O-OG1 2.74Å; V222-R241 HydrophobicContact CG1-CG 4.32Å; V222-R241 HydrophobicContact CG2-CG 4.49Å; V222-L244 HydrophobicContact CG2-CB 3.86Å; V222-L244 HydrophobicContact CG2-CD1 3.96Å; V222-Y245 HydrophobicContact CG1-CE1 3.83Å; V222-Y245 HydrophobicContact CG1-CE2 4.46Å; V222-Y245 VanDerWaalsContact CG1-OH 3.3Å; V222-Y245 WeakPolarHBondContact CG1-OH 3.38Å; V222-Y245 HydrophobicContact CG2-CE1 4.37Å
223	N	96.6	Very high	93.9	Very high	107 Å²	107	53 Å²	53	57%	0.572	28%	0.283	S	S	*	.	H	α-helix	trans	-63.2	-44.7	175.7	-73.2	-20.8	0	0	0	111.4	N219 E220 T226 K227	N219-N223 PolarHBondContact O-N 2.91Å; N219-N223 PolarHBondContact O-ND2 3.42Å; E220-N223 PolarHBondContact O-N 3.43Å; N223-T226 WeakPolarHBondContact O-CB 3.47Å; N223-T226 PolarHBondContact O-N 3.28Å; N223-K227 PolarHBondContact O-N 3.3Å
224	D	96.6	Very high	94.2	Very high	13 Å²	13	54.5 Å²	54.5	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-48.3	177.1	-80	-4.9	0	0	0	111.7	F205 R208 A209 E220 A221 T226 K227 A228	F205-D224 HydrophobicContact CB-CB 4.25Å; F205-D224 HydrophobicContact CD1-CB 4.35Å; R208-D224 IonicContact CZ-OD1 3.93Å; R208-D224 IonicContact CZ-OD2 3.18Å; R208-D224 IonicContact NE-OD1 3.04Å; R208-D224 IonicContact NE-OD2 2.74Å; R208-D224 PolarHBondContact NE-OD2 3.09Å; R208-D224 VanDerWaalsContact NH2-CG 3.35Å; R208-D224 IonicContact NH2-OD1 3.53Å; R208-D224 PolarHBondContact NH2-OD1 3.48Å; R208-D224 IonicContact NH2-OD2 2.74Å; R208-D224 PolarHBondContact NH2-OD2 3.09Å; A209-D224 HydrophobicContact CB-CB 4.07Å; E220-D224 PolarHBondContact O-N 3.16Å; A221-D224 PolarHBondContact O-N 3.01Å; D224-T226 VanDerWaalsContact C-N 3.27Å; D224-T226 PolarHBondContact O-N 3.25Å; D224-K227 PolarHBondContact O-N 2.83Å; D224-K227 VanDerWaalsContact O-N 3.14Å; D224-A228 WeakPolarHBondContact O-CB 3.47Å; D224-A228 PolarHBondContact O-N 2.92Å
225	L	97.3	Very high	94.6	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-36.2	176.2	-69.5	170.1	0	0	0	111.9	E206 A209 A221 K227 A228 I229 L237 H240 R241 L244	E206-L225 HydrophobicContact CG-CD2 4.45Å; A209-L225 HydrophobicContact CB-CD1 4.16Å; A209-L225 HydrophobicContact CB-CD2 3.87Å; A209-L225 HydrophobicContact CB-CG 3.61Å; A221-L225 WeakPolarHBondContact O-CG 3.49Å; A221-L225 PolarHBondContact O-N 3.12Å; L225-K227 VanDerWaalsContact C-N 3.34Å; L225-A228 PolarHBondContact O-N 2.84Å; L225-I229 WeakPolarHBondContact O-CB 3.49Å; L225-I229 WeakPolarHBondContact O-CD1 3.4Å; L225-I229 WeakPolarHBondContact O-CG1 3.4Å; L225-I229 PolarHBondContact O-N 2.66Å; L225-L237 HydrophobicContact CD2-CD2 3.76Å; L225-H240 HydrophobicContact CD1-CB 4.15Å; L225-H240 HydrophobicContact CD2-CB 4.38Å; L225-R241 HydrophobicContact CB-CB 4Å; L225-R241 HydrophobicContact CB-CG 4.13Å; L225-R241 HydrophobicContact CD1-CB 3.83Å; L225-R241 HydrophobicContact CD1-CG 4.32Å; L225-L244 HydrophobicContact CD1-CD1 3.66Å; L225-L244 HydrophobicContact CD1-CG 4.49Å
226	T	97.7	Very high	94.9	Very high	37 Å²	37	53.6 Å²	53.6	23%	0.227	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-41.3	175.2	-61.8	0	0	0	0	111.4	V222 N223 D224 I229 Q230 R241	V222-T226 VanDerWaalsContact O-CB 3.29Å; V222-T226 WeakPolarHBondContact O-CB 3.42Å; V222-T226 PolarHBondContact O-N 3.03Å; V222-T226 PolarHBondContact O-OG1 2.74Å; N223-T226 WeakPolarHBondContact O-CB 3.47Å; N223-T226 PolarHBondContact O-N 3.28Å; D224-T226 VanDerWaalsContact C-N 3.27Å; D224-T226 PolarHBondContact O-N 3.25Å; T226-I229 PolarHBondContact O-N 2.89Å; T226-Q230 VanDerWaalsContact O-CG 3.31Å; T226-Q230 WeakPolarHBondContact O-CG 3.41Å; T226-Q230 PolarHBondContact O-N 3.06Å; T226-R241 WeakPolarHBondContact OG1-CD 3.22Å; T226-R241 PolarHBondContact OG1-NH1 2.99Å
227	K	96.8	Very high	95.3	Very high	79 Å²	79	51.4 Å²	51.4	34%	0.343	26%	0.259	S	S	.	.	H	α-helix	trans	-67.3	-41.7	174.7	-175.2	58.1	-178.9	172.3	0	111.8	F205 N223 D224 L225 I229 Q230 L231	F205-K227 HydrophobicContact CD1-CB 4.19Å; F205-K227 HydrophobicContact CD1-CG 4.16Å; F205-K227 HydrophobicContact CD2-CG 4.35Å; F205-K227 HydrophobicContact CE1-CB 4.25Å; F205-K227 HydrophobicContact CE1-CG 3.79Å; F205-K227 HydrophobicContact CE2-CG 4.02Å; F205-K227 HydrophobicContact CG-CG 4.42Å; F205-K227 HydrophobicContact CZ-CG 3.72Å; N223-K227 PolarHBondContact O-N 3.3Å; D224-K227 PolarHBondContact O-N 2.83Å; D224-K227 VanDerWaalsContact O-N 3.14Å; L225-K227 VanDerWaalsContact C-N 3.34Å; K227-I229 VanDerWaalsContact C-N 3.34Å; K227-I229 PolarHBondContact O-N 3.11Å; K227-Q230 WeakPolarHBondContact O-CB 3.31Å; K227-Q230 PolarHBondContact O-N 3.03Å; K227-L231 HydrophobicContact CG-CD1 4.49Å; K227-L231 WeakPolarHBondContact O-CG 3.24Å; K227-L231 PolarHBondContact O-N 3.04Å; K227-L231 VanDerWaalsContact O-N 3.09Å
228	A	96.5	Very high	95.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-45.1	175.1	0	0	0	0	0	111.7	P202 F205 D224 L225 Q230 L231 Q232 L237	P202-A228 HydrophobicContact CB-CB 4.22Å; F205-A228 HydrophobicContact CB-CB 3.95Å; D224-A228 WeakPolarHBondContact O-CB 3.47Å; D224-A228 PolarHBondContact O-N 2.92Å; L225-A228 PolarHBondContact O-N 2.84Å; A228-Q230 VanDerWaalsContact C-N 3.35Å; A228-Q230 PolarHBondContact O-N 2.98Å; A228-L231 PolarHBondContact O-N 3.43Å; A228-Q232 PolarHBondContact O-N 3.32Å; A228-L237 HydrophobicContact CB-CD1 3.91Å; A228-L237 HydrophobicContact CB-CD2 3.89Å
229	I	97.1	Very high	95.8	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.056	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-39.6	177	-70.1	163.4	0	0	0	111.3	L225 T226 K227 L231 Q232 P233 L237 Y238 R241	L225-I229 WeakPolarHBondContact O-CB 3.49Å; L225-I229 WeakPolarHBondContact O-CD1 3.4Å; L225-I229 WeakPolarHBondContact O-CG1 3.4Å; L225-I229 PolarHBondContact O-N 2.66Å; T226-I229 PolarHBondContact O-N 2.89Å; K227-I229 VanDerWaalsContact C-N 3.34Å; K227-I229 PolarHBondContact O-N 3.11Å; I229-L231 VanDerWaalsContact C-N 3.29Å; I229-L231 PolarHBondContact O-N 2.9Å; I229-Q232 CarbonylContact O-C 3.6Å; I229-P233 VanDerWaalsContact O-CD 3.27Å; I229-P233 WeakPolarHBondContact O-CD 3.46Å; I229-P233 VanDerWaalsContact O-CG 3.31Å; I229-P233 WeakPolarHBondContact O-CG 3.28Å; I229-L237 HydrophobicContact CD1-CB 4.14Å; I229-L237 HydrophobicContact CG1-CB 3.58Å; I229-L237 HydrophobicContact CG1-CD1 4.11Å; I229-L237 HydrophobicContact CG1-CG 4.45Å; I229-Y238 HydrophobicContact CD1-CD1 3.96Å; I229-Y238 HydrophobicContact CD1-CE1 4.11Å; I229-Y238 HydrophobicContact CD1-CG 4.41Å; I229-Y238 HydrophobicContact CG2-CE1 3.9Å; I229-Y238 HydrophobicContact CG2-CE2 4.24Å; I229-Y238 WeakPolarHBondContact CG2-OH 3.47Å; I229-R241 HydrophobicContact CD1-CB 4.47Å; I229-R241 VanDerWaalsContact CD1-CZ 3.46Å
230	Q	96.9	Very high	95.8	Very high	137 Å²	137	45.6 Å²	45.6	64%	0.64	23%	0.227	S	C	*	.	H	α-helix	trans	-63.8	-34.1	176.1	-74.9	172	-0.4	0	0	112.8	T226 K227 A228	T226-Q230 VanDerWaalsContact O-CG 3.31Å; T226-Q230 WeakPolarHBondContact O-CG 3.41Å; T226-Q230 PolarHBondContact O-N 3.06Å; K227-Q230 WeakPolarHBondContact O-CB 3.31Å; K227-Q230 PolarHBondContact O-N 3.03Å; A228-Q230 VanDerWaalsContact C-N 3.35Å; A228-Q230 PolarHBondContact O-N 2.98Å
231	L	95.7	Very high	95.9	Very high	46 Å²	46	43 Å²	43	24%	0.241	21%	0.214	C	C	.	.	H	α-helix	trans	-76.7	-51.6	177.7	-69	171.9	0	0	0	111.2	P202 F205 K227 A228 I229	P202-L231 HydrophobicContact CB-CB 4.08Å; P202-L231 HydrophobicContact CB-CD1 4.42Å; P202-L231 HydrophobicContact CG-CB 4.45Å; F205-L231 HydrophobicContact CD2-CD1 4.03Å; F205-L231 HydrophobicContact CE2-CD1 3.81Å; K227-L231 HydrophobicContact CG-CD1 4.49Å; K227-L231 WeakPolarHBondContact O-CG 3.24Å; K227-L231 PolarHBondContact O-N 3.04Å; K227-L231 VanDerWaalsContact O-N 3.09Å; A228-L231 PolarHBondContact O-N 3.43Å; I229-L231 VanDerWaalsContact C-N 3.29Å; I229-L231 PolarHBondContact O-N 2.9Å
232	Q	95.6	Very high	95.9	Very high	121 Å²	121	43 Å²	43	57%	0.565	21%	0.214	S	C	*	.	S	Bend	trans	-148.2	101.5	179.9	-173.7	63.8	48.5	0	0	110.1	P202 A228 I229 S234 L237	P202-Q232 HydrophobicContact CB-CB 4.22Å; P202-Q232 HydrophobicContact CG-CB 3.77Å; A228-Q232 PolarHBondContact O-N 3.32Å; I229-Q232 CarbonylContact O-C 3.6Å; Q232-S234 PolarHBondContact O-N 2.78Å; Q232-L237 VanDerWaalsContact O-CD1 3.28Å; Q232-L237 WeakPolarHBondContact O-CD1 3.26Å
233	P	94.9	Very high	95.8	Very high	66 Å²	66	43.1 Å²	43.1	43%	0.429	21%	0.214	S	C	.	.			trans	-61.8	136.9	175.9	-20.2	30.1	0	0	0	111.4	I229 Y238	I229-P233 VanDerWaalsContact O-CD 3.27Å; I229-P233 WeakPolarHBondContact O-CD 3.46Å; I229-P233 VanDerWaalsContact O-CG 3.31Å; I229-P233 WeakPolarHBondContact O-CG 3.28Å; P233-Y238 HydrophobicContact CB-CE2 4.14Å
234	S	94.6	Very high	95.6	Very high	39 Å²	39	38 Å²	38	27%	0.273	19%	0.187	S	C	.	.			trans	-147.6	152.5	173.4	83.9	0	0	0	0	111.3	Q232 R236 L237 Y238	Q232-S234 PolarHBondContact O-N 2.78Å; S234-R236 PolarHBondContact O-N 2.85Å; S234-L237 PolarHBondContact O-N 3.3Å; S234-L237 VanDerWaalsContact OG-CG 3.27Å; S234-L237 WeakPolarHBondContact OG-CG 3.44Å; S234-L237 PolarHBondContact OG-N 3.14Å; S234-Y238 VanDerWaalsContact O-CD2 3.28Å; S234-Y238 WeakPolarHBondContact O-CD2 3.42Å; S234-Y238 PolarHBondContact O-N 2.79Å
235	A	94.4	Very high	95.5	Very high	17 Å²	17	39.5 Å²	39.5	14%	0.14	19%	0.192	C	C	.	.	H	α-helix	trans	-57	-37.4	177.9	0	0	0	0	0	112	R239 S261 L264 N265	A235-R239 WeakPolarHBondContact O-CB 3.49Å; A235-R239 PolarHBondContact O-N 2.62Å; A235-S261 WeakPolarHBondContact O-CB 3.17Å; A235-S261 PolarHBondContact O-OG 3.47Å; A235-L264 HydrophobicContact CB-CB 3.86Å; A235-N265 HydrophobicContact CB-CB 4Å
236	R	92.4	Very high	95.3	Very high	69 Å²	69	39.5 Å²	39.5	26%	0.26	19%	0.192	S	C	.	.	H	α-helix	trans	-64.2	-45.7	178.9	178.2	176.9	170.2	179.8	-2.3	112.2	E206 E210 S234 R239 H240	E206-R236 WeakPolarHBondContact OE1-CD 3.26Å; E206-R236 WeakPolarHBondContact OE1-CG 3.21Å; E206-R236 IonicContact OE1-CZ 3.57Å; E206-R236 IonicContact OE1-NE 3.84Å; E206-R236 PolarHBondContact OE1-NE 3.17Å; E206-R236 IonicContact OE1-NH2 3.04Å; E210-R236 IonicContact OE1-CZ 3.39Å; E210-R236 IonicContact OE1-NH2 2.72Å; E210-R236 PolarHBondContact OE1-NH2 2.94Å; E210-R236 IonicContact OE2-NH2 3.28Å; S234-R236 PolarHBondContact O-N 2.85Å; R236-R239 PolarHBondContact O-N 3Å; R236-H240 WeakPolarHBondContact O-CB 3.18Å; R236-H240 PolarHBondContact O-N 3.1Å
237	L	95.1	Very high	94.9	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-45.2	-178.8	-69	171.7	0	0	0	111.6	E206 L225 A228 I229 Q232 S234 R239 H240 R241	E206-L237 HydrophobicContact CB-CD2 3.81Å; E206-L237 HydrophobicContact CG-CD2 3.67Å; L225-L237 HydrophobicContact CD2-CD2 3.76Å; A228-L237 HydrophobicContact CB-CD1 3.91Å; A228-L237 HydrophobicContact CB-CD2 3.89Å; I229-L237 HydrophobicContact CD1-CB 4.14Å; I229-L237 HydrophobicContact CG1-CB 3.58Å; I229-L237 HydrophobicContact CG1-CD1 4.11Å; I229-L237 HydrophobicContact CG1-CG 4.45Å; Q232-L237 VanDerWaalsContact O-CD1 3.28Å; Q232-L237 WeakPolarHBondContact O-CD1 3.26Å; S234-L237 PolarHBondContact O-N 3.3Å; S234-L237 VanDerWaalsContact OG-CG 3.27Å; S234-L237 WeakPolarHBondContact OG-CG 3.44Å; S234-L237 PolarHBondContact OG-N 3.14Å; L237-R239 PolarHBondContact O-N 3.4Å; L237-H240 PolarHBondContact O-N 3.42Å; L237-R241 WeakPolarHBondContact O-CB 3.32Å; L237-R241 PolarHBondContact O-N 3.32Å
238	Y	97.3	Very high	94.5	Very high	34 Å²	34	38 Å²	38	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-45.4	174.2	-78.2	-65.4	0	0	0	111.7	I229 P233 S234 H240 R241 G242 D257 Q260 L264	I229-Y238 HydrophobicContact CD1-CD1 3.96Å; I229-Y238 HydrophobicContact CD1-CE1 4.11Å; I229-Y238 HydrophobicContact CD1-CG 4.41Å; I229-Y238 HydrophobicContact CG2-CE1 3.9Å; I229-Y238 HydrophobicContact CG2-CE2 4.24Å; I229-Y238 WeakPolarHBondContact CG2-OH 3.47Å; P233-Y238 HydrophobicContact CB-CE2 4.14Å; S234-Y238 VanDerWaalsContact O-CD2 3.28Å; S234-Y238 WeakPolarHBondContact O-CD2 3.42Å; S234-Y238 PolarHBondContact O-N 2.79Å; Y238-H240 VanDerWaalsContact C-N 3.34Å; Y238-H240 PolarHBondContact O-N 3.43Å; Y238-R241 PolarHBondContact O-N 3.42Å; Y238-G242 PolarHBondContact O-N 2.89Å; Y238-D257 WeakPolarHBondContact CB-O 3.49Å; Y238-D257 WeakPolarHBondContact CD1-OD1 3.47Å; Y238-Q260 HydrophobicContact CD1-CB 3.92Å; Y238-Q260 HydrophobicContact CD2-CB 4.15Å; Y238-Q260 HydrophobicContact CE1-CB 4.06Å; Y238-Q260 HydrophobicContact CE1-CG 4.41Å; Y238-Q260 HydrophobicContact CE2-CB 4.28Å; Y238-Q260 HydrophobicContact CG-CB 3.98Å; Y238-L264 HydrophobicContact CD2-CD1 3.78Å; Y238-L264 HydrophobicContact CE2-CD1 3.86Å
239	R	95.3	Very high	94.1	Very high	51 Å²	51	41.9 Å²	41.9	19%	0.192	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-42.2	177	-174.2	178.5	60.6	72.8	4.5	112.2	A235 R236 L237 T243 F258 A271	A235-R239 WeakPolarHBondContact O-CB 3.49Å; A235-R239 PolarHBondContact O-N 2.62Å; R236-R239 PolarHBondContact O-N 3Å; L237-R239 PolarHBondContact O-N 3.4Å; R239-T243 WeakPolarHBondContact O-CB 3.48Å; R239-T243 PolarHBondContact O-N 3.2Å; R239-T243 PolarHBondContact O-OG1 3.05Å; R239-F258 HydrophobicContact CG-CD1 4.38Å; R239-F258 HydrophobicContact CG-CE1 4.12Å; R239-A271 HydrophobicContact CG-CB 4.27Å
240	H	93.8	Very high	93.7	Very high	28 Å²	28	43 Å²	43	13%	0.13	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-47.9	179.6	-170.1	-177.1	0	0	0	110.8	E210 S213 L225 R236 L237 Y238 G242 T243 L244	E210-H240 VanDerWaalsContact CG-CE1 3.48Å; E210-H240 WeakPolarHBondContact CG-CE1 3.25Å; S213-H240 PolarHBondContact OG-NE2 3.09Å; S213-H240 VanDerWaalsContact OG-NE2 3.17Å; L225-H240 HydrophobicContact CD1-CB 4.15Å; L225-H240 HydrophobicContact CD2-CB 4.38Å; R236-H240 WeakPolarHBondContact O-CB 3.18Å; R236-H240 PolarHBondContact O-N 3.1Å; L237-H240 PolarHBondContact O-N 3.42Å; Y238-H240 VanDerWaalsContact C-N 3.34Å; Y238-H240 PolarHBondContact O-N 3.43Å; H240-G242 PolarHBondContact O-N 2.87Å; H240-T243 WeakPolarHBondContact O-CB 3.28Å; H240-T243 PolarHBondContact O-N 2.84Å; H240-T243 VanDerWaalsContact O-N 3.14Å; H240-L244 PolarHBondContact O-N 3.05Å; H240-L244 VanDerWaalsContact O-N 3.08Å
241	R	96.5	Very high	93.4	Very high	31 Å²	31	37.1 Å²	37.1	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-64.9	-40.8	178.4	-165.6	179.4	65.6	-178.5	-4.2	111.7	V222 L225 T226 I229 L237 Y238 T243 L244 Y245 D257	V222-R241 HydrophobicContact CG1-CG 4.32Å; V222-R241 HydrophobicContact CG2-CG 4.49Å; L225-R241 HydrophobicContact CB-CB 4Å; L225-R241 HydrophobicContact CB-CG 4.13Å; L225-R241 HydrophobicContact CD1-CB 3.83Å; L225-R241 HydrophobicContact CD1-CG 4.32Å; T226-R241 WeakPolarHBondContact OG1-CD 3.22Å; T226-R241 PolarHBondContact OG1-NH1 2.99Å; I229-R241 HydrophobicContact CD1-CB 4.47Å; I229-R241 VanDerWaalsContact CD1-CZ 3.46Å; L237-R241 WeakPolarHBondContact O-CB 3.32Å; L237-R241 PolarHBondContact O-N 3.32Å; Y238-R241 PolarHBondContact O-N 3.42Å; R241-T243 VanDerWaalsContact C-N 3.28Å; R241-T243 PolarHBondContact O-N 3.29Å; R241-L244 WeakPolarHBondContact O-CB 3.45Å; R241-L244 PolarHBondContact O-N 3.24Å; R241-L244 VanDerWaalsContact O-N 3.08Å; R241-Y245 HydrophobicContact CG-CD2 4.01Å; R241-Y245 HydrophobicContact CG-CE2 3.58Å; R241-Y245 WeakPolarHBondContact O-CD2 3.43Å; R241-Y245 PolarHBondContact O-N 2.66Å; R241-D257 WeakPolarHBondContact CB-OD2 3.44Å; R241-D257 WeakPolarHBondContact CG-OD2 3.39Å; R241-D257 IonicContact CZ-OD1 3.91Å; R241-D257 IonicContact CZ-OD2 3.46Å; R241-D257 IonicContact NE-OD1 2.76Å; R241-D257 IonicContact NE-OD2 3.96Å; R241-D257 PolarHBondContact NE-OD2 3.45Å; R241-D257 IonicContact NH2-OD1 3.8Å; R241-D257 PolarHBondContact NH2-OD1 3.22Å; R241-D257 IonicContact NH2-OD2 2.65Å
242	G	96.2	Very high	93.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.4	-37	172.5	0	0	0	0	0	113	Y238 H240 Y245 F246 A254 D257 F258	Y238-G242 PolarHBondContact O-N 2.89Å; H240-G242 PolarHBondContact O-N 2.87Å; G242-Y245 PolarHBondContact O-N 3.4Å; G242-F246 WeakPolarHBondContact O-CB 3.28Å; G242-F246 PolarHBondContact O-N 3.47Å; G242-A254 VanDerWaalsContact O-CB 3.3Å; G242-A254 WeakPolarHBondContact O-CB 3.38Å; G242-D257 PolarHBondContact N-OD2 2.88Å; G242-F258 VanDerWaalsContact C-CZ 3.43Å
243	T	94.1	Very high	93.1	Very high	14 Å²	14	32.4 Å²	32.4	9%	0.086	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-39.7	174	-54.9	0	0	0	0	111.5	R239 H240 R241 F246 I247	R239-T243 WeakPolarHBondContact O-CB 3.48Å; R239-T243 PolarHBondContact O-N 3.2Å; R239-T243 PolarHBondContact O-OG1 3.05Å; H240-T243 WeakPolarHBondContact O-CB 3.28Å; H240-T243 PolarHBondContact O-N 2.84Å; H240-T243 VanDerWaalsContact O-N 3.14Å; R241-T243 VanDerWaalsContact C-N 3.28Å; R241-T243 PolarHBondContact O-N 3.29Å; T243-F246 WeakPolarHBondContact O-CB 3.5Å; T243-F246 PolarHBondContact O-N 3.43Å; T243-I247 HydrophobicContact CG2-CD1 3.97Å; T243-I247 VanDerWaalsContact O-CD1 3.32Å; T243-I247 WeakPolarHBondContact O-CD1 3.3Å; T243-I247 VanDerWaalsContact O-CG1 3.25Å; T243-I247 WeakPolarHBondContact O-CG1 3.46Å; T243-I247 PolarHBondContact O-N 3.4Å
244	L	93.5	Very high	93.1	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-42.7	175.1	-62.9	-174.9	0	0	0	112.1	S213 I218 A221 V222 L225 H240 R241 F246 I247 S248	S213-L244 WeakPolarHBondContact OG-CD2 3.31Å; I218-L244 HydrophobicContact CD1-CD2 4.07Å; I218-L244 HydrophobicContact CG2-CB 4.16Å; A221-L244 HydrophobicContact CB-CD1 3.54Å; V222-L244 HydrophobicContact CG2-CB 3.86Å; V222-L244 HydrophobicContact CG2-CD1 3.96Å; L225-L244 HydrophobicContact CD1-CD1 3.66Å; L225-L244 HydrophobicContact CD1-CG 4.49Å; H240-L244 PolarHBondContact O-N 3.05Å; H240-L244 VanDerWaalsContact O-N 3.08Å; R241-L244 WeakPolarHBondContact O-CB 3.45Å; R241-L244 PolarHBondContact O-N 3.24Å; R241-L244 VanDerWaalsContact O-N 3.08Å; L244-F246 VanDerWaalsContact C-N 3.32Å; L244-F246 PolarHBondContact O-N 3.37Å; L244-I247 PolarHBondContact O-N 2.72Å; L244-S248 PolarHBondContact O-N 2.91Å; L244-S248 PolarHBondContact O-OG 2.97Å
245	Y	94.2	Very high	93.2	Very high	43 Å²	43	28.6 Å²	28.6	17%	0.169	14%	0.144	C	C	.	.	H	α-helix	trans	-61.5	-40.4	173.2	-73.9	-51.6	0	0	0	112.2	V222 R241 G242 I247 S248 E249 D250 T253 D257	V222-Y245 HydrophobicContact CG1-CE1 3.83Å; V222-Y245 HydrophobicContact CG1-CE2 4.46Å; V222-Y245 VanDerWaalsContact CG1-OH 3.3Å; V222-Y245 WeakPolarHBondContact CG1-OH 3.38Å; V222-Y245 HydrophobicContact CG2-CE1 4.37Å; R241-Y245 HydrophobicContact CG-CD2 4.01Å; R241-Y245 HydrophobicContact CG-CE2 3.58Å; R241-Y245 WeakPolarHBondContact O-CD2 3.43Å; R241-Y245 PolarHBondContact O-N 2.66Å; G242-Y245 PolarHBondContact O-N 3.4Å; Y245-I247 VanDerWaalsContact C-N 3.3Å; Y245-I247 PolarHBondContact O-N 3.26Å; Y245-S248 WeakPolarHBondContact CA-OG 3.29Å; Y245-S248 CarbonylContact O-C 3.3Å; Y245-S248 PolarHBondContact O-N 3.08Å; Y245-S248 PolarHBondContact O-OG 3.14Å; Y245-E249 PolarHBondContact O-N 3.47Å; Y245-D250 HydrophobicContact CD1-CB 4.31Å; Y245-D250 WeakPolarHBondContact O-CA 3.31Å; Y245-D250 PolarHBondContact O-N 3.27Å; Y245-T253 HydrophobicContact CD1-CG2 4.36Å; Y245-T253 HydrophobicContact CD2-CG2 3.65Å; Y245-T253 HydrophobicContact CE1-CG2 4.21Å; Y245-T253 HydrophobicContact CE2-CG2 3.44Å; Y245-T253 VanDerWaalsContact CE2-CG2 3.44Å; Y245-T253 HydrophobicContact CG-CG2 4.12Å; Y245-D257 WeakPolarHBondContact CD2-OD2 3.42Å; Y245-D257 WeakPolarHBondContact CE2-OD2 3.26Å
246	F	92.9	Very high	93.3	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	16%	0.162	C	C	.	.	H	α-helix	trans	-60	-42.2	174.6	-177	-89.9	0	0	0	111.6	P41 L44 G242 T243 L244 E249 Y251 A254 F258 Y274 L277 T278 H281	P41-F246 HydrophobicContact CB-CD1 4.2Å; P41-F246 HydrophobicContact CB-CE1 4.11Å; P41-F246 HydrophobicContact CG-CE1 4.45Å; L44-F246 HydrophobicContact CD1-CE1 4.44Å; G242-F246 WeakPolarHBondContact O-CB 3.28Å; G242-F246 PolarHBondContact O-N 3.47Å; T243-F246 WeakPolarHBondContact O-CB 3.5Å; T243-F246 PolarHBondContact O-N 3.43Å; L244-F246 VanDerWaalsContact C-N 3.32Å; L244-F246 PolarHBondContact O-N 3.37Å; F246-E249 PolarHBondContact O-N 2.83Å; F246-E249 VanDerWaalsContact O-N 3.11Å; F246-Y251 AromaticContact CD2-CD1 3.74Å; F246-Y251 HydrophobicContact CD2-CD1 3.74Å; F246-Y251 AromaticContact CD2-CE1 3.92Å; F246-Y251 HydrophobicContact CD2-CE1 3.92Å; F246-Y251 AromaticContact CE2-CD1 3.86Å; F246-Y251 HydrophobicContact CE2-CD1 3.86Å; F246-Y251 AromaticContact CE2-CE1 3.79Å; F246-Y251 HydrophobicContact CE2-CE1 3.79Å; F246-Y251 HydrophobicContact CG-CE1 4.46Å; F246-Y251 HydrophobicContact CZ-CE1 4.24Å; F246-A254 HydrophobicContact CB-CB 4.12Å; F246-F258 HydrophobicContact CB-CE2 4.46Å; F246-Y274 HydrophobicContact CD1-CD1 4.26Å; F246-Y274 HydrophobicContact CD1-CE1 4.22Å; F246-Y274 HydrophobicContact CD2-CD1 4.49Å; F246-Y274 HydrophobicContact CE1-CD1 4.42Å; F246-Y274 HydrophobicContact CE1-CE1 4.31Å; F246-Y274 HydrophobicContact CG-CD1 4.3Å; F246-L277 HydrophobicContact CE2-CB 3.63Å; F246-L277 HydrophobicContact CZ-CB 3.84Å; F246-L277 HydrophobicContact CZ-CD1 4.33Å; F246-T278 HydrophobicContact CD2-CG2 3.74Å; F246-T278 HydrophobicContact CE2-CG2 4.29Å; F246-H281 AromaticContact CE2-CD2 3.69Å; F246-H281 AromaticContact CZ-CD2 3.53Å; F246-H281 AromaticContact CZ-NE2 3.7Å
247	I	88.8	Confident	93.5	Very high	23 Å²	23	30.2 Å²	30.2	12%	0.118	15%	0.151	C	C	.	.	H	α-helix	trans	-69.9	-34.6	178.6	-67	157.7	0	0	0	112	P41 L45 T243 L244 Y245 E249	P41-I247 HydrophobicContact CB-CB 4.35Å; P41-I247 HydrophobicContact CB-CG1 4.17Å; L45-I247 HydrophobicContact CB-CD1 3.83Å; L45-I247 HydrophobicContact CB-CG1 4.49Å; L45-I247 HydrophobicContact CD1-CD1 3.55Å; L45-I247 HydrophobicContact CD2-CD1 4Å; L45-I247 HydrophobicContact CG-CD1 3.95Å; T243-I247 HydrophobicContact CG2-CD1 3.97Å; T243-I247 VanDerWaalsContact O-CD1 3.32Å; T243-I247 WeakPolarHBondContact O-CD1 3.3Å; T243-I247 VanDerWaalsContact O-CG1 3.25Å; T243-I247 WeakPolarHBondContact O-CG1 3.46Å; T243-I247 PolarHBondContact O-N 3.4Å; L244-I247 PolarHBondContact O-N 2.72Å; Y245-I247 VanDerWaalsContact C-N 3.3Å; Y245-I247 PolarHBondContact O-N 3.26Å; I247-E249 PolarHBondContact O-N 3.08Å
248	S	87.9	Confident	93.6	Very high	62 Å²	62	30 Å²	30	43%	0.434	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	6.6	171.9	65.6	0	0	0	0	113.6	L244 Y245 D250	L244-S248 PolarHBondContact O-N 2.91Å; L244-S248 PolarHBondContact O-OG 2.97Å; Y245-S248 WeakPolarHBondContact CA-OG 3.29Å; Y245-S248 CarbonylContact O-C 3.3Å; Y245-S248 PolarHBondContact O-N 3.08Å; Y245-S248 PolarHBondContact O-OG 3.14Å; S248-D250 PolarHBondContact O-N 3.47Å
249	E	88.3	Confident	93.6	Very high	81 Å²	81	31.6 Å²	31.6	38%	0.379	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	19.1	-178.9	-52.6	175.9	165.3	0	0	113.5	R34 Y245 F246 I247 Y251	R34-E249 IonicContact CZ-OE2 3.68Å; R34-E249 IonicContact NE-OE2 2.81Å; R34-E249 IonicContact NH2-OE1 2.77Å; R34-E249 IonicContact NH2-OE2 2.65Å; R34-E249 PolarHBondContact NH2-OE2 3.34Å; Y245-E249 PolarHBondContact O-N 3.47Å; F246-E249 PolarHBondContact O-N 2.83Å; F246-E249 VanDerWaalsContact O-N 3.11Å; I247-E249 PolarHBondContact O-N 3.08Å; E249-Y251 HydrophobicContact CB-CE2 4.04Å; E249-Y251 WeakPolarHBondContact O-CD2 3.47Å; E249-Y251 WeakPolarHBondContact O-CE2 3.32Å; E249-Y251 PolarHBondContact O-N 2.91Å
250	D	89.6	Confident	93.7	Very high	35 Å²	35	32.6 Å²	32.6	19%	0.187	17%	0.166	C	C	.	.			trans	-91.6	72.2	171.5	-167.4	-11	0	0	0	110.1	Y245 S248 A252 T253 A254 Q593	Y245-D250 HydrophobicContact CD1-CB 4.31Å; Y245-D250 WeakPolarHBondContact O-CA 3.31Å; Y245-D250 PolarHBondContact O-N 3.27Å; S248-D250 PolarHBondContact O-N 3.47Å; D250-A252 VanDerWaalsContact C-N 3.28Å; D250-A252 PolarHBondContact O-N 3.48Å; D250-T253 PolarHBondContact OD1-N 3.41Å; D250-T253 PolarHBondContact OD2-OG1 3.31Å; D250-A254 WeakPolarHBondContact O-CB 3.47Å; D250-A254 PolarHBondContact O-N 3.46Å; D250-Q593 PolarHBondContact OD1-NE2 3.24Å
251	Y	91.1	Very high	93.9	Very high	13 Å²	13	31.2 Å²	31.2	5%	0.051	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-26.8	-175.5	-54.2	-65.1	0	0	0	113.7	F246 E249 H255 T278 H281 R282	F246-Y251 AromaticContact CD2-CD1 3.74Å; F246-Y251 HydrophobicContact CD2-CD1 3.74Å; F246-Y251 AromaticContact CD2-CE1 3.92Å; F246-Y251 HydrophobicContact CD2-CE1 3.92Å; F246-Y251 AromaticContact CE2-CD1 3.86Å; F246-Y251 HydrophobicContact CE2-CD1 3.86Å; F246-Y251 AromaticContact CE2-CE1 3.79Å; F246-Y251 HydrophobicContact CE2-CE1 3.79Å; F246-Y251 HydrophobicContact CG-CE1 4.46Å; F246-Y251 HydrophobicContact CZ-CE1 4.24Å; E249-Y251 HydrophobicContact CB-CE2 4.04Å; E249-Y251 WeakPolarHBondContact O-CD2 3.47Å; E249-Y251 WeakPolarHBondContact O-CE2 3.32Å; E249-Y251 PolarHBondContact O-N 2.91Å; Y251-H255 VanDerWaalsContact O-CB 3.24Å; Y251-H255 WeakPolarHBondContact O-CB 3.42Å; Y251-H255 PolarHBondContact O-N 2.74Å; Y251-T278 WeakPolarHBondContact O-CB 3.47Å; Y251-H281 HydrophobicContact CD1-CB 3.91Å; Y251-H281 HydrophobicContact CD2-CB 4.04Å; Y251-H281 HydrophobicContact CE1-CB 3.66Å; Y251-H281 AromaticContact CE1-CD2 3.93Å; Y251-H281 AromaticContact CE1-CG 3.84Å; Y251-H281 HydrophobicContact CE2-CB 3.81Å; Y251-H281 HydrophobicContact CG-CB 4.08Å; Y251-H281 AromaticContact CZ-CG 3.87Å; Y251-R282 HydrophobicContact CD2-CG 4.47Å; Y251-R282 HydrophobicContact CG-CG 4.38Å
252	A	90.6	Very high	93.9	Very high	27 Å²	27	30.4 Å²	30.4	22%	0.223	16%	0.157	C	C	.	.	H	α-helix	trans	-68.8	-54	178.2	0	0	0	0	0	110.9	D250 A254 H255 E256	D250-A252 VanDerWaalsContact C-N 3.28Å; D250-A252 PolarHBondContact O-N 3.48Å; A252-A254 VanDerWaalsContact C-N 3.34Å; A252-A254 PolarHBondContact O-N 3.08Å; A252-H255 WeakPolarHBondContact O-CB 3.46Å; A252-H255 PolarHBondContact O-N 2.98Å; A252-E256 PolarHBondContact O-N 3.05Å
253	T	93.1	Very high	93.9	Very high	41 Å²	41	36.1 Å²	36.1	25%	0.252	18%	0.184	S	C	.	.	H	α-helix	trans	-69.4	-34.4	177.4	-55.9	0	0	0	0	111.7	Y245 D250 H255 E256 D257	Y245-T253 HydrophobicContact CD1-CG2 4.36Å; Y245-T253 HydrophobicContact CD2-CG2 3.65Å; Y245-T253 HydrophobicContact CE1-CG2 4.21Å; Y245-T253 HydrophobicContact CE2-CG2 3.44Å; Y245-T253 VanDerWaalsContact CE2-CG2 3.44Å; Y245-T253 HydrophobicContact CG-CG2 4.12Å; D250-T253 PolarHBondContact OD1-N 3.41Å; D250-T253 PolarHBondContact OD2-OG1 3.31Å; T253-H255 VanDerWaalsContact C-N 3.29Å; T253-H255 PolarHBondContact O-N 2.88Å; T253-E256 PolarHBondContact O-N 3.47Å; T253-D257 PolarHBondContact O-N 3.35Å
254	A	95.6	Very high	94	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58	-42.3	171.5	0	0	0	0	0	112.3	G242 F246 D250 A252 D257 F258 T278	G242-A254 VanDerWaalsContact O-CB 3.3Å; G242-A254 WeakPolarHBondContact O-CB 3.38Å; F246-A254 HydrophobicContact CB-CB 4.12Å; D250-A254 WeakPolarHBondContact O-CB 3.47Å; D250-A254 PolarHBondContact O-N 3.46Å; A252-A254 VanDerWaalsContact C-N 3.34Å; A252-A254 PolarHBondContact O-N 3.08Å; A254-D257 PolarHBondContact O-N 3.21Å; A254-F258 HydrophobicContact CB-CD2 4.45Å; A254-F258 HydrophobicContact CB-CE2 4.09Å; A254-F258 WeakPolarHBondContact O-CD2 3.16Å; A254-F258 WeakPolarHBondContact O-CG 3.29Å; A254-F258 PolarHBondContact O-N 2.71Å; A254-T278 HydrophobicContact CB-CG2 3.74Å
255	H	95.9	Very high	94	Very high	24 Å²	24	42.2 Å²	42.2	11%	0.111	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-46.1	178	169.7	76.9	0	0	0	112.2	Y251 A252 T253 D257 F258 E259 K275 T278 F279	Y251-H255 VanDerWaalsContact O-CB 3.24Å; Y251-H255 WeakPolarHBondContact O-CB 3.42Å; Y251-H255 PolarHBondContact O-N 2.74Å; A252-H255 WeakPolarHBondContact O-CB 3.46Å; A252-H255 PolarHBondContact O-N 2.98Å; T253-H255 VanDerWaalsContact C-N 3.29Å; T253-H255 PolarHBondContact O-N 2.88Å; H255-D257 VanDerWaalsContact C-N 3.34Å; H255-D257 PolarHBondContact O-N 3.09Å; H255-F258 PolarHBondContact O-N 3.1Å; H255-E259 IonicContact NE2-OE2 3.64Å; H255-E259 WeakPolarHBondContact O-CB 3.43Å; H255-E259 PolarHBondContact O-N 3.49Å; H255-K275 WeakPolarHBondContact CE1-CE 3.28Å; H255-T278 HydrophobicContact CB-CG2 4.39Å; H255-F279 AromaticContact CE1-CE1 3.66Å; H255-F279 AromaticContact CE1-CE2 3.54Å; H255-F279 AromaticContact CE1-CZ 3.05Å; H255-F279 WeakPolarHBondContact CE1-CZ 3.48Å; H255-F279 AromaticContact ND1-CE1 3.93Å; H255-F279 AromaticContact ND1-CE2 3.83Å; H255-F279 AromaticContact ND1-CZ 3.59Å; H255-F279 AromaticContact NE2-CZ 3.8Å
256	E	96.2	Very high	93.9	Very high	114 Å²	114	49.8 Å²	49.8	53%	0.533	24%	0.244	S	C	.	.	H	α-helix	trans	-59	-45.7	176.8	-67.6	172.1	-174.9	0	0	111.1	A252 T253 E259 Q260	A252-E256 PolarHBondContact O-N 3.05Å; T253-E256 PolarHBondContact O-N 3.47Å; E256-E259 PolarHBondContact O-N 3.48Å; E256-Q260 WeakPolarHBondContact O-CG 3.48Å; E256-Q260 PolarHBondContact O-N 2.88Å
257	D	97.5	Very high	93.8	Very high	6 Å²	6	54 Å²	54	3%	0.032	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-41.9	177.6	-91.4	1.8	0	0	0	112.3	Y238 R241 G242 Y245 T253 A254 H255 E259 Q260 S261	Y238-D257 WeakPolarHBondContact CB-O 3.49Å; Y238-D257 WeakPolarHBondContact CD1-OD1 3.47Å; R241-D257 WeakPolarHBondContact CB-OD2 3.44Å; R241-D257 WeakPolarHBondContact CG-OD2 3.39Å; R241-D257 IonicContact CZ-OD1 3.91Å; R241-D257 IonicContact CZ-OD2 3.46Å; R241-D257 IonicContact NE-OD1 2.76Å; R241-D257 IonicContact NE-OD2 3.96Å; R241-D257 PolarHBondContact NE-OD2 3.45Å; R241-D257 IonicContact NH2-OD1 3.8Å; R241-D257 PolarHBondContact NH2-OD1 3.22Å; R241-D257 IonicContact NH2-OD2 2.65Å; G242-D257 PolarHBondContact N-OD2 2.88Å; Y245-D257 WeakPolarHBondContact CD2-OD2 3.42Å; Y245-D257 WeakPolarHBondContact CE2-OD2 3.26Å; T253-D257 PolarHBondContact O-N 3.35Å; A254-D257 PolarHBondContact O-N 3.21Å; H255-D257 VanDerWaalsContact C-N 3.34Å; H255-D257 PolarHBondContact O-N 3.09Å; D257-E259 VanDerWaalsContact C-N 3.31Å; D257-E259 PolarHBondContact O-N 3.44Å; D257-Q260 PolarHBondContact O-N 3.47Å; D257-S261 WeakPolarHBondContact O-CB 3.02Å; D257-S261 PolarHBondContact O-N 3.13Å
258	F	97.9	Very high	94.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66	-35.2	174.6	-68.9	-54.6	0	0	0	112.4	R239 G242 F246 A254 H255 S261 L262 A271 Y274 K275 T278	R239-F258 HydrophobicContact CG-CD1 4.38Å; R239-F258 HydrophobicContact CG-CE1 4.12Å; G242-F258 VanDerWaalsContact C-CZ 3.43Å; F246-F258 HydrophobicContact CB-CE2 4.46Å; A254-F258 HydrophobicContact CB-CD2 4.45Å; A254-F258 HydrophobicContact CB-CE2 4.09Å; A254-F258 WeakPolarHBondContact O-CD2 3.16Å; A254-F258 WeakPolarHBondContact O-CG 3.29Å; A254-F258 PolarHBondContact O-N 2.71Å; H255-F258 PolarHBondContact O-N 3.1Å; F258-S261 PolarHBondContact O-N 3.05Å; F258-L262 WeakPolarHBondContact O-CB 3.48Å; F258-L262 WeakPolarHBondContact O-CD1 3.49Å; F258-L262 VanDerWaalsContact O-CG 3.24Å; F258-L262 WeakPolarHBondContact O-CG 3.33Å; F258-L262 PolarHBondContact O-N 3.45Å; F258-A271 HydrophobicContact CD1-CB 4.38Å; F258-Y274 HydrophobicContact CE1-CG 4.24Å; F258-Y274 HydrophobicContact CE2-CG 4.36Å; F258-Y274 HydrophobicContact CZ-CD1 4.22Å; F258-Y274 AromaticContact CZ-CG 3.84Å; F258-Y274 HydrophobicContact CZ-CG 3.84Å; F258-K275 HydrophobicContact CB-CB 4.07Å; F258-T278 HydrophobicContact CD2-CG2 4.06Å; F258-T278 HydrophobicContact CE2-CG2 4.07Å
259	E	97.4	Very high	94.3	Very high	68 Å²	68	52.5 Å²	52.5	32%	0.318	25%	0.254	S	S	.	.	H	α-helix	trans	-65.3	-48.9	174.8	-177.5	153	-105	0	0	111.7	H255 E256 D257 S261 L262 E263 K275	H255-E259 IonicContact NE2-OE2 3.64Å; H255-E259 WeakPolarHBondContact O-CB 3.43Å; H255-E259 PolarHBondContact O-N 3.49Å; E256-E259 PolarHBondContact O-N 3.48Å; D257-E259 VanDerWaalsContact C-N 3.31Å; D257-E259 PolarHBondContact O-N 3.44Å; E259-S261 VanDerWaalsContact C-N 3.29Å; E259-S261 PolarHBondContact O-N 3.23Å; E259-L262 PolarHBondContact O-N 3.42Å; E259-L262 VanDerWaalsContact O-N 3.07Å; E259-E263 WeakPolarHBondContact O-CG 3.5Å; E259-E263 PolarHBondContact O-N 3.31Å; E259-K275 IonicContact OE1-NZ 3.19Å; E259-K275 PolarHBondContact OE1-NZ 2.97Å
260	Q	97.6	Very high	94.5	Very high	72 Å²	72	50.8 Å²	50.8	34%	0.336	25%	0.25	S	C	.	.	H	α-helix	trans	-59.1	-39.9	174.7	-70.5	-59	-62.5	0	0	112.2	Y238 E256 D257 L262 E263 L264	Y238-Q260 HydrophobicContact CD1-CB 3.92Å; Y238-Q260 HydrophobicContact CD2-CB 4.15Å; Y238-Q260 HydrophobicContact CE1-CB 4.06Å; Y238-Q260 HydrophobicContact CE1-CG 4.41Å; Y238-Q260 HydrophobicContact CE2-CB 4.28Å; Y238-Q260 HydrophobicContact CG-CB 3.98Å; E256-Q260 WeakPolarHBondContact O-CG 3.48Å; E256-Q260 PolarHBondContact O-N 2.88Å; D257-Q260 PolarHBondContact O-N 3.47Å; Q260-L262 VanDerWaalsContact C-N 3.34Å; Q260-L262 PolarHBondContact O-N 3.04Å; Q260-E263 PolarHBondContact NE2-OE2 3.17Å; Q260-E263 PolarHBondContact O-N 3.12Å; Q260-L264 WeakPolarHBondContact O-CG 3.44Å; Q260-L264 PolarHBondContact O-N 3.38Å
261	S	97.1	Very high	94.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.6	-44.4	173.6	-176.6	0	0	0	0	112.3	A235 D257 F258 E259 L264 N265 Q268	A235-S261 WeakPolarHBondContact O-CB 3.17Å; A235-S261 PolarHBondContact O-OG 3.47Å; D257-S261 WeakPolarHBondContact O-CB 3.02Å; D257-S261 PolarHBondContact O-N 3.13Å; F258-S261 PolarHBondContact O-N 3.05Å; E259-S261 VanDerWaalsContact C-N 3.29Å; E259-S261 PolarHBondContact O-N 3.23Å; S261-L264 PolarHBondContact O-N 3.02Å; S261-N265 PolarHBondContact O-N 2.84Å; S261-Q268 PolarHBondContact O-NE2 2.86Å; S261-Q268 VanDerWaalsContact O-NE2 3.14Å; S261-Q268 PolarHBondContact OG-NE2 2.85Å; S261-Q268 VanDerWaalsContact OG-NE2 3.13Å
262	L	96	Very high	95	Very high	13 Å²	13	49.9 Å²	49.9	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-73	-27.3	-179.5	-72.9	166.1	0	0	0	113.3	F258 E259 Q260 N265 R266 Q268 A271 M272 K275	F258-L262 WeakPolarHBondContact O-CB 3.48Å; F258-L262 WeakPolarHBondContact O-CD1 3.49Å; F258-L262 VanDerWaalsContact O-CG 3.24Å; F258-L262 WeakPolarHBondContact O-CG 3.33Å; F258-L262 PolarHBondContact O-N 3.45Å; E259-L262 PolarHBondContact O-N 3.42Å; E259-L262 VanDerWaalsContact O-N 3.07Å; Q260-L262 VanDerWaalsContact C-N 3.34Å; Q260-L262 PolarHBondContact O-N 3.04Å; L262-N265 WeakPolarHBondContact CA-O 3.24Å; L262-N265 CarbonylContact O-C 3.58Å; L262-N265 VanDerWaalsContact O-C 3.3Å; L262-R266 WeakPolarHBondContact O-CA 3.45Å; L262-R266 VanDerWaalsContact O-CG 3.26Å; L262-R266 WeakPolarHBondContact O-CG 3.03Å; L262-R266 PolarHBondContact O-N 3.39Å; L262-Q268 HydrophobicContact CD2-CB 4.06Å; L262-A271 HydrophobicContact CD2-CB 4.07Å; L262-A271 HydrophobicContact CG-CB 4.19Å; L262-M272 HydrophobicContact CD1-CE 3.83Å; L262-M272 HydrophobicContact CD1-SD 3.93Å; L262-M272 HydrophobicContact CD2-CE 4.01Å; L262-K275 HydrophobicContact CD1-CB 4.46Å; L262-K275 HydrophobicContact CD1-CD 3.84Å
263	E	96.7	Very high	95.3	Very high	120 Å²	120	49.1 Å²	49.1	56%	0.561	24%	0.237	S	C	*	.	H	α-helix	trans	-66.7	-40	171.2	-75.3	178.7	176.1	0	0	111.6	E259 Q260	E259-E263 WeakPolarHBondContact O-CG 3.5Å; E259-E263 PolarHBondContact O-N 3.31Å; Q260-E263 PolarHBondContact NE2-OE2 3.17Å; Q260-E263 PolarHBondContact O-N 3.12Å
264	L	95.6	Very high	95.4	Very high	98 Å²	98	47.6 Å²	47.6	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-74.7	-41.8	177.1	-67.9	176.7	0	0	0	112.9	A235 Y238 Q260 S261	A235-L264 HydrophobicContact CB-CB 3.86Å; Y238-L264 HydrophobicContact CD2-CD1 3.78Å; Y238-L264 HydrophobicContact CE2-CD1 3.86Å; Q260-L264 WeakPolarHBondContact O-CG 3.44Å; Q260-L264 PolarHBondContact O-N 3.38Å; S261-L264 PolarHBondContact O-N 3.02Å
265	N	93.8	Very high	95.5	Very high	45 Å²	45	49.1 Å²	49.1	24%	0.241	23%	0.233	C	C	.	.			trans	-139.8	114.9	171.2	-179.3	-6.5	0	0	0	110.7	E75 A235 S261 L262 N267 Q268	E75-N265 PolarHBondContact OE2-ND2 3.17Å; A235-N265 HydrophobicContact CB-CB 4Å; S261-N265 PolarHBondContact O-N 2.84Å; L262-N265 WeakPolarHBondContact CA-O 3.24Å; L262-N265 CarbonylContact O-C 3.58Å; L262-N265 VanDerWaalsContact O-C 3.3Å; N265-N267 PolarHBondContact OD1-N 3.37Å; N265-Q268 HydrophobicContact CB-CG 4.46Å; N265-Q268 PolarHBondContact O-NE2 3.38Å
266	R	91.6	Very high	95.5	Very high	203 Å²	203	48 Å²	48	77%	0.766	23%	0.228	S	C	*	.	S	Bend	trans	-75.8	-24	-175.7	-68.3	-177.5	176.7	-173.7	-0.8	114.6	L262 Q268 Q298	L262-R266 WeakPolarHBondContact O-CA 3.45Å; L262-R266 VanDerWaalsContact O-CG 3.26Å; L262-R266 WeakPolarHBondContact O-CG 3.03Å; L262-R266 PolarHBondContact O-N 3.39Å; R266-Q268 VanDerWaalsContact C-N 3.3Å; R266-Q268 PolarHBondContact O-N 2.92Å; R266-Q268 VanDerWaalsContact O-N 3.14Å; R266-Q298 PolarHBondContact O-NE2 3.11Å; R266-Q298 PolarHBondContact O-OE1 3.33Å
267	N	92.5	Very high	95.5	Very high	89 Å²	89	43.2 Å²	43.2	48%	0.476	21%	0.206	S	C	.	.			trans	-91.1	56.5	-172.4	-167.7	31.9	0	0	0	112.2	N265	N265-N267 PolarHBondContact OD1-N 3.37Å
268	Q	93.4	Very high	95.4	Very high	27 Å²	27	43 Å²	43	13%	0.126	21%	0.205	C	C	.	.			trans	-126.8	82	-177.7	-65.4	-176.2	82.9	0	0	110.5	S261 L262 N265 R266 T270 A271 M272 Q298	S261-Q268 PolarHBondContact O-NE2 2.86Å; S261-Q268 VanDerWaalsContact O-NE2 3.14Å; S261-Q268 PolarHBondContact OG-NE2 2.85Å; S261-Q268 VanDerWaalsContact OG-NE2 3.13Å; L262-Q268 HydrophobicContact CD2-CB 4.06Å; N265-Q268 HydrophobicContact CB-CG 4.46Å; N265-Q268 PolarHBondContact O-NE2 3.38Å; R266-Q268 VanDerWaalsContact C-N 3.3Å; R266-Q268 PolarHBondContact O-N 2.92Å; R266-Q268 VanDerWaalsContact O-N 3.14Å; Q268-T270 PolarHBondContact O-N 3.03Å; Q268-A271 HydrophobicContact CB-CB 3.76Å; Q268-A271 PolarHBondContact O-N 3.1Å; Q268-M272 PolarHBondContact O-N 3.41Å; Q268-Q298 VanDerWaalsContact C-OE1 3.3Å; Q268-Q298 VanDerWaalsContact N-OE1 3.14Å
269	P	93.6	Very high	95.3	Very high	26 Å²	26	44.4 Å²	44.4	17%	0.169	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-34.9	-175.9	20.5	-32.2	0	0	0	112.4	M272 L273 Q298 K299 F302	P269-M272 PolarHBondContact O-N 2.97Å; P269-L273 WeakPolarHBondContact O-CB 3.47Å; P269-L273 PolarHBondContact O-N 3.1Å; P269-Q298 HydrophobicContact CB-CB 4.12Å; P269-Q298 VanDerWaalsContact N-OE1 3.12Å; P269-K299 HydrophobicContact CB-CB 3.9Å; P269-K299 HydrophobicContact CG-CB 4.07Å; P269-F302 HydrophobicContact CB-CD1 4.24Å; P269-F302 HydrophobicContact CB-CE1 4.14Å
270	T	92.6	Very high	95.2	Very high	46 Å²	46	42 Å²	42	28%	0.282	20%	0.2	S	C	.	.	H	α-helix	trans	-66.1	-44.1	175.7	-53.8	0	0	0	0	112.1	Q268 M272 L273 Y274	Q268-T270 PolarHBondContact O-N 3.03Å; T270-M272 VanDerWaalsContact C-N 3.29Å; T270-M272 PolarHBondContact O-N 3.5Å; T270-L273 WeakPolarHBondContact O-CB 3.39Å; T270-L273 PolarHBondContact O-N 3.05Å; T270-Y274 HydrophobicContact CG2-CD2 3.82Å; T270-Y274 HydrophobicContact CG2-CE2 3.7Å; T270-Y274 VanDerWaalsContact O-CD2 3.27Å; T270-Y274 WeakPolarHBondContact O-CD2 3.37Å; T270-Y274 PolarHBondContact O-N 3.47Å
271	A	93.5	Very high	94.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.5	-38.3	175.6	0	0	0	0	0	111.3	R239 F258 L262 Q268 Y274 K275	R239-A271 HydrophobicContact CG-CB 4.27Å; F258-A271 HydrophobicContact CD1-CB 4.38Å; L262-A271 HydrophobicContact CD2-CB 4.07Å; L262-A271 HydrophobicContact CG-CB 4.19Å; Q268-A271 HydrophobicContact CB-CB 3.76Å; Q268-A271 PolarHBondContact O-N 3.1Å; A271-Y274 PolarHBondContact O-N 3.02Å; A271-K275 WeakPolarHBondContact O-CB 3.46Å; A271-K275 PolarHBondContact O-N 2.94Å
272	M	96.9	Very high	94.5	Very high	29 Å²	29	42.2 Å²	42.2	14%	0.143	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-40.9	173.9	-167	67.1	71.7	0	0	112.3	L262 Q268 P269 T270 K275 G276 A291 E294 A295	L262-M272 HydrophobicContact CD1-CE 3.83Å; L262-M272 HydrophobicContact CD1-SD 3.93Å; L262-M272 HydrophobicContact CD2-CE 4.01Å; Q268-M272 PolarHBondContact O-N 3.41Å; P269-M272 PolarHBondContact O-N 2.97Å; T270-M272 VanDerWaalsContact C-N 3.29Å; T270-M272 PolarHBondContact O-N 3.5Å; M272-K275 WeakPolarHBondContact O-CB 3.34Å; M272-K275 PolarHBondContact O-N 2.95Å; M272-K275 HydrophobicContact SD-CD 4.43Å; M272-G276 PolarHBondContact O-N 3.16Å; M272-A291 WeakPolarHBondContact CG-O 3.42Å; M272-E294 HydrophobicContact CE-CB 4.32Å; M272-E294 HydrophobicContact CG-CB 4.03Å; M272-E294 HydrophobicContact SD-CB 4.14Å; M272-A295 HydrophobicContact CB-CB 3.97Å; M272-A295 HydrophobicContact CG-CB 3.94Å
273	L	96.2	Very high	94.2	Very high	10 Å²	10	41.9 Å²	41.9	5%	0.052	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-49.6	173.1	174.5	69.1	0	0	0	110.8	P269 T270 K275 G276 L277 F292 F302 D304 A305	P269-L273 WeakPolarHBondContact O-CB 3.47Å; P269-L273 PolarHBondContact O-N 3.1Å; T270-L273 WeakPolarHBondContact O-CB 3.39Å; T270-L273 PolarHBondContact O-N 3.05Å; L273-K275 VanDerWaalsContact C-N 3.34Å; L273-K275 PolarHBondContact O-N 2.03Å; L273-G276 CarbonylContact O-C 3.56Å; L273-G276 WeakPolarHBondContact O-CA 3.36Å; L273-G276 PolarHBondContact O-N 3.45Å; L273-L277 HydrophobicContact CG-CD1 4.24Å; L273-L277 WeakPolarHBondContact O-CG 3.46Å; L273-L277 PolarHBondContact O-N 2.81Å; L273-F292 HydrophobicContact CD1-CD1 3.73Å; L273-F292 HydrophobicContact CD1-CE1 3.77Å; L273-F292 WeakPolarHBondContact O-CE1 3.15Å; L273-F302 HydrophobicContact CB-CE1 3.82Å; L273-F302 HydrophobicContact CB-CZ 4.13Å; L273-F302 HydrophobicContact CD2-CE1 3.92Å; L273-F302 HydrophobicContact CD2-CE2 4.13Å; L273-F302 HydrophobicContact CD2-CZ 3.43Å; L273-F302 VanDerWaalsContact CD2-CZ 3.43Å; L273-F302 HydrophobicContact CG-CE1 4.37Å; L273-F302 HydrophobicContact CG-CZ 4.34Å; L273-D304 HydrophobicContact CD2-CB 3.77Å; L273-A305 HydrophobicContact CD1-CB 4.15Å
274	Y	96.2	Very high	93.9	Very high	10 Å²	10	38.2 Å²	38.2	4%	0.039	18%	0.182	C	C	.	.	H	α-helix	trans	-65.7	-35.3	178.8	-81.5	-76.9	0	0	0	112.6	E48 F246 F258 T270 A271 G276 L277 T278	E48-Y274 WeakPolarHBondContact OE2-CE2 3.29Å; E48-Y274 PolarHBondContact OE2-OH 3.34Å; F246-Y274 HydrophobicContact CD1-CD1 4.26Å; F246-Y274 HydrophobicContact CD1-CE1 4.22Å; F246-Y274 HydrophobicContact CD2-CD1 4.49Å; F246-Y274 HydrophobicContact CE1-CD1 4.42Å; F246-Y274 HydrophobicContact CE1-CE1 4.31Å; F246-Y274 HydrophobicContact CG-CD1 4.3Å; F258-Y274 HydrophobicContact CE1-CG 4.24Å; F258-Y274 HydrophobicContact CE2-CG 4.36Å; F258-Y274 HydrophobicContact CZ-CD1 4.22Å; F258-Y274 AromaticContact CZ-CG 3.84Å; F258-Y274 HydrophobicContact CZ-CG 3.84Å; T270-Y274 HydrophobicContact CG2-CD2 3.82Å; T270-Y274 HydrophobicContact CG2-CE2 3.7Å; T270-Y274 VanDerWaalsContact O-CD2 3.27Å; T270-Y274 WeakPolarHBondContact O-CD2 3.37Å; T270-Y274 PolarHBondContact O-N 3.47Å; A271-Y274 PolarHBondContact O-N 3.02Å; Y274-G276 VanDerWaalsContact C-N 3.3Å; Y274-G276 PolarHBondContact O-N 2.6Å; Y274-L277 HydrophobicContact CD1-CD1 4.1Å; Y274-L277 HydrophobicContact CE1-CD1 4.38Å; Y274-L277 PolarHBondContact O-N 3.09Å; Y274-L277 VanDerWaalsContact O-N 3.16Å; Y274-T278 WeakPolarHBondContact O-CG2 3.37Å; Y274-T278 PolarHBondContact O-N 3.47Å
275	K	96.6	Very high	93.8	Very high	31 Å²	31	34 Å²	34	14%	0.135	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-40	168.5	-174.1	178.5	-174.9	172.8	0	111.8	H255 F258 E259 L262 A271 M272 L273 T278 F279	H255-K275 WeakPolarHBondContact CE1-CE 3.28Å; F258-K275 HydrophobicContact CB-CB 4.07Å; E259-K275 IonicContact OE1-NZ 3.19Å; E259-K275 PolarHBondContact OE1-NZ 2.97Å; L262-K275 HydrophobicContact CD1-CB 4.46Å; L262-K275 HydrophobicContact CD1-CD 3.84Å; A271-K275 WeakPolarHBondContact O-CB 3.46Å; A271-K275 PolarHBondContact O-N 2.94Å; M272-K275 WeakPolarHBondContact O-CB 3.34Å; M272-K275 PolarHBondContact O-N 2.95Å; M272-K275 HydrophobicContact SD-CD 4.43Å; L273-K275 VanDerWaalsContact C-N 3.34Å; L273-K275 PolarHBondContact O-N 2.03Å; K275-T278 PolarHBondContact O-OG1 3.36Å; K275-F279 HydrophobicContact CG-CE2 4.18Å; K275-F279 WeakPolarHBondContact O-CD2 3.4Å; K275-F279 PolarHBondContact O-N 3.22Å
276	G	97	Very high	93.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67	-38.5	173.1	0	0	0	0	0	112.9	M272 L273 Y274 F279 F280 A288 A291 F292	M272-G276 PolarHBondContact O-N 3.16Å; L273-G276 CarbonylContact O-C 3.56Å; L273-G276 WeakPolarHBondContact O-CA 3.36Å; L273-G276 PolarHBondContact O-N 3.45Å; Y274-G276 VanDerWaalsContact C-N 3.3Å; Y274-G276 PolarHBondContact O-N 2.6Å; G276-F279 PolarHBondContact O-N 2.99Å; G276-F280 WeakPolarHBondContact O-CB 3.43Å; G276-F280 PolarHBondContact O-N 2.98Å; G276-A288 VanDerWaalsContact O-CB 3.31Å; G276-A288 WeakPolarHBondContact O-CB 3.34Å; G276-A291 VanDerWaalsContact CA-CB 3.47Å; G276-F292 VanDerWaalsContact C-CE1 3.4Å; G276-F292 VanDerWaalsContact C-CZ 3.47Å
277	L	96.4	Very high	93.9	Very high	15 Å²	15	33.5 Å²	33.5	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-67.3	-36.9	177.5	-70.8	171.8	0	0	0	112.2	F246 L273 Y274 F279 F280 H281 F292	F246-L277 HydrophobicContact CE2-CB 3.63Å; F246-L277 HydrophobicContact CZ-CB 3.84Å; F246-L277 HydrophobicContact CZ-CD1 4.33Å; L273-L277 HydrophobicContact CG-CD1 4.24Å; L273-L277 WeakPolarHBondContact O-CG 3.46Å; L273-L277 PolarHBondContact O-N 2.81Å; Y274-L277 HydrophobicContact CD1-CD1 4.1Å; Y274-L277 HydrophobicContact CE1-CD1 4.38Å; Y274-L277 PolarHBondContact O-N 3.09Å; Y274-L277 VanDerWaalsContact O-N 3.16Å; L277-F279 VanDerWaalsContact C-N 3.33Å; L277-F279 PolarHBondContact O-N 3.35Å; L277-F280 PolarHBondContact O-N 2.72Å; L277-H281 PolarHBondContact O-CD2 3.35Å; L277-H281 PolarHBondContact O-N 3.42Å; L277-F292 HydrophobicContact CD2-CE1 4.22Å; L277-F292 HydrophobicContact CD2-CZ 3.98Å; L277-F292 HydrophobicContact CG-CE1 4.08Å; L277-F292 HydrophobicContact CG-CZ 4.27Å
278	T	95.4	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-42.9	174	57.6	0	0	0	0	110.9	F246 Y251 A254 H255 F258 Y274 K275 R282	F246-T278 HydrophobicContact CD2-CG2 3.74Å; F246-T278 HydrophobicContact CE2-CG2 4.29Å; Y251-T278 WeakPolarHBondContact O-CB 3.47Å; A254-T278 HydrophobicContact CB-CG2 3.74Å; H255-T278 HydrophobicContact CB-CG2 4.39Å; F258-T278 HydrophobicContact CD2-CG2 4.06Å; F258-T278 HydrophobicContact CE2-CG2 4.07Å; Y274-T278 WeakPolarHBondContact O-CG2 3.37Å; Y274-T278 PolarHBondContact O-N 3.47Å; K275-T278 PolarHBondContact O-OG1 3.36Å; T278-R282 WeakPolarHBondContact O-CB 3.35Å; T278-R282 WeakPolarHBondContact O-CD 3.37Å; T278-R282 WeakPolarHBondContact O-CG 3.27Å; T278-R282 PolarHBondContact O-N 2.81Å; T278-R282 VanDerWaalsContact O-N 3.11Å
279	F	95.7	Very high	94.4	Very high	31 Å²	31	28.3 Å²	28.3	14%	0.136	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-45	172.4	-74.1	-51.9	0	0	0	112.5	H255 K275 G276 L277 H281 R282 G283 L284 E287 A288	H255-F279 AromaticContact CE1-CE1 3.66Å; H255-F279 AromaticContact CE1-CE2 3.54Å; H255-F279 AromaticContact CE1-CZ 3.05Å; H255-F279 WeakPolarHBondContact CE1-CZ 3.48Å; H255-F279 AromaticContact ND1-CE1 3.93Å; H255-F279 AromaticContact ND1-CE2 3.83Å; H255-F279 AromaticContact ND1-CZ 3.59Å; H255-F279 AromaticContact NE2-CZ 3.8Å; K275-F279 HydrophobicContact CG-CE2 4.18Å; K275-F279 WeakPolarHBondContact O-CD2 3.4Å; K275-F279 PolarHBondContact O-N 3.22Å; G276-F279 PolarHBondContact O-N 2.99Å; L277-F279 VanDerWaalsContact C-N 3.33Å; L277-F279 PolarHBondContact O-N 3.35Å; F279-H281 PolarHBondContact O-N 2.87Å; F279-R282 PolarHBondContact O-N 2.87Å; F279-G283 PolarHBondContact O-N 3.19Å; F279-G283 VanDerWaalsContact O-N 3.16Å; F279-L284 HydrophobicContact CB-CB 4.14Å; F279-L284 HydrophobicContact CD1-CB 3.99Å; F279-L284 HydrophobicContact CD1-CD1 3.73Å; F279-L284 HydrophobicContact CE1-CD1 4.17Å; F279-L284 HydrophobicContact CG-CB 4.49Å; F279-L284 PolarHBondContact O-N 3.31Å; F279-E287 HydrophobicContact CB-CB 4.22Å; F279-E287 HydrophobicContact CD1-CB 3.88Å; F279-E287 HydrophobicContact CD2-CB 3.85Å; F279-E287 HydrophobicContact CE1-CB 4.09Å; F279-E287 HydrophobicContact CE1-CG 4.48Å; F279-E287 HydrophobicContact CE2-CB 4.04Å; F279-E287 HydrophobicContact CG-CB 3.74Å; F279-E287 HydrophobicContact CZ-CB 4.13Å; F279-A288 HydrophobicContact CB-CB 3.83Å
280	F	94.7	Very high	94.5	Very high	16 Å²	16	31.7 Å²	31.7	7%	0.07	15%	0.149	C	C	.	.	H	α-helix	trans	-58.3	-50.1	179.6	177.9	-93.6	0	0	0	111.6	G276 L277 R282 G283 L285 A288 F292 Q311 A312 E315	G276-F280 WeakPolarHBondContact O-CB 3.43Å; G276-F280 PolarHBondContact O-N 2.98Å; L277-F280 PolarHBondContact O-N 2.72Å; F280-R282 VanDerWaalsContact C-N 3.28Å; F280-R282 PolarHBondContact O-N 3.34Å; F280-G283 PolarHBondContact O-N 3.39Å; F280-L285 HydrophobicContact CD2-CD2 3.52Å; F280-L285 HydrophobicContact CE2-CD2 3.74Å; F280-L285 HydrophobicContact CG-CD2 4.46Å; F280-A288 HydrophobicContact CB-CB 3.94Å; F280-F292 HydrophobicContact CB-CZ 4.3Å; F280-Q311 HydrophobicContact CE2-CG 4.1Å; F280-Q311 HydrophobicContact CZ-CG 3.72Å; F280-A312 HydrophobicContact CD2-CB 4.02Å; F280-A312 HydrophobicContact CE2-CB 4.26Å; F280-E315 HydrophobicContact CE2-CB 4.43Å; F280-E315 HydrophobicContact CE2-CG 3.89Å; F280-E315 HydrophobicContact CZ-CG 3.94Å
281	H	90.8	Very high	94.8	Very high	18 Å²	18	29.9 Å²	29.9	8%	0.083	14%	0.139	C	C	.	.	H	α-helix	trans	-68.5	-26.3	179.7	-74.5	-66.8	0	0	0	113.3	F246 Y251 L277 F279 G283 V594	F246-H281 AromaticContact CE2-CD2 3.69Å; F246-H281 AromaticContact CZ-CD2 3.53Å; F246-H281 AromaticContact CZ-NE2 3.7Å; Y251-H281 HydrophobicContact CD1-CB 3.91Å; Y251-H281 HydrophobicContact CD2-CB 4.04Å; Y251-H281 HydrophobicContact CE1-CB 3.66Å; Y251-H281 AromaticContact CE1-CD2 3.93Å; Y251-H281 AromaticContact CE1-CG 3.84Å; Y251-H281 HydrophobicContact CE2-CB 3.81Å; Y251-H281 HydrophobicContact CG-CB 4.08Å; Y251-H281 AromaticContact CZ-CG 3.87Å; L277-H281 PolarHBondContact O-CD2 3.35Å; L277-H281 PolarHBondContact O-N 3.42Å; F279-H281 PolarHBondContact O-N 2.87Å; H281-G283 PolarHBondContact O-N 3.43Å; H281-V594 WeakPolarHBondContact O-CG1 3.35Å; H281-V594 WeakPolarHBondContact O-CG2 3.3Å
282	R	90.4	Very high	95	Very high	60 Å²	60	29.9 Å²	29.9	23%	0.226	14%	0.139	C	C	.	.	H	α-helix	trans	-76.8	-8.6	171.3	-69.4	172.2	65.7	-167.3	1.8	113.5	Y251 T278 F279 F280 L284 Q593 I595	Y251-R282 HydrophobicContact CD2-CG 4.47Å; Y251-R282 HydrophobicContact CG-CG 4.38Å; T278-R282 WeakPolarHBondContact O-CB 3.35Å; T278-R282 WeakPolarHBondContact O-CD 3.37Å; T278-R282 WeakPolarHBondContact O-CG 3.27Å; T278-R282 PolarHBondContact O-N 2.81Å; T278-R282 VanDerWaalsContact O-N 3.11Å; F279-R282 PolarHBondContact O-N 2.87Å; F280-R282 VanDerWaalsContact C-N 3.28Å; F280-R282 PolarHBondContact O-N 3.34Å; R282-L284 HydrophobicContact CB-CD1 4.37Å; R282-L284 HydrophobicContact CB-CG 4.39Å; R282-Q593 HydrophobicContact CG-CB 4.42Å; R282-I595 WeakPolarHBondContact O-CB 3.35Å; R282-I595 PolarHBondContact O-N 3.18Å
283	G	88.4	Confident	95	Very high	6 Å²	6	31.9 Å²	31.9	6%	0.062	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	7.1	-177.1	0	0	0	0	0	114.6	F279 F280 H281 L285	F279-G283 PolarHBondContact O-N 3.19Å; F279-G283 VanDerWaalsContact O-N 3.16Å; F280-G283 PolarHBondContact O-N 3.39Å; H281-G283 PolarHBondContact O-N 3.43Å; G283-L285 VanDerWaalsContact C-N 3.31Å; G283-L285 PolarHBondContact O-N 2.85Å; G283-L285 VanDerWaalsContact O-N 3.12Å
284	L	91.4	Very high	95.1	Very high	43 Å²	43	34.6 Å²	34.6	23%	0.225	16%	0.159	C	C	.	.			trans	-86.8	68	179	-61.8	173.5	0	0	0	110.1	F279 R282 K286 E287 A288	F279-L284 HydrophobicContact CB-CB 4.14Å; F279-L284 HydrophobicContact CD1-CB 3.99Å; F279-L284 HydrophobicContact CD1-CD1 3.73Å; F279-L284 HydrophobicContact CE1-CD1 4.17Å; F279-L284 HydrophobicContact CG-CB 4.49Å; F279-L284 PolarHBondContact O-N 3.31Å; R282-L284 HydrophobicContact CB-CD1 4.37Å; R282-L284 HydrophobicContact CB-CG 4.39Å; L284-K286 PolarHBondContact O-N 3.42Å; L284-E287 HydrophobicContact CB-CB 4.36Å; L284-E287 PolarHBondContact O-N 2.94Å; L284-A288 WeakPolarHBondContact O-CB 3.37Å; L284-A288 PolarHBondContact O-N 3.12Å
285	L	92.1	Very high	95.1	Very high	9 Å²	9	34.1 Å²	34.1	5%	0.047	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-31.7	-168.5	-63.7	179.4	0	0	0	114.1	F280 G283 A288 I289 E315 M597	F280-L285 HydrophobicContact CD2-CD2 3.52Å; F280-L285 HydrophobicContact CE2-CD2 3.74Å; F280-L285 HydrophobicContact CG-CD2 4.46Å; G283-L285 VanDerWaalsContact C-N 3.31Å; G283-L285 PolarHBondContact O-N 2.85Å; G283-L285 VanDerWaalsContact O-N 3.12Å; L285-A288 PolarHBondContact O-N 2.87Å; L285-I289 WeakPolarHBondContact O-CB 3.32Å; L285-I289 WeakPolarHBondContact O-CD1 3.11Å; L285-I289 WeakPolarHBondContact O-CG1 3.28Å; L285-I289 PolarHBondContact O-N 3.36Å; L285-E315 HydrophobicContact CD1-CB 3.57Å; L285-E315 HydrophobicContact CD2-CB 4.06Å; L285-E315 HydrophobicContact CG-CB 4.49Å; L285-M597 HydrophobicContact CD1-CG 4.21Å; L285-M597 HydrophobicContact CD1-SD 3.95Å; L285-M597 HydrophobicContact CG-SD 4.49Å
286	K	93.1	Very high	95.1	Very high	152 Å²	152	33.5 Å²	33.5	66%	0.661	16%	0.156	S	C	*	.	H	α-helix	trans	-69.6	-45.7	-178.6	-67.9	178.5	-177.6	170.2	0	110.1	L284 A288 I289 E290	L284-K286 PolarHBondContact O-N 3.42Å; K286-A288 VanDerWaalsContact C-N 3.33Å; K286-I289 PolarHBondContact O-N 3.35Å; K286-E290 PolarHBondContact O-N 2.88Å; K286-E290 VanDerWaalsContact O-N 3.09Å
287	E	95.9	Very high	95.1	Very high	86 Å²	86	40.3 Å²	40.3	40%	0.402	19%	0.185	S	C	.	.	H	α-helix	trans	-62.3	-41.9	175.3	-61.9	83.4	169.2	0	0	110.6	F279 L284 E290 A291	F279-E287 HydrophobicContact CB-CB 4.22Å; F279-E287 HydrophobicContact CD1-CB 3.88Å; F279-E287 HydrophobicContact CD2-CB 3.85Å; F279-E287 HydrophobicContact CE1-CB 4.09Å; F279-E287 HydrophobicContact CE1-CG 4.48Å; F279-E287 HydrophobicContact CE2-CB 4.04Å; F279-E287 HydrophobicContact CG-CB 3.74Å; F279-E287 HydrophobicContact CZ-CB 4.13Å; L284-E287 HydrophobicContact CB-CB 4.36Å; L284-E287 PolarHBondContact O-N 2.94Å; E287-E290 PolarHBondContact O-N 3.03Å; E287-A291 WeakPolarHBondContact O-CB 3.35Å; E287-A291 PolarHBondContact O-N 3.31Å
288	A	96.9	Very high	95	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-46.8	173.9	0	0	0	0	0	112.5	G276 F279 F280 L284 L285 K286 E290 A291 F292	G276-A288 VanDerWaalsContact O-CB 3.31Å; G276-A288 WeakPolarHBondContact O-CB 3.34Å; F279-A288 HydrophobicContact CB-CB 3.83Å; F280-A288 HydrophobicContact CB-CB 3.94Å; L284-A288 WeakPolarHBondContact O-CB 3.37Å; L284-A288 PolarHBondContact O-N 3.12Å; L285-A288 PolarHBondContact O-N 2.87Å; K286-A288 VanDerWaalsContact C-N 3.33Å; A288-E290 VanDerWaalsContact C-N 3.35Å; A288-E290 PolarHBondContact O-N 3.24Å; A288-A291 PolarHBondContact O-N 2.61Å; A288-F292 HydrophobicContact CB-CE2 3.99Å; A288-F292 HydrophobicContact CB-CZ 4.35Å; A288-F292 WeakPolarHBondContact O-CD2 3.47Å; A288-F292 WeakPolarHBondContact O-CG 3.35Å; A288-F292 PolarHBondContact O-N 3.4Å
289	I	97.6	Very high	95	Very high	7 Å²	7	46.5 Å²	46.5	4%	0.036	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-45.8	178.6	-75.7	163	0	0	0	111.1	L285 K286 F292 K293 L309 A312 Y313 L316	L285-I289 WeakPolarHBondContact O-CB 3.32Å; L285-I289 WeakPolarHBondContact O-CD1 3.11Å; L285-I289 WeakPolarHBondContact O-CG1 3.28Å; L285-I289 PolarHBondContact O-N 3.36Å; K286-I289 PolarHBondContact O-N 3.35Å; I289-F292 PolarHBondContact O-N 3.09Å; I289-K293 HydrophobicContact CG2-CD 4.27Å; I289-K293 WeakPolarHBondContact O-CG 3.46Å; I289-K293 PolarHBondContact O-N 3.42Å; I289-L309 HydrophobicContact CB-CD1 4.25Å; I289-L309 HydrophobicContact CG1-CD1 4.16Å; I289-L309 HydrophobicContact CG2-CD1 3.87Å; I289-A312 HydrophobicContact CD1-CB 4.29Å; I289-A312 HydrophobicContact CG1-CB 3.68Å; I289-Y313 HydrophobicContact CD1-CD1 3.83Å; I289-Y313 HydrophobicContact CD1-CE1 3.74Å; I289-Y313 HydrophobicContact CG1-CE1 4.33Å; I289-Y313 HydrophobicContact CG2-CE1 4.16Å; I289-L316 HydrophobicContact CD1-CD2 3.88Å
290	E	97.6	Very high	95	Very high	96 Å²	96	49.9 Å²	49.9	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-65.5	-42.8	178.8	-65.6	-51.4	123.9	0	0	111.3	K286 E287 A288 F292 K293 E294	K286-E290 PolarHBondContact O-N 2.88Å; K286-E290 VanDerWaalsContact O-N 3.09Å; E287-E290 PolarHBondContact O-N 3.03Å; A288-E290 VanDerWaalsContact C-N 3.35Å; A288-E290 PolarHBondContact O-N 3.24Å; E290-F292 PolarHBondContact O-N 3.16Å; E290-K293 PolarHBondContact O-N 2.85Å; E290-K293 IonicContact OE1-NZ 2.85Å; E290-K293 PolarHBondContact OE1-NZ 3.3Å; E290-K293 IonicContact OE2-NZ 2.75Å; E290-E294 WeakPolarHBondContact O-CG 3.44Å; E290-E294 PolarHBondContact O-N 2.99Å
291	A	97.4	Very high	95	Very high	9 Å²	9	53.7 Å²	53.7	7%	0.074	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-42.2	174.5	0	0	0	0	0	112.7	M272 G276 E287 A288 K293 E294 A295	M272-A291 WeakPolarHBondContact CG-O 3.42Å; G276-A291 VanDerWaalsContact CA-CB 3.47Å; E287-A291 WeakPolarHBondContact O-CB 3.35Å; E287-A291 PolarHBondContact O-N 3.31Å; A288-A291 PolarHBondContact O-N 2.61Å; A291-K293 PolarHBondContact O-N 3.05Å; A291-E294 PolarHBondContact O-N 2.93Å; A291-A295 PolarHBondContact O-N 3.4Å
292	F	98.2	Very high	95.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-37.3	175.9	-61.1	-35.5	0	0	0	112.6	L273 G276 L277 F280 A288 I289 E290 A295 L296 L309 A312	L273-F292 HydrophobicContact CD1-CD1 3.73Å; L273-F292 HydrophobicContact CD1-CE1 3.77Å; L273-F292 WeakPolarHBondContact O-CE1 3.15Å; G276-F292 VanDerWaalsContact C-CE1 3.4Å; G276-F292 VanDerWaalsContact C-CZ 3.47Å; L277-F292 HydrophobicContact CD2-CE1 4.22Å; L277-F292 HydrophobicContact CD2-CZ 3.98Å; L277-F292 HydrophobicContact CG-CE1 4.08Å; L277-F292 HydrophobicContact CG-CZ 4.27Å; F280-F292 HydrophobicContact CB-CZ 4.3Å; A288-F292 HydrophobicContact CB-CE2 3.99Å; A288-F292 HydrophobicContact CB-CZ 4.35Å; A288-F292 WeakPolarHBondContact O-CD2 3.47Å; A288-F292 WeakPolarHBondContact O-CG 3.35Å; A288-F292 PolarHBondContact O-N 3.4Å; I289-F292 PolarHBondContact O-N 3.09Å; E290-F292 PolarHBondContact O-N 3.16Å; F292-A295 PolarHBondContact O-N 3.19Å; F292-L296 WeakPolarHBondContact O-CG 3.39Å; F292-L296 PolarHBondContact O-N 3.37Å; F292-L309 HydrophobicContact CB-CB 4.18Å; F292-L309 HydrophobicContact CB-CD1 4.22Å; F292-L309 HydrophobicContact CD2-CB 4.38Å; F292-A312 HydrophobicContact CD2-CB 4.38Å; F292-A312 HydrophobicContact CE2-CB 4.09Å
293	K	97.9	Very high	95.5	Very high	70 Å²	70	52.6 Å²	52.6	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-65.6	-40.2	173.6	-72.6	172.7	-176.9	169.1	0	111.9	I289 E290 A291 A295 L296 K297 L309 Y313	I289-K293 HydrophobicContact CG2-CD 4.27Å; I289-K293 WeakPolarHBondContact O-CG 3.46Å; I289-K293 PolarHBondContact O-N 3.42Å; E290-K293 PolarHBondContact O-N 2.85Å; E290-K293 IonicContact OE1-NZ 2.85Å; E290-K293 PolarHBondContact OE1-NZ 3.3Å; E290-K293 IonicContact OE2-NZ 2.75Å; A291-K293 PolarHBondContact O-N 3.05Å; K293-A295 VanDerWaalsContact C-N 3.35Å; K293-L296 PolarHBondContact O-N 2.93Å; K293-K297 WeakPolarHBondContact O-CG 3.38Å; K293-K297 PolarHBondContact O-N 3.1Å; K293-L309 HydrophobicContact CG-CD1 4.44Å; K293-Y313 VanDerWaalsContact CE-OH 3.28Å; K293-Y313 WeakPolarHBondContact CE-OH 3.45Å
294	E	96.6	Very high	95.7	Very high	68 Å²	68	54.5 Å²	54.5	32%	0.318	26%	0.263	S	S	.	.	H	α-helix	trans	-63.7	-40.9	174.5	-68.5	-52.1	145.1	0	0	111.7	M272 E290 A291 L296 K297 Q298	M272-E294 HydrophobicContact CE-CB 4.32Å; M272-E294 HydrophobicContact CG-CB 4.03Å; M272-E294 HydrophobicContact SD-CB 4.14Å; E290-E294 WeakPolarHBondContact O-CG 3.44Å; E290-E294 PolarHBondContact O-N 2.99Å; A291-E294 PolarHBondContact O-N 2.93Å; E294-L296 VanDerWaalsContact C-N 3.26Å; E294-L296 PolarHBondContact O-N 2.94Å; E294-K297 WeakPolarHBondContact O-CB 3.3Å; E294-K297 PolarHBondContact O-N 3.37Å; E294-K297 VanDerWaalsContact O-N 3.14Å; E294-K297 IonicContact OE1-NZ 2.93Å; E294-K297 PolarHBondContact OE1-NZ 3.41Å; E294-K297 VanDerWaalsContact OE2-CD 3.3Å; E294-K297 WeakPolarHBondContact OE2-CD 3.49Å; E294-K297 IonicContact OE2-NZ 3.91Å; E294-K297 PolarHBondContact OE2-NZ 3.2Å; E294-Q298 PolarHBondContact O-N 3Å
295	A	96.4	Very high	96	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-40	172.8	0	0	0	0	0	111.7	M272 A291 F292 K293 Q298 K299 F302 A305	M272-A295 HydrophobicContact CB-CB 3.97Å; M272-A295 HydrophobicContact CG-CB 3.94Å; A291-A295 PolarHBondContact O-N 3.4Å; F292-A295 PolarHBondContact O-N 3.19Å; K293-A295 VanDerWaalsContact C-N 3.35Å; A295-Q298 PolarHBondContact O-N 3.39Å; A295-K299 PolarHBondContact O-N 2.87Å; A295-F302 HydrophobicContact CB-CD1 4.37Å; A295-A305 HydrophobicContact CB-CB 4.36Å
296	L	96.9	Very high	96.3	Very high	18 Å²	18	53.7 Å²	53.7	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-71.5	-25.9	177	-73.4	166.2	0	0	0	114.1	F292 K293 E294 Q298 K299 V300 F302 A305 Y306 L309	F292-L296 WeakPolarHBondContact O-CG 3.39Å; F292-L296 PolarHBondContact O-N 3.37Å; K293-L296 PolarHBondContact O-N 2.93Å; E294-L296 VanDerWaalsContact C-N 3.26Å; E294-L296 PolarHBondContact O-N 2.94Å; L296-Q298 VanDerWaalsContact C-N 3.34Å; L296-K299 WeakPolarHBondContact CA-O 3.4Å; L296-K299 CarbonylContact O-C 3.57Å; L296-K299 VanDerWaalsContact O-C 3.27Å; L296-V300 WeakPolarHBondContact O-CA 3.39Å; L296-V300 PolarHBondContact O-N 3.41Å; L296-F302 HydrophobicContact CD2-CB 4.1Å; L296-A305 HydrophobicContact CD1-CB 4.38Å; L296-A305 HydrophobicContact CD2-CB 3.83Å; L296-A305 HydrophobicContact CG-CB 3.75Å; L296-Y306 HydrophobicContact CD1-CD1 3.66Å; L296-Y306 HydrophobicContact CD1-CE1 3.57Å; L296-Y306 HydrophobicContact CD1-CG 4.25Å; L296-Y306 HydrophobicContact CD2-CD1 4.09Å; L296-Y306 HydrophobicContact CD2-CD2 3.7Å; L296-Y306 HydrophobicContact CD2-CE1 3.93Å; L296-Y306 HydrophobicContact CD2-CE2 3.57Å; L296-Y306 HydrophobicContact CD2-CG 3.96Å; L296-Y306 HydrophobicContact CG-CE1 4.37Å; L296-L309 HydrophobicContact CD1-CD2 3.89Å
297	K	96.7	Very high	96.5	Very high	142 Å²	142	47.3 Å²	47.3	62%	0.617	23%	0.229	S	C	*	.	H	α-helix	trans	-70.2	-34.2	171.6	-72.9	174.5	-173	171.5	0	111.7	K293 E294	K293-K297 WeakPolarHBondContact O-CG 3.38Å; K293-K297 PolarHBondContact O-N 3.1Å; E294-K297 WeakPolarHBondContact O-CB 3.3Å; E294-K297 PolarHBondContact O-N 3.37Å; E294-K297 VanDerWaalsContact O-N 3.14Å; E294-K297 IonicContact OE1-NZ 2.93Å; E294-K297 PolarHBondContact OE1-NZ 3.41Å; E294-K297 VanDerWaalsContact OE2-CD 3.3Å; E294-K297 WeakPolarHBondContact OE2-CD 3.49Å; E294-K297 IonicContact OE2-NZ 3.91Å; E294-K297 PolarHBondContact OE2-NZ 3.2Å
298	Q	94.4	Very high	96.5	Very high	63 Å²	63	43.6 Å²	43.6	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-76.3	-40.7	175.2	-63.2	-177.7	14.3	0	0	111.5	R266 Q268 P269 E294 A295 L296	R266-Q298 PolarHBondContact O-NE2 3.11Å; R266-Q298 PolarHBondContact O-OE1 3.33Å; Q268-Q298 VanDerWaalsContact C-OE1 3.3Å; Q268-Q298 VanDerWaalsContact N-OE1 3.14Å; P269-Q298 HydrophobicContact CB-CB 4.12Å; P269-Q298 VanDerWaalsContact N-OE1 3.12Å; E294-Q298 PolarHBondContact O-N 3Å; A295-Q298 PolarHBondContact O-N 3.39Å; L296-Q298 VanDerWaalsContact C-N 3.34Å
299	K	95.7	Very high	96.6	Very high	82 Å²	82	44.1 Å²	44.1	36%	0.357	22%	0.215	S	C	.	.			trans	-134.3	102.3	178.7	-174.8	178.5	177.2	172.4	0	111.2	P269 A295 L296 D301 F302	P269-K299 HydrophobicContact CB-CB 3.9Å; P269-K299 HydrophobicContact CG-CB 4.07Å; A295-K299 PolarHBondContact O-N 2.87Å; L296-K299 WeakPolarHBondContact CA-O 3.4Å; L296-K299 CarbonylContact O-C 3.57Å; L296-K299 VanDerWaalsContact O-C 3.27Å; K299-D301 WeakPolarHBondContact CE-OD1 3.32Å; K299-D301 WeakPolarHBondContact CG-OD1 3.5Å; K299-D301 PolarHBondContact O-N 2.98Å; K299-F302 HydrophobicContact CB-CB 4.13Å; K299-F302 HydrophobicContact CD-CB 3.99Å; K299-F302 HydrophobicContact CD-CD2 4.4Å; K299-F302 HydrophobicContact CD-CG 4.1Å; K299-F302 HydrophobicContact CG-CB 3.93Å; K299-F302 HydrophobicContact CG-CG 4.5Å; K299-F302 VanDerWaalsContact O-CB 3.29Å; K299-F302 WeakPolarHBondContact O-CB 3.45Å; K299-F302 PolarHBondContact O-N 2.92Å
300	V	95.1	Very high	96.6	Very high	102 Å²	102	43.8 Å²	43.8	62%	0.618	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-34.8	-174.9	179.3	0	0	0	0	112.4	L296 F302 Y306	L296-V300 WeakPolarHBondContact O-CA 3.39Å; L296-V300 PolarHBondContact O-N 3.41Å; V300-F302 VanDerWaalsContact C-N 3.25Å; V300-F302 PolarHBondContact O-N 2.73Å; V300-Y306 VanDerWaalsContact O-CE2 3.3Å; V300-Y306 WeakPolarHBondContact O-CE2 3.27Å
301	D	94.9	Very high	96.5	Very high	97 Å²	97	40.5 Å²	40.5	52%	0.519	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	31.8	-179.3	66.5	-27.9	0	0	0	112.8	K299 I303 L332	K299-D301 WeakPolarHBondContact CE-OD1 3.32Å; K299-D301 WeakPolarHBondContact CG-OD1 3.5Å; K299-D301 PolarHBondContact O-N 2.98Å; D301-I303 PolarHBondContact O-N 3.35Å; D301-L332 HydrophobicContact CB-CD2 4.19Å
302	F	95.8	Very high	96.4	Very high	16 Å²	16	40 Å²	40	7%	0.07	20%	0.195	C	C	.	.			trans	-91.1	91.9	-176.6	-160.9	-174.4	0	0	0	112.9	P269 L273 A295 L296 K299 V300 D304 A305 Y306	P269-F302 HydrophobicContact CB-CD1 4.24Å; P269-F302 HydrophobicContact CB-CE1 4.14Å; L273-F302 HydrophobicContact CB-CE1 3.82Å; L273-F302 HydrophobicContact CB-CZ 4.13Å; L273-F302 HydrophobicContact CD2-CE1 3.92Å; L273-F302 HydrophobicContact CD2-CE2 4.13Å; L273-F302 HydrophobicContact CD2-CZ 3.43Å; L273-F302 VanDerWaalsContact CD2-CZ 3.43Å; L273-F302 HydrophobicContact CG-CE1 4.37Å; L273-F302 HydrophobicContact CG-CZ 4.34Å; A295-F302 HydrophobicContact CB-CD1 4.37Å; L296-F302 HydrophobicContact CD2-CB 4.1Å; K299-F302 HydrophobicContact CB-CB 4.13Å; K299-F302 HydrophobicContact CD-CB 3.99Å; K299-F302 HydrophobicContact CD-CD2 4.4Å; K299-F302 HydrophobicContact CD-CG 4.1Å; K299-F302 HydrophobicContact CG-CB 3.93Å; K299-F302 HydrophobicContact CG-CG 4.5Å; K299-F302 VanDerWaalsContact O-CB 3.29Å; K299-F302 WeakPolarHBondContact O-CB 3.45Å; K299-F302 PolarHBondContact O-N 2.92Å; V300-F302 VanDerWaalsContact C-N 3.25Å; V300-F302 PolarHBondContact O-N 2.73Å; F302-D304 VanDerWaalsContact C-N 3.34Å; F302-D304 HydrophobicContact CD2-CB 4.26Å; F302-D304 HydrophobicContact CE2-CB 3.87Å; F302-D304 HydrophobicContact CZ-CB 4.49Å; F302-D304 PolarHBondContact O-N 3.31Å; F302-A305 HydrophobicContact CB-CB 4.03Å; F302-A305 HydrophobicContact CD1-CB 3.59Å; F302-A305 HydrophobicContact CE1-CB 4.25Å; F302-A305 HydrophobicContact CG-CB 3.85Å; F302-A305 PolarHBondContact O-N 3.31Å; F302-A305 VanDerWaalsContact O-N 3.17Å; F302-Y306 PolarHBondContact O-N 3.49Å; F302-Y306 VanDerWaalsContact O-N 3.15Å
303	I	95.7	Very high	96.4	Very high	38 Å²	38	41.6 Å²	41.6	20%	0.195	20%	0.201	C	C	.	.	H	α-helix	trans	-54	-46.2	-177.8	-62.5	164.4	0	0	0	112.2	D301 A305 Y306 K307 A329 L332 N333	D301-I303 PolarHBondContact O-N 3.35Å; I303-A305 VanDerWaalsContact C-N 3.33Å; I303-A305 PolarHBondContact O-N 3.4Å; I303-Y306 PolarHBondContact O-N 3.23Å; I303-K307 WeakPolarHBondContact O-CB 3.35Å; I303-K307 PolarHBondContact O-N 2.68Å; I303-A329 HydrophobicContact CG2-CB 4.29Å; I303-L332 HydrophobicContact CD1-CB 4.17Å; I303-L332 HydrophobicContact CG1-CB 3.67Å; I303-L332 HydrophobicContact CG1-CD1 3.89Å; I303-L332 HydrophobicContact CG1-CG 4.46Å; I303-N333 HydrophobicContact CD1-CB 3.59Å
304	D	94.1	Very high	96.2	Very high	47 Å²	47	39.5 Å²	39.5	25%	0.251	19%	0.191	S	C	.	.	H	α-helix	trans	-65.7	-33.9	-178.2	-74	-52.8	0	0	0	113.2	L273 F302 K307 S308	L273-D304 HydrophobicContact CD2-CB 3.77Å; F302-D304 VanDerWaalsContact C-N 3.34Å; F302-D304 HydrophobicContact CD2-CB 4.26Å; F302-D304 HydrophobicContact CE2-CB 3.87Å; F302-D304 HydrophobicContact CZ-CB 4.49Å; F302-D304 PolarHBondContact O-N 3.31Å; D304-K307 IonicContact OD1-NZ 3.84Å; D304-K307 PolarHBondContact OD1-NZ 3.03Å; D304-S308 WeakPolarHBondContact O-CB 3.44Å; D304-S308 PolarHBondContact O-N 3.22Å; D304-S308 PolarHBondContact O-OG 2.93Å
305	A	96	Very high	96	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69	-42.7	174.4	0	0	0	0	0	111.6	L273 A295 L296 F302 I303 K307 S308 L309	L273-A305 HydrophobicContact CD1-CB 4.15Å; A295-A305 HydrophobicContact CB-CB 4.36Å; L296-A305 HydrophobicContact CD1-CB 4.38Å; L296-A305 HydrophobicContact CD2-CB 3.83Å; L296-A305 HydrophobicContact CG-CB 3.75Å; F302-A305 HydrophobicContact CB-CB 4.03Å; F302-A305 HydrophobicContact CD1-CB 3.59Å; F302-A305 HydrophobicContact CE1-CB 4.25Å; F302-A305 HydrophobicContact CG-CB 3.85Å; F302-A305 PolarHBondContact O-N 3.31Å; F302-A305 VanDerWaalsContact O-N 3.17Å; I303-A305 VanDerWaalsContact C-N 3.33Å; I303-A305 PolarHBondContact O-N 3.4Å; A305-K307 PolarHBondContact O-N 3.25Å; A305-S308 PolarHBondContact O-N 2.85Å; A305-L309 WeakPolarHBondContact O-CB 3.44Å; A305-L309 PolarHBondContact O-N 3.29Å
306	Y	98.3	Very high	95.7	Very high	35 Å²	35	40.4 Å²	40.4	14%	0.137	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-39.8	173.6	-80.4	-55.9	0	0	0	113	L296 V300 F302 I303 G310 K328 L332	L296-Y306 HydrophobicContact CD1-CD1 3.66Å; L296-Y306 HydrophobicContact CD1-CE1 3.57Å; L296-Y306 HydrophobicContact CD1-CG 4.25Å; L296-Y306 HydrophobicContact CD2-CD1 4.09Å; L296-Y306 HydrophobicContact CD2-CD2 3.7Å; L296-Y306 HydrophobicContact CD2-CE1 3.93Å; L296-Y306 HydrophobicContact CD2-CE2 3.57Å; L296-Y306 HydrophobicContact CD2-CG 3.96Å; L296-Y306 HydrophobicContact CG-CE1 4.37Å; V300-Y306 VanDerWaalsContact O-CE2 3.3Å; V300-Y306 WeakPolarHBondContact O-CE2 3.27Å; F302-Y306 PolarHBondContact O-N 3.49Å; F302-Y306 VanDerWaalsContact O-N 3.15Å; I303-Y306 PolarHBondContact O-N 3.23Å; Y306-G310 PolarHBondContact O-N 3.21Å; Y306-K328 HydrophobicContact CD1-CB 3.91Å; Y306-K328 HydrophobicContact CD1-CD 4.15Å; Y306-K328 HydrophobicContact CD2-CB 4.23Å; Y306-K328 HydrophobicContact CE1-CB 4Å; Y306-K328 HydrophobicContact CE1-CD 3.56Å; Y306-K328 HydrophobicContact CE1-CG 4.42Å; Y306-K328 HydrophobicContact CE2-CB 4.26Å; Y306-K328 HydrophobicContact CG-CB 4.06Å; Y306-L332 HydrophobicContact CD2-CD1 3.74Å; Y306-L332 HydrophobicContact CE2-CD1 3.88Å
307	K	97.3	Very high	95.4	Very high	18 Å²	18	40.5 Å²	40.5	8%	0.078	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-51.8	174.5	177.8	-164.7	75	-162.7	0	111	I303 D304 A305 L309 G310 Q311 F326 Q338 L342	I303-K307 WeakPolarHBondContact O-CB 3.35Å; I303-K307 PolarHBondContact O-N 2.68Å; D304-K307 IonicContact OD1-NZ 3.84Å; D304-K307 PolarHBondContact OD1-NZ 3.03Å; A305-K307 PolarHBondContact O-N 3.25Å; K307-L309 VanDerWaalsContact C-N 3.34Å; K307-L309 PolarHBondContact O-N 2.85Å; K307-G310 PolarHBondContact O-N 2.58Å; K307-Q311 PolarHBondContact O-N 3.29Å; K307-F326 WeakPolarHBondContact O-CE1 3.3Å; K307-Q338 HydrophobicContact CD-CB 4.19Å; K307-L342 HydrophobicContact CD-CD1 4.17Å; K307-L342 HydrophobicContact CG-CD1 3.77Å
308	S	97.6	Very high	95.3	Very high	7 Å²	7	36.6 Å²	36.6	5%	0.049	19%	0.188	C	C	.	.	H	α-helix	trans	-65.3	-37.6	-179.6	-60.2	0	0	0	0	111.9	D304 A305 Q311 A312	D304-S308 WeakPolarHBondContact O-CB 3.44Å; D304-S308 PolarHBondContact O-N 3.22Å; D304-S308 PolarHBondContact O-OG 2.93Å; A305-S308 PolarHBondContact O-N 2.85Å; S308-Q311 PolarHBondContact O-N 2.75Å; S308-A312 WeakPolarHBondContact O-CB 3.48Å; S308-A312 PolarHBondContact O-N 3.34Å
309	L	97.8	Very high	95.2	Very high	11 Å²	11	34.9 Å²	34.9	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-62.1	-44.8	172.7	-176.8	63.7	0	0	0	111.8	I289 F292 K293 L296 A305 K307 Q311 A312 Y313	I289-L309 HydrophobicContact CB-CD1 4.25Å; I289-L309 HydrophobicContact CG1-CD1 4.16Å; I289-L309 HydrophobicContact CG2-CD1 3.87Å; F292-L309 HydrophobicContact CB-CB 4.18Å; F292-L309 HydrophobicContact CB-CD1 4.22Å; F292-L309 HydrophobicContact CD2-CB 4.38Å; K293-L309 HydrophobicContact CG-CD1 4.44Å; L296-L309 HydrophobicContact CD1-CD2 3.89Å; A305-L309 WeakPolarHBondContact O-CB 3.44Å; A305-L309 PolarHBondContact O-N 3.29Å; K307-L309 VanDerWaalsContact C-N 3.34Å; K307-L309 PolarHBondContact O-N 2.85Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 3.2Å; L309-A312 PolarHBondContact O-N 3.25Å; L309-Y313 HydrophobicContact CD1-CD2 3.98Å; L309-Y313 HydrophobicContact CD1-CE2 3.43Å; L309-Y313 VanDerWaalsContact CD1-CE2 3.43Å; L309-Y313 HydrophobicContact CD2-CE2 4.09Å; L309-Y313 HydrophobicContact CG-CD2 3.87Å; L309-Y313 HydrophobicContact CG-CE2 3.54Å; L309-Y313 VanDerWaalsContact O-CD2 3.24Å; L309-Y313 WeakPolarHBondContact O-CD2 3.33Å; L309-Y313 PolarHBondContact O-N 3.24Å
310	G	97.3	Very high	95.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-40.8	175.3	0	0	0	0	0	112.7	Y306 K307 Y313 R314 A322 S325 F326	Y306-G310 PolarHBondContact O-N 3.21Å; K307-G310 PolarHBondContact O-N 2.58Å; G310-Y313 PolarHBondContact O-N 2.8Å; G310-R314 PolarHBondContact O-N 2.92Å; G310-A322 VanDerWaalsContact O-CB 3.31Å; G310-A322 WeakPolarHBondContact O-CB 3.31Å; G310-S325 VanDerWaalsContact CA-CB 3.49Å; G310-F326 VanDerWaalsContact C-CZ 3.42Å
311	Q	96.3	Very high	95.3	Very high	27 Å²	27	33.2 Å²	33.2	13%	0.126	17%	0.169	C	C	.	.	H	α-helix	trans	-66.2	-42.8	175	-171	174.7	-12.2	0	0	112.1	F280 K307 S308 L309 Y313 R314 E315 F326	F280-Q311 HydrophobicContact CE2-CG 4.1Å; F280-Q311 HydrophobicContact CZ-CG 3.72Å; K307-Q311 PolarHBondContact O-N 3.29Å; S308-Q311 PolarHBondContact O-N 2.75Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 3.2Å; Q311-Y313 VanDerWaalsContact C-N 3.34Å; Q311-Y313 PolarHBondContact O-N 2.73Å; Q311-R314 WeakPolarHBondContact O-CB 3.41Å; Q311-R314 PolarHBondContact O-N 3.24Å; Q311-E315 PolarHBondContact O-N 2.94Å; Q311-F326 HydrophobicContact CB-CZ 4.44Å
312	A	96.1	Very high	95.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.2	-39.9	175.7	0	0	0	0	0	112.4	F280 I289 F292 S308 L309 E315 L316	F280-A312 HydrophobicContact CD2-CB 4.02Å; F280-A312 HydrophobicContact CE2-CB 4.26Å; I289-A312 HydrophobicContact CD1-CB 4.29Å; I289-A312 HydrophobicContact CG1-CB 3.68Å; F292-A312 HydrophobicContact CD2-CB 4.38Å; F292-A312 HydrophobicContact CE2-CB 4.09Å; S308-A312 WeakPolarHBondContact O-CB 3.48Å; S308-A312 PolarHBondContact O-N 3.34Å; L309-A312 PolarHBondContact O-N 3.25Å; A312-E315 PolarHBondContact O-N 3.18Å; A312-L316 WeakPolarHBondContact O-CB 3.47Å; A312-L316 PolarHBondContact O-N 2.91Å
313	Y	96.7	Very high	95.4	Very high	33 Å²	33	29.5 Å²	29.5	13%	0.129	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-37.1	173.4	-77.1	-53.4	0	0	0	113.2	I289 K293 L309 G310 Q311 L316 G317 N318 A321	I289-Y313 HydrophobicContact CD1-CD1 3.83Å; I289-Y313 HydrophobicContact CD1-CE1 3.74Å; I289-Y313 HydrophobicContact CG1-CE1 4.33Å; I289-Y313 HydrophobicContact CG2-CE1 4.16Å; K293-Y313 VanDerWaalsContact CE-OH 3.28Å; K293-Y313 WeakPolarHBondContact CE-OH 3.45Å; L309-Y313 HydrophobicContact CD1-CD2 3.98Å; L309-Y313 HydrophobicContact CD1-CE2 3.43Å; L309-Y313 VanDerWaalsContact CD1-CE2 3.43Å; L309-Y313 HydrophobicContact CD2-CE2 4.09Å; L309-Y313 HydrophobicContact CG-CD2 3.87Å; L309-Y313 HydrophobicContact CG-CE2 3.54Å; L309-Y313 VanDerWaalsContact O-CD2 3.24Å; L309-Y313 WeakPolarHBondContact O-CD2 3.33Å; L309-Y313 PolarHBondContact O-N 3.24Å; G310-Y313 PolarHBondContact O-N 2.8Å; Q311-Y313 VanDerWaalsContact C-N 3.34Å; Q311-Y313 PolarHBondContact O-N 2.73Å; Y313-L316 HydrophobicContact CD1-CD2 4.34Å; Y313-L316 PolarHBondContact O-N 2.82Å; Y313-G317 PolarHBondContact O-N 3.41Å; Y313-G317 VanDerWaalsContact O-N 3.13Å; Y313-N318 HydrophobicContact CD1-CB 4.21Å; Y313-N318 PolarHBondContact O-N 3.49Å; Y313-A321 HydrophobicContact CD1-CB 3.79Å; Y313-A321 HydrophobicContact CD2-CB 3.69Å; Y313-A321 HydrophobicContact CE1-CB 4.05Å; Y313-A321 HydrophobicContact CE2-CB 3.93Å; Y313-A321 HydrophobicContact CG-CB 3.62Å
314	R	94.8	Very high	95.5	Very high	26 Å²	26	32.8 Å²	32.8	10%	0.098	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-50.3	171.4	173.9	-163.7	172.6	-129.7	14.6	110.1	E37 G310 Q311 L316 G317 A322 M346 H349	E37-R314 IonicContact OE2-CZ 3.9Å; E37-R314 IonicContact OE2-NH1 3.12Å; E37-R314 IonicContact OE2-NH2 3.68Å; E37-R314 PolarHBondContact OE2-NH2 3.49Å; E37-R314 VanDerWaalsContact OE2-NH2 3.09Å; G310-R314 PolarHBondContact O-N 2.92Å; Q311-R314 WeakPolarHBondContact O-CB 3.41Å; Q311-R314 PolarHBondContact O-N 3.24Å; R314-L316 PolarHBondContact O-N 3.35Å; R314-G317 WeakPolarHBondContact O-CA 3.18Å; R314-G317 PolarHBondContact O-N 2.84Å; R314-A322 HydrophobicContact CB-CB 4.31Å; R314-M346 HydrophobicContact CG-CB 4.46Å; R314-M346 HydrophobicContact CG-CG 4.26Å; R314-H349 PolarHBondContact NH2-CD2 2.87Å; R314-H349 PolarHBondContact NH2-NE2 3.14Å
315	E	91.6	Very high	95.7	Very high	37 Å²	37	30.9 Å²	30.9	17%	0.173	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-24.8	178.2	-62.9	-50.5	138.7	0	0	112.4	F280 L285 Q311 A312 G317 P505 G506	F280-E315 HydrophobicContact CE2-CB 4.43Å; F280-E315 HydrophobicContact CE2-CG 3.89Å; F280-E315 HydrophobicContact CZ-CG 3.94Å; L285-E315 HydrophobicContact CD1-CB 3.57Å; L285-E315 HydrophobicContact CD2-CB 4.06Å; L285-E315 HydrophobicContact CG-CB 4.49Å; Q311-E315 PolarHBondContact O-N 2.94Å; A312-E315 PolarHBondContact O-N 3.18Å; E315-G317 PolarHBondContact O-N 3.05Å; E315-P505 CarbonylContact O-C 3.45Å; E315-G506 VanDerWaalsContact O-CA 3.29Å; E315-G506 WeakPolarHBondContact O-CA 3.17Å; E315-G506 PolarHBondContact O-N 2.8Å
316	L	91.6	Very high	95.8	Very high	50 Å²	50	30.9 Å²	30.9	26%	0.262	16%	0.156	S	C	.	.	H	α-helix	trans	-75.7	-11.5	171.1	-165.8	64.3	0	0	0	112.9	I289 A312 Y313 R314 P505	I289-L316 HydrophobicContact CD1-CD2 3.88Å; A312-L316 WeakPolarHBondContact O-CB 3.47Å; A312-L316 PolarHBondContact O-N 2.91Å; Y313-L316 HydrophobicContact CD1-CD2 4.34Å; Y313-L316 PolarHBondContact O-N 2.82Å; R314-L316 PolarHBondContact O-N 3.35Å; L316-P505 HydrophobicContact CD1-CB 4.33Å; L316-P505 HydrophobicContact CD1-CG 4.04Å
317	G	90.5	Very high	95.8	Very high	20 Å²	20	32.7 Å²	32.7	21%	0.206	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	9.5	-174.4	0	0	0	0	0	114.2	Y313 R314 E315 F319	Y313-G317 PolarHBondContact O-N 3.41Å; Y313-G317 VanDerWaalsContact O-N 3.13Å; R314-G317 WeakPolarHBondContact O-CA 3.18Å; R314-G317 PolarHBondContact O-N 2.84Å; E315-G317 PolarHBondContact O-N 3.05Å; G317-F319 PolarHBondContact O-N 2.96Å
318	N	93.2	Very high	95.8	Very high	60 Å²	60	35.6 Å²	35.6	32%	0.321	18%	0.178	S	C	.	.			trans	-90.9	90.5	178.6	-171.6	-26.7	0	0	0	110.3	Y313 A321 A322	Y313-N318 HydrophobicContact CD1-CB 4.21Å; Y313-N318 PolarHBondContact O-N 3.49Å; N318-A321 HydrophobicContact CB-CB 4.35Å; N318-A321 VanDerWaalsContact CG-CB 3.49Å; N318-A321 VanDerWaalsContact OD1-CB 3.3Å; N318-A321 WeakPolarHBondContact OD1-CB 3.47Å; N318-A321 PolarHBondContact OD1-N 2.92Å; N318-A322 VanDerWaalsContact O-CB 3.26Å; N318-A322 WeakPolarHBondContact O-CB 3.49Å; N318-A322 PolarHBondContact O-N 3.47Å; N318-A322 VanDerWaalsContact O-N 3.12Å
319	F	93.8	Very high	95.8	Very high	26 Å²	26	35.2 Å²	35.2	11%	0.114	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-40.5	-175.8	177.9	-103.6	0	0	0	112.8	G317 T323 M346 L347 H350 L508	G317-F319 PolarHBondContact O-N 2.96Å; F319-T323 WeakPolarHBondContact O-CB 3.27Å; F319-T323 PolarHBondContact O-N 3.44Å; F319-T323 PolarHBondContact O-OG1 2.86Å; F319-M346 HydrophobicContact CD2-CE 4.2Å; F319-M346 HydrophobicContact CD2-CG 4.06Å; F319-M346 HydrophobicContact CD2-SD 4.05Å; F319-M346 HydrophobicContact CE2-CE 3.75Å; F319-M346 HydrophobicContact CE2-CG 4.12Å; F319-M346 HydrophobicContact CE2-SD 4.18Å; F319-M346 HydrophobicContact CZ-CE 4.43Å; F319-L347 HydrophobicContact CE2-CD2 4.19Å; F319-L347 HydrophobicContact CZ-CD2 3.95Å; F319-H350 AromaticContact CD1-CE1 3.92Å; F319-H350 AromaticContact CD1-NE2 3.97Å; F319-H350 HydrophobicContact CD2-CB 3.97Å; F319-H350 AromaticContact CD2-CG 3.7Å; F319-H350 AromaticContact CD2-ND1 3.77Å; F319-H350 AromaticContact CE1-CD2 3.76Å; F319-H350 AromaticContact CE1-NE2 3.68Å; F319-H350 HydrophobicContact CE2-CB 3.57Å; F319-H350 AromaticContact CE2-CD2 3.61Å; F319-H350 AromaticContact CE2-CG 3.41Å; F319-H350 VanDerWaalsContact CE2-CG 3.41Å; F319-H350 AromaticContact CE2-ND1 3.96Å; F319-H350 AromaticContact CG-CE1 4Å; F319-H350 AromaticContact CG-ND1 3.92Å; F319-H350 HydrophobicContact CZ-CB 4.23Å; F319-H350 AromaticContact CZ-CD2 3.38Å; F319-H350 WeakPolarHBondContact CZ-CD2 3.28Å; F319-H350 AromaticContact CZ-CG 3.72Å; F319-H350 AromaticContact CZ-NE2 3.83Å; F319-L508 HydrophobicContact CB-CD1 3.9Å; F319-L508 HydrophobicContact CD2-CD1 4.17Å; F319-L508 HydrophobicContact CD2-CD2 4.24Å; F319-L508 HydrophobicContact CD2-CG 4.49Å
320	E	94.8	Very high	95.7	Very high	134 Å²	134	35.3 Å²	35.3	63%	0.626	18%	0.176	S	C	*	.	H	α-helix	trans	-66.2	-51.4	-177	-65.7	74.1	-162.8	0	0	110.9	A322 T323 E324	E320-A322 VanDerWaalsContact C-N 3.31Å; E320-A322 PolarHBondContact O-N 3.24Å; E320-T323 PolarHBondContact O-N 3.36Å; E320-E324 PolarHBondContact O-N 3.47Å
321	A	96.5	Very high	95.7	Very high	16 Å²	16	40.9 Å²	40.9	13%	0.132	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-34.7	179.2	0	0	0	0	0	112.2	Y313 N318 S325	Y313-A321 HydrophobicContact CD1-CB 3.79Å; Y313-A321 HydrophobicContact CD2-CB 3.69Å; Y313-A321 HydrophobicContact CE1-CB 4.05Å; Y313-A321 HydrophobicContact CE2-CB 3.93Å; Y313-A321 HydrophobicContact CG-CB 3.62Å; N318-A321 HydrophobicContact CB-CB 4.35Å; N318-A321 VanDerWaalsContact CG-CB 3.49Å; N318-A321 VanDerWaalsContact OD1-CB 3.3Å; N318-A321 WeakPolarHBondContact OD1-CB 3.47Å; N318-A321 PolarHBondContact OD1-N 2.92Å; A321-S325 WeakPolarHBondContact O-CB 3.5Å; A321-S325 PolarHBondContact O-N 3.48Å; A321-S325 PolarHBondContact O-OG 3.03Å
322	A	97.2	Very high	95.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-45.9	173.3	0	0	0	0	0	111.5	G310 R314 N318 E320 S325 F326 M346	G310-A322 VanDerWaalsContact O-CB 3.31Å; G310-A322 WeakPolarHBondContact O-CB 3.31Å; R314-A322 HydrophobicContact CB-CB 4.31Å; N318-A322 VanDerWaalsContact O-CB 3.26Å; N318-A322 WeakPolarHBondContact O-CB 3.49Å; N318-A322 PolarHBondContact O-N 3.47Å; N318-A322 VanDerWaalsContact O-N 3.12Å; E320-A322 VanDerWaalsContact C-N 3.31Å; E320-A322 PolarHBondContact O-N 3.24Å; A322-S325 PolarHBondContact O-N 3.16Å; A322-F326 HydrophobicContact CB-CE2 4.42Å; A322-F326 WeakPolarHBondContact O-CD2 3.3Å; A322-F326 WeakPolarHBondContact O-CG 3.23Å; A322-F326 PolarHBondContact O-N 2.97Å; A322-M346 HydrophobicContact CB-SD 3.49Å; A322-M346 WeakPolarHBondContact CB-SD 3.41Å
323	T	97.1	Very high	95.7	Very high	35 Å²	35	46.3 Å²	46.3	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-45.3	177.6	-60.5	0	0	0	0	111.7	F319 E320 S325 Q327 M346	F319-T323 WeakPolarHBondContact O-CB 3.27Å; F319-T323 PolarHBondContact O-N 3.44Å; F319-T323 PolarHBondContact O-OG1 2.86Å; E320-T323 PolarHBondContact O-N 3.36Å; T323-S325 PolarHBondContact O-N 2.73Å; T323-Q327 VanDerWaalsContact O-CB 3.26Å; T323-Q327 WeakPolarHBondContact O-CB 3.35Å; T323-Q327 PolarHBondContact O-N 3.22Å; T323-M346 VanDerWaalsContact OG1-CE 3.24Å; T323-M346 WeakPolarHBondContact OG1-CE 3.38Å
324	E	97.7	Very high	95.6	Very high	107 Å²	107	51.5 Å²	51.5	50%	0.5	26%	0.26	S	S	.	.	H	α-helix	trans	-59.9	-46.1	176.8	-171.7	-171.3	161	0	0	111.4	E320 Q327 K328	E320-E324 PolarHBondContact O-N 3.47Å; E324-Q327 PolarHBondContact O-N 3.19Å; E324-K328 WeakPolarHBondContact O-CG 3.48Å; E324-K328 PolarHBondContact O-N 3.17Å; E324-K328 WeakPolarHBondContact OE1-CE 3.37Å; E324-K328 IonicContact OE1-NZ 2.82Å; E324-K328 PolarHBondContact OE1-NZ 3.43Å
325	S	98.1	Very high	95.6	Very high	7 Å²	7	53.8 Å²	53.8	5%	0.049	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-45	-178.8	-57.7	0	0	0	0	111.9	G310 A321 A322 T323 Q327 K328 A329	G310-S325 VanDerWaalsContact CA-CB 3.49Å; A321-S325 WeakPolarHBondContact O-CB 3.5Å; A321-S325 PolarHBondContact O-N 3.48Å; A321-S325 PolarHBondContact O-OG 3.03Å; A322-S325 PolarHBondContact O-N 3.16Å; T323-S325 PolarHBondContact O-N 2.73Å; S325-Q327 VanDerWaalsContact C-N 3.32Å; S325-Q327 PolarHBondContact O-N 3.48Å; S325-K328 PolarHBondContact O-N 3.08Å; S325-A329 PolarHBondContact O-N 3.19Å
326	F	98.2	Very high	95.8	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-36.5	173.9	-68.6	-44.3	0	0	0	112.5	K307 G310 Q311 A322 A329 L330 T339 L342 R343 M346	K307-F326 WeakPolarHBondContact O-CE1 3.3Å; G310-F326 VanDerWaalsContact C-CZ 3.42Å; Q311-F326 HydrophobicContact CB-CZ 4.44Å; A322-F326 HydrophobicContact CB-CE2 4.42Å; A322-F326 WeakPolarHBondContact O-CD2 3.3Å; A322-F326 WeakPolarHBondContact O-CG 3.23Å; A322-F326 PolarHBondContact O-N 2.97Å; F326-A329 PolarHBondContact O-N 3.06Å; F326-L330 WeakPolarHBondContact O-CG 3.21Å; F326-L330 PolarHBondContact O-N 3.32Å; F326-T339 HydrophobicContact CB-CG2 4.06Å; F326-T339 HydrophobicContact CD1-CG2 3.89Å; F326-T339 HydrophobicContact CG-CG2 4.36Å; F326-L342 HydrophobicContact CE1-CB 3.92Å; F326-L342 HydrophobicContact CE1-CD1 4.34Å; F326-L342 HydrophobicContact CZ-CB 3.88Å; F326-R343 HydrophobicContact CB-CB 4.12Å; F326-R343 HydrophobicContact CB-CG 4.2Å; F326-R343 HydrophobicContact CD2-CB 4.03Å; F326-R343 HydrophobicContact CD2-CG 4.28Å; F326-R343 HydrophobicContact CG-CB 4.12Å; F326-M346 HydrophobicContact CD2-CE 4.07Å; F326-M346 HydrophobicContact CD2-SD 3.98Å; F326-M346 HydrophobicContact CE2-CB 4.42Å; F326-M346 HydrophobicContact CE2-CE 4.41Å; F326-M346 HydrophobicContact CE2-SD 3.8Å
327	Q	97.6	Very high	96	Very high	73 Å²	73	51.1 Å²	51.1	34%	0.341	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-43.3	175.6	-176.2	63.1	38.9	0	0	111.1	T323 E324 S325 L330 L331	T323-Q327 VanDerWaalsContact O-CB 3.26Å; T323-Q327 WeakPolarHBondContact O-CB 3.35Å; T323-Q327 PolarHBondContact O-N 3.22Å; E324-Q327 PolarHBondContact O-N 3.19Å; S325-Q327 VanDerWaalsContact C-N 3.32Å; S325-Q327 PolarHBondContact O-N 3.48Å; Q327-L330 CarbonylContact O-C 3.58Å; Q327-L330 PolarHBondContact O-N 2.96Å; Q327-L331 HydrophobicContact CG-CD1 4.42Å; Q327-L331 WeakPolarHBondContact O-CG 3.5Å; Q327-L331 PolarHBondContact O-N 3.14Å
328	K	97.6	Very high	96.2	Very high	78 Å²	78	52.4 Å²	52.4	34%	0.339	26%	0.262	S	S	.	.	H	α-helix	trans	-60.2	-44.9	175	-73.4	178.8	-175.5	169.3	0	112	Y306 E324 S325 L330 L331 L332	Y306-K328 HydrophobicContact CD1-CB 3.91Å; Y306-K328 HydrophobicContact CD1-CD 4.15Å; Y306-K328 HydrophobicContact CD2-CB 4.23Å; Y306-K328 HydrophobicContact CE1-CB 4Å; Y306-K328 HydrophobicContact CE1-CD 3.56Å; Y306-K328 HydrophobicContact CE1-CG 4.42Å; Y306-K328 HydrophobicContact CE2-CB 4.26Å; Y306-K328 HydrophobicContact CG-CB 4.06Å; E324-K328 WeakPolarHBondContact O-CG 3.48Å; E324-K328 PolarHBondContact O-N 3.17Å; E324-K328 WeakPolarHBondContact OE1-CE 3.37Å; E324-K328 IonicContact OE1-NZ 2.82Å; E324-K328 PolarHBondContact OE1-NZ 3.43Å; S325-K328 PolarHBondContact O-N 3.08Å; K328-L330 VanDerWaalsContact C-N 3.31Å; K328-L330 PolarHBondContact O-N 3.15Å; K328-L331 PolarHBondContact O-N 3.32Å; K328-L332 PolarHBondContact O-N 2.96Å
329	A	97.2	Very high	96.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-41.1	174	0	0	0	0	0	112.6	I303 S325 F326 L332 N333 T339	I303-A329 HydrophobicContact CG2-CB 4.29Å; S325-A329 PolarHBondContact O-N 3.19Å; F326-A329 PolarHBondContact O-N 3.06Å; A329-L332 PolarHBondContact O-N 3.45Å; A329-N333 PolarHBondContact O-N 3.02Å; A329-T339 HydrophobicContact CB-CG2 3.9Å
330	L	96.7	Very high	96.5	Very high	12 Å²	12	48.8 Å²	48.8	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-76.5	-21.9	178.3	-68.3	169.4	0	0	0	113.9	F326 Q327 K328 N333 Q334 T339 L340	F326-L330 WeakPolarHBondContact O-CG 3.21Å; F326-L330 PolarHBondContact O-N 3.32Å; Q327-L330 CarbonylContact O-C 3.58Å; Q327-L330 PolarHBondContact O-N 2.96Å; K328-L330 VanDerWaalsContact C-N 3.31Å; K328-L330 PolarHBondContact O-N 3.15Å; L330-N333 WeakPolarHBondContact CA-O 3.41Å; L330-N333 CarbonylContact O-C 3.57Å; L330-Q334 WeakPolarHBondContact O-CA 3.43Å; L330-Q334 VanDerWaalsContact O-CG 3.3Å; L330-Q334 WeakPolarHBondContact O-CG 3.27Å; L330-Q334 PolarHBondContact O-N 3.08Å; L330-Q334 VanDerWaalsContact O-N 3.08Å; L330-T339 HydrophobicContact CD1-CG2 4.08Å; L330-T339 HydrophobicContact CD2-CG2 3.88Å; L330-T339 HydrophobicContact CG-CG2 3.6Å; L330-L340 HydrophobicContact CD1-CD2 4.04Å; L330-L340 HydrophobicContact CD2-CD2 3.82Å; L330-L340 HydrophobicContact CD2-CG 3.82Å
331	L	97.3	Very high	96.5	Very high	117 Å²	117	42.8 Å²	42.8	61%	0.613	22%	0.216	S	C	*	.	H	α-helix	trans	-69.8	-38.7	170.8	-74.9	171.2	0	0	0	111	Q327 K328	Q327-L331 HydrophobicContact CG-CD1 4.42Å; Q327-L331 WeakPolarHBondContact O-CG 3.5Å; Q327-L331 PolarHBondContact O-N 3.14Å; K328-L331 PolarHBondContact O-N 3.32Å
332	L	96.3	Very high	96.5	Very high	80 Å²	80	42.5 Å²	42.5	42%	0.419	21%	0.212	S	C	.	.	H	α-helix	trans	-69.1	-41.7	174.4	-65.7	174.6	0	0	0	111.9	D301 I303 Y306 K328 A329	D301-L332 HydrophobicContact CB-CD2 4.19Å; I303-L332 HydrophobicContact CD1-CB 4.17Å; I303-L332 HydrophobicContact CG1-CB 3.67Å; I303-L332 HydrophobicContact CG1-CD1 3.89Å; I303-L332 HydrophobicContact CG1-CG 4.46Å; Y306-L332 HydrophobicContact CD2-CD1 3.74Å; Y306-L332 HydrophobicContact CE2-CD1 3.88Å; K328-L332 PolarHBondContact O-N 2.96Å; A329-L332 PolarHBondContact O-N 3.45Å
333	N	95.5	Very high	96.5	Very high	62 Å²	62	44.8 Å²	44.8	33%	0.332	22%	0.22	S	C	.	.			trans	-143.9	104.6	173.4	-178.4	-5.4	0	0	0	111.7	I303 A329 L330 N335 H336	I303-N333 HydrophobicContact CD1-CB 3.59Å; A329-N333 PolarHBondContact O-N 3.02Å; L330-N333 WeakPolarHBondContact CA-O 3.41Å; L330-N333 CarbonylContact O-C 3.57Å; N333-N335 PolarHBondContact O-N 3.47Å; N333-N335 VanDerWaalsContact O-N 3.17Å; N333-N335 WeakPolarHBondContact OD1-CA 3.34Å; N333-N335 PolarHBondContact OD1-N 3.26Å; N333-H336 HydrophobicContact CB-CB 4.16Å; N333-H336 WeakPolarHBondContact O-CB 3.28Å; N333-H336 PolarHBondContact O-N 3.24Å; N333-H336 PolarHBondContact OD1-N 3.42Å
334	Q	94.6	Very high	96.6	Very high	141 Å²	141	43.1 Å²	43.1	66%	0.659	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.1	-178.5	-62.7	-179.6	19.2	0	0	113.6	L330	L330-Q334 WeakPolarHBondContact O-CA 3.43Å; L330-Q334 VanDerWaalsContact O-CG 3.3Å; L330-Q334 WeakPolarHBondContact O-CG 3.27Å; L330-Q334 PolarHBondContact O-N 3.08Å; L330-Q334 VanDerWaalsContact O-N 3.08Å
335	N	95.4	Very high	96.5	Very high	74 Å²	74	38.5 Å²	38.5	40%	0.396	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	14.8	-178.6	-63.8	-22.2	0	0	0	112.5	N333 V337 R362 L366	N333-N335 PolarHBondContact O-N 3.47Å; N333-N335 VanDerWaalsContact O-N 3.17Å; N333-N335 WeakPolarHBondContact OD1-CA 3.34Å; N333-N335 PolarHBondContact OD1-N 3.26Å; N335-V337 PolarHBondContact O-N 3.02Å; N335-R362 PolarHBondContact OD1-NH2 2.64Å; N335-L366 HydrophobicContact CB-CD1 3.95Å; N335-L366 HydrophobicContact CB-CD2 3.98Å; N335-L366 WeakPolarHBondContact O-CD1 3.34Å
336	H	95.6	Very high	96.4	Very high	20 Å²	20	38.2 Å²	38.2	9%	0.093	19%	0.186	C	C	.	.			trans	-72.9	98.4	177.6	-165.5	-103.4	0	0	0	111.5	N333 Q338 T339 L340	N333-H336 HydrophobicContact CB-CB 4.16Å; N333-H336 WeakPolarHBondContact O-CB 3.28Å; N333-H336 PolarHBondContact O-N 3.24Å; N333-H336 PolarHBondContact OD1-N 3.42Å; H336-Q338 PolarHBondContact CE1-OE1 2.96Å; H336-Q338 PolarHBondContact NE2-OE1 3.47Å; H336-Q338 PolarHBondContact O-N 3.37Å; H336-T339 PolarHBondContact ND1-N 3.46Å; H336-T339 PolarHBondContact ND1-OG1 2.9Å; H336-T339 PolarHBondContact O-N 2.9Å; H336-L340 PolarHBondContact O-N 2.89Å; H336-L340 VanDerWaalsContact O-N 3.16Å
337	V	94.8	Very high	96.4	Very high	11 Å²	11	38.4 Å²	38.4	7%	0.067	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-44.2	-169.8	-179.1	0	0	0	0	112.6	N335 T339 L340 Q341 C363 L366 E367	N335-V337 PolarHBondContact O-N 3.02Å; V337-T339 VanDerWaalsContact C-N 3.28Å; V337-T339 PolarHBondContact O-N 3.33Å; V337-L340 WeakPolarHBondContact O-CB 3.47Å; V337-L340 PolarHBondContact O-N 3.19Å; V337-Q341 WeakPolarHBondContact O-CB 3.47Å; V337-Q341 PolarHBondContact O-N 3.33Å; V337-C363 HydrophobicContact CG1-CB 4.48Å; V337-C363 VanDerWaalsContact CG1-SG 3.54Å; V337-L366 HydrophobicContact CG2-CB 3.78Å; V337-L366 HydrophobicContact CG2-CD1 3.91Å; V337-E367 HydrophobicContact CG1-CG 4.33Å; V337-E367 HydrophobicContact CG2-CG 4.09Å
338	Q	94.1	Very high	96.3	Very high	48 Å²	48	35.3 Å²	35.3	22%	0.224	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-37.2	-178.4	-61.4	82.1	-5.8	0	0	111.3	K307 H336 Q341 L342	K307-Q338 HydrophobicContact CD-CB 4.19Å; H336-Q338 PolarHBondContact CE1-OE1 2.96Å; H336-Q338 PolarHBondContact NE2-OE1 3.47Å; H336-Q338 PolarHBondContact O-N 3.37Å; Q338-Q341 PolarHBondContact O-N 3.2Å; Q338-L342 WeakPolarHBondContact O-CB 3.16Å; Q338-L342 VanDerWaalsContact O-CG 3.31Å; Q338-L342 WeakPolarHBondContact O-CG 3.47Å; Q338-L342 PolarHBondContact O-N 3.48Å
339	T	95.9	Very high	96.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-70	-41.3	176.8	-60.2	0	0	0	0	111.4	F326 A329 L330 H336 V337 Q341 L342 R343	F326-T339 HydrophobicContact CB-CG2 4.06Å; F326-T339 HydrophobicContact CD1-CG2 3.89Å; F326-T339 HydrophobicContact CG-CG2 4.36Å; A329-T339 HydrophobicContact CB-CG2 3.9Å; L330-T339 HydrophobicContact CD1-CG2 4.08Å; L330-T339 HydrophobicContact CD2-CG2 3.88Å; L330-T339 HydrophobicContact CG-CG2 3.6Å; H336-T339 PolarHBondContact ND1-N 3.46Å; H336-T339 PolarHBondContact ND1-OG1 2.9Å; H336-T339 PolarHBondContact O-N 2.9Å; V337-T339 VanDerWaalsContact C-N 3.28Å; V337-T339 PolarHBondContact O-N 3.33Å; T339-Q341 VanDerWaalsContact C-N 3.31Å; T339-Q341 PolarHBondContact O-N 3.38Å; T339-L342 PolarHBondContact O-N 2.88Å; T339-R343 WeakPolarHBondContact O-CB 3.49Å; T339-R343 PolarHBondContact O-N 3.34Å
340	L	97.3	Very high	95.9	Very high	10 Å²	10	34 Å²	34	5%	0.052	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-44.3	174.2	-69.5	167.4	0	0	0	111.1	L330 H336 V337 G344 N359 R362 C363 L366	L330-L340 HydrophobicContact CD1-CD2 4.04Å; L330-L340 HydrophobicContact CD2-CD2 3.82Å; L330-L340 HydrophobicContact CD2-CG 3.82Å; H336-L340 PolarHBondContact O-N 2.89Å; H336-L340 VanDerWaalsContact O-N 3.16Å; V337-L340 WeakPolarHBondContact O-CB 3.47Å; V337-L340 PolarHBondContact O-N 3.19Å; L340-G344 PolarHBondContact O-N 3.16Å; L340-N359 WeakPolarHBondContact O-CB 3.48Å; L340-R362 HydrophobicContact CD1-CB 4.19Å; L340-R362 HydrophobicContact CD1-CG 3.59Å; L340-R362 HydrophobicContact CD2-CB 4.43Å; L340-R362 HydrophobicContact CD2-CG 4.17Å; L340-C363 HydrophobicContact CB-CB 4.47Å; L340-L366 HydrophobicContact CD1-CD1 3.73Å
341	Q	96.5	Very high	95.7	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-54	177.7	-175.6	-177.2	-20.8	0	0	111.5	Y39 V337 Q338 T339 R343 G344 M345 V372	Y39-Q341 PolarHBondContact OH-NE2 3.24Å; Y39-Q341 PolarHBondContact OH-OE1 3.4Å; V337-Q341 WeakPolarHBondContact O-CB 3.47Å; V337-Q341 PolarHBondContact O-N 3.33Å; Q338-Q341 PolarHBondContact O-N 3.2Å; T339-Q341 VanDerWaalsContact C-N 3.31Å; T339-Q341 PolarHBondContact O-N 3.38Å; Q341-R343 PolarHBondContact O-N 3.3Å; Q341-G344 PolarHBondContact O-N 3.48Å; Q341-M345 HydrophobicContact CG-SD 4.35Å; Q341-M345 WeakPolarHBondContact O-CG 3.34Å; Q341-M345 PolarHBondContact O-N 2.84Å; Q341-V372 HydrophobicContact CG-CG1 4.4Å
342	L	96.4	Very high	95.5	Very high	9 Å²	9	30 Å²	30	5%	0.047	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-42.9	-178.1	-72.6	172.2	0	0	0	112.4	Y39 K307 F326 Q338 T339 M345 M346	Y39-L342 HydrophobicContact CE2-CD2 4.18Å; K307-L342 HydrophobicContact CD-CD1 4.17Å; K307-L342 HydrophobicContact CG-CD1 3.77Å; F326-L342 HydrophobicContact CE1-CB 3.92Å; F326-L342 HydrophobicContact CE1-CD1 4.34Å; F326-L342 HydrophobicContact CZ-CB 3.88Å; Q338-L342 WeakPolarHBondContact O-CB 3.16Å; Q338-L342 VanDerWaalsContact O-CG 3.31Å; Q338-L342 WeakPolarHBondContact O-CG 3.47Å; Q338-L342 PolarHBondContact O-N 3.48Å; T339-L342 PolarHBondContact O-N 2.88Å; L342-M345 PolarHBondContact O-N 2.98Å; L342-M346 PolarHBondContact O-N 2.69Å
343	R	97.6	Very high	95.4	Very high	48 Å²	48	26.7 Å²	26.7	18%	0.181	14%	0.137	C	C	.	.	H	α-helix	trans	-63.3	-42.2	174.6	-174.2	-176.8	175.9	177.9	6.5	111.3	F326 T339 Q341 M346 L347	F326-R343 HydrophobicContact CB-CB 4.12Å; F326-R343 HydrophobicContact CB-CG 4.2Å; F326-R343 HydrophobicContact CD2-CB 4.03Å; F326-R343 HydrophobicContact CD2-CG 4.28Å; F326-R343 HydrophobicContact CG-CB 4.12Å; T339-R343 WeakPolarHBondContact O-CB 3.49Å; T339-R343 PolarHBondContact O-N 3.34Å; Q341-R343 PolarHBondContact O-N 3.3Å; R343-M346 HydrophobicContact CG-CE 4.25Å; R343-M346 PolarHBondContact O-N 3.31Å; R343-L347 HydrophobicContact CG-CD1 4.02Å; R343-L347 WeakPolarHBondContact O-CB 3.49Å; R343-L347 VanDerWaalsContact O-CG 3.25Å; R343-L347 WeakPolarHBondContact O-CG 3.41Å; R343-L347 PolarHBondContact O-N 2.98Å
344	G	97.5	Very high	95.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-44.9	175.2	0	0	0	0	0	112.5	L340 Q341 L347 Y348 A356 F360	L340-G344 PolarHBondContact O-N 3.16Å; Q341-G344 PolarHBondContact O-N 3.48Å; G344-L347 PolarHBondContact O-N 2.87Å; G344-Y348 PolarHBondContact O-N 3.47Å; G344-A356 WeakPolarHBondContact O-CB 3.29Å; G344-F360 WeakPolarHBondContact O-CZ 3.27Å
345	M	96.1	Very high	95.4	Very high	11 Å²	11	26.4 Å²	26.4	5%	0.054	13%	0.133	C	C	.	.	H	α-helix	trans	-63.3	-45.8	176	-69.7	176.2	68.4	0	0	111.8	E37 Q341 L342 L347 Y348 H349 F360 V372 M376	E37-M345 VanDerWaalsContact CD-CE 3.46Å; E37-M345 VanDerWaalsContact OE1-CE 3.29Å; E37-M345 WeakPolarHBondContact OE1-CE 3.49Å; E37-M345 WeakPolarHBondContact OE2-CE 3.45Å; Q341-M345 HydrophobicContact CG-SD 4.35Å; Q341-M345 WeakPolarHBondContact O-CG 3.34Å; Q341-M345 PolarHBondContact O-N 2.84Å; L342-M345 PolarHBondContact O-N 2.98Å; M345-L347 VanDerWaalsContact C-N 3.32Å; M345-L347 PolarHBondContact O-N 2.92Å; M345-Y348 WeakPolarHBondContact O-CB 3.31Å; M345-Y348 PolarHBondContact O-N 3.48Å; M345-H349 PolarHBondContact O-CD2 2.79Å; M345-H349 PolarHBondContact O-N 3.41Å; M345-F360 HydrophobicContact CG-CE1 4.25Å; M345-F360 HydrophobicContact CG-CZ 4.23Å; M345-V372 HydrophobicContact SD-CG1 4.37Å; M345-M376 HydrophobicContact CG-CE 4.17Å; M345-M376 HydrophobicContact CG-CG 4.24Å
346	M	96.4	Very high	95.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-56.3	-46.7	174.5	178.8	-166.9	72.4	0	0	111.5	R314 F319 A322 T323 F326 L342 R343 Y348 H349 H350 L508	R314-M346 HydrophobicContact CG-CB 4.46Å; R314-M346 HydrophobicContact CG-CG 4.26Å; F319-M346 HydrophobicContact CD2-CE 4.2Å; F319-M346 HydrophobicContact CD2-CG 4.06Å; F319-M346 HydrophobicContact CD2-SD 4.05Å; F319-M346 HydrophobicContact CE2-CE 3.75Å; F319-M346 HydrophobicContact CE2-CG 4.12Å; F319-M346 HydrophobicContact CE2-SD 4.18Å; F319-M346 HydrophobicContact CZ-CE 4.43Å; A322-M346 HydrophobicContact CB-SD 3.49Å; A322-M346 WeakPolarHBondContact CB-SD 3.41Å; T323-M346 VanDerWaalsContact OG1-CE 3.24Å; T323-M346 WeakPolarHBondContact OG1-CE 3.38Å; F326-M346 HydrophobicContact CD2-CE 4.07Å; F326-M346 HydrophobicContact CD2-SD 3.98Å; F326-M346 HydrophobicContact CE2-CB 4.42Å; F326-M346 HydrophobicContact CE2-CE 4.41Å; F326-M346 HydrophobicContact CE2-SD 3.8Å; L342-M346 PolarHBondContact O-N 2.69Å; R343-M346 HydrophobicContact CG-CE 4.25Å; R343-M346 PolarHBondContact O-N 3.31Å; M346-Y348 PolarHBondContact O-N 2.51Å; M346-H349 PolarHBondContact O-N 3.38Å; M346-H350 WeakPolarHBondContact O-CB 3.29Å; M346-H350 PolarHBondContact O-N 3.48Å; M346-L508 HydrophobicContact CG-CD2 3.88Å; M346-L508 WeakPolarHBondContact O-CD2 3.11Å
347	L	97.1	Very high	95.6	Very high	4 Å²	4	22 Å²	22	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-63.9	-38.8	178.4	-71.3	166.1	0	0	0	112.3	F319 R343 G344 M345 H350 G351 S352 E355 A356 N359	F319-L347 HydrophobicContact CE2-CD2 4.19Å; F319-L347 HydrophobicContact CZ-CD2 3.95Å; R343-L347 HydrophobicContact CG-CD1 4.02Å; R343-L347 WeakPolarHBondContact O-CB 3.49Å; R343-L347 VanDerWaalsContact O-CG 3.25Å; R343-L347 WeakPolarHBondContact O-CG 3.41Å; R343-L347 PolarHBondContact O-N 2.98Å; G344-L347 PolarHBondContact O-N 2.87Å; M345-L347 VanDerWaalsContact C-N 3.32Å; M345-L347 PolarHBondContact O-N 2.92Å; L347-H350 PolarHBondContact O-N 2.89Å; L347-G351 PolarHBondContact O-N 3.28Å; L347-G351 VanDerWaalsContact O-N 3.17Å; L347-S352 PolarHBondContact O-N 3.37Å; L347-E355 HydrophobicContact CD1-CB 3.89Å; L347-E355 HydrophobicContact CD2-CB 4.32Å; L347-E355 WeakPolarHBondContact CD2-OE2 3.4Å; L347-A356 HydrophobicContact CB-CB 3.92Å; L347-N359 WeakPolarHBondContact CD1-ND2 3.47Å
348	Y	96.1	Very high	95.7	Very high	8 Å²	8	28.5 Å²	28.5	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-51.1	172.9	175.1	-91	0	0	0	110.8	G344 M345 M346 H350 G351 L353 M376 L379 S380 A383 D563	G344-Y348 PolarHBondContact O-N 3.47Å; M345-Y348 WeakPolarHBondContact O-CB 3.31Å; M345-Y348 PolarHBondContact O-N 3.48Å; M346-Y348 PolarHBondContact O-N 2.51Å; Y348-H350 PolarHBondContact O-N 3.2Å; Y348-G351 PolarHBondContact O-N 2.71Å; Y348-L353 HydrophobicContact CD2-CD2 3.35Å; Y348-L353 HydrophobicContact CE2-CD2 3.59Å; Y348-L353 HydrophobicContact CG-CD2 4.24Å; Y348-M376 HydrophobicContact CD1-CE 3.67Å; Y348-M376 HydrophobicContact CD2-CE 4.34Å; Y348-M376 HydrophobicContact CE1-CE 4.3Å; Y348-M376 HydrophobicContact CG-CE 3.72Å; Y348-L379 HydrophobicContact CE1-CD2 3.89Å; Y348-L379 HydrophobicContact CE1-CG 4.49Å; Y348-L379 HydrophobicContact CE2-CD2 4.03Å; Y348-L379 HydrophobicContact CE2-CG 3.82Å; Y348-L379 WeakPolarHBondContact OH-CG 3.17Å; Y348-S380 WeakPolarHBondContact CD2-OG 3.41Å; Y348-A383 HydrophobicContact CE2-CB 4.29Å; Y348-D563 PolarHBondContact OH-OD1 2.85Å
349	H	93.6	Very high	95.9	Very high	40 Å²	40	27 Å²	27	19%	0.185	13%	0.131	C	C	.	.	H	α-helix	trans	-69	-19.7	179	-65.2	-60.7	0	0	0	113.8	R314 M345 M346 G351 L508 N510	R314-H349 PolarHBondContact NH2-CD2 2.87Å; R314-H349 PolarHBondContact NH2-NE2 3.14Å; M345-H349 PolarHBondContact O-CD2 2.79Å; M345-H349 PolarHBondContact O-N 3.41Å; M346-H349 PolarHBondContact O-N 3.38Å; H349-G351 VanDerWaalsContact C-N 3.31Å; H349-L508 HydrophobicContact CB-CD2 4.16Å; H349-N510 WeakPolarHBondContact O-CB 3.44Å; H349-N510 PolarHBondContact O-ND2 3.45Å
350	H	93.6	Very high	96	Very high	12 Å²	12	27 Å²	27	6%	0.056	13%	0.131	C	C	.	.	H	α-helix	trans	-78.8	-16.1	170.4	-170.7	60.6	0	0	0	112.9	F319 M346 L347 Y348 L508 P509 N510 K511	F319-H350 AromaticContact CD1-CE1 3.92Å; F319-H350 AromaticContact CD1-NE2 3.97Å; F319-H350 HydrophobicContact CD2-CB 3.97Å; F319-H350 AromaticContact CD2-CG 3.7Å; F319-H350 AromaticContact CD2-ND1 3.77Å; F319-H350 AromaticContact CE1-CD2 3.76Å; F319-H350 AromaticContact CE1-NE2 3.68Å; F319-H350 HydrophobicContact CE2-CB 3.57Å; F319-H350 AromaticContact CE2-CD2 3.61Å; F319-H350 AromaticContact CE2-CG 3.41Å; F319-H350 VanDerWaalsContact CE2-CG 3.41Å; F319-H350 AromaticContact CE2-ND1 3.96Å; F319-H350 AromaticContact CG-CE1 4Å; F319-H350 AromaticContact CG-ND1 3.92Å; F319-H350 HydrophobicContact CZ-CB 4.23Å; F319-H350 AromaticContact CZ-CD2 3.38Å; F319-H350 WeakPolarHBondContact CZ-CD2 3.28Å; F319-H350 AromaticContact CZ-CG 3.72Å; F319-H350 AromaticContact CZ-NE2 3.83Å; M346-H350 WeakPolarHBondContact O-CB 3.29Å; M346-H350 PolarHBondContact O-N 3.48Å; L347-H350 PolarHBondContact O-N 2.89Å; Y348-H350 PolarHBondContact O-N 3.2Å; H350-L508 HydrophobicContact CB-CD2 4.04Å; H350-P509 WeakPolarHBondContact CA-O 3.26Å; H350-P509 PolarHBondContact ND1-O 3.02Å; H350-N510 WeakPolarHBondContact O-CA 3.31Å; H350-K511 VanDerWaalsContact NE2-CE 3.31Å; H350-K511 WeakPolarHBondContact NE2-CE 3.39Å; H350-K511 PolarHBondContact O-N 2.93Å
351	G	92.3	Very high	96	Very high	20 Å²	20	31.2 Å²	31.2	21%	0.206	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	1.8	-175.1	0	0	0	0	0	114.4	L347 Y348 H349 L353	L347-G351 PolarHBondContact O-N 3.28Å; L347-G351 VanDerWaalsContact O-N 3.17Å; Y348-G351 PolarHBondContact O-N 2.71Å; H349-G351 VanDerWaalsContact C-N 3.31Å; G351-L353 VanDerWaalsContact C-N 3.25Å; G351-L353 PolarHBondContact O-N 2.95Å
352	S	93.5	Very high	96	Very high	24 Å²	24	35.1 Å²	35.1	17%	0.168	16%	0.163	C	C	.	.			trans	-81.5	62.1	176.8	-66.1	0	0	0	0	111.8	L347 Q354 E355 A356	L347-S352 PolarHBondContact O-N 3.37Å; S352-Q354 VanDerWaalsContact C-N 3.34Å; S352-Q354 PolarHBondContact O-N 3.22Å; S352-E355 PolarHBondContact O-N 3Å; S352-A356 PolarHBondContact O-N 3.13Å
353	L	94.4	Very high	96	Very high	11 Å²	11	34.7 Å²	34.7	6%	0.058	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-38	-170.6	-60	179.9	0	0	0	114	Y348 G351 A356 L357 A383 M384	Y348-L353 HydrophobicContact CD2-CD2 3.35Å; Y348-L353 HydrophobicContact CE2-CD2 3.59Å; Y348-L353 HydrophobicContact CG-CD2 4.24Å; G351-L353 VanDerWaalsContact C-N 3.25Å; G351-L353 PolarHBondContact O-N 2.95Å; L353-A356 WeakPolarHBondContact O-CB 3.41Å; L353-A356 PolarHBondContact O-N 2.88Å; L353-L357 PolarHBondContact O-N 3.07Å; L353-A383 HydrophobicContact CD1-CB 3.7Å; L353-A383 HydrophobicContact CD2-CB 4.35Å; L353-M384 HydrophobicContact CB-CG 3.92Å; L353-M384 HydrophobicContact CB-SD 3.9Å; L353-M384 HydrophobicContact CD1-CG 3.56Å; L353-M384 HydrophobicContact CG-CG 4.4Å
354	Q	93.7	Very high	96	Very high	97 Å²	97	33.4 Å²	33.4	45%	0.453	16%	0.158	S	C	.	.	H	α-helix	trans	-67	-40.3	178.9	-70.6	-68.4	-11.6	0	0	112.3	S352 L357 K358 M384	S352-Q354 VanDerWaalsContact C-N 3.34Å; S352-Q354 PolarHBondContact O-N 3.22Å; Q354-L357 PolarHBondContact O-N 3.43Å; Q354-K358 WeakPolarHBondContact O-CG 3.43Å; Q354-K358 PolarHBondContact O-N 2.82Å; Q354-M384 HydrophobicContact CG-SD 4.16Å; Q354-M384 PolarHBondContact NE2-SD 3.47Å
355	E	95.1	Very high	96	Very high	99 Å²	99	39.5 Å²	39.5	46%	0.463	19%	0.186	S	C	.	.	H	α-helix	trans	-71.9	-37.3	176.8	-59.8	-174.2	154.1	0	0	111.3	L347 S352 L357 K358 N359	L347-E355 HydrophobicContact CD1-CB 3.89Å; L347-E355 HydrophobicContact CD2-CB 4.32Å; L347-E355 WeakPolarHBondContact CD2-OE2 3.4Å; S352-E355 PolarHBondContact O-N 3Å; E355-L357 VanDerWaalsContact C-N 3.34Å; E355-L357 PolarHBondContact O-N 3.14Å; E355-K358 PolarHBondContact O-N 2.98Å; E355-N359 PolarHBondContact O-N 2.83Å; E355-N359 PolarHBondContact O-ND2 3.14Å
356	A	97.3	Very high	96	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.2	-47.7	171.5	0	0	0	0	0	111	G344 L347 S352 L353 K358 N359 F360	G344-A356 WeakPolarHBondContact O-CB 3.29Å; L347-A356 HydrophobicContact CB-CB 3.92Å; S352-A356 PolarHBondContact O-N 3.13Å; L353-A356 WeakPolarHBondContact O-CB 3.41Å; L353-A356 PolarHBondContact O-N 2.88Å; A356-K358 VanDerWaalsContact C-N 3.33Å; A356-K358 PolarHBondContact O-N 3.24Å; A356-N359 WeakPolarHBondContact O-CB 3.44Å; A356-N359 PolarHBondContact O-N 2.84Å; A356-N359 VanDerWaalsContact O-N 3.12Å; A356-F360 HydrophobicContact CB-CD2 4.41Å; A356-F360 HydrophobicContact CB-CE2 3.88Å; A356-F360 WeakPolarHBondContact O-CD2 3.45Å; A356-F360 WeakPolarHBondContact O-CG 3.48Å; A356-F360 PolarHBondContact O-N 3.41Å
357	L	97.4	Very high	95.9	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-37.9	176.1	-85	-170.3	0	0	0	113.8	L353 Q354 E355 N359 F360 K361 K377 M384	L353-L357 PolarHBondContact O-N 3.07Å; Q354-L357 PolarHBondContact O-N 3.43Å; E355-L357 VanDerWaalsContact C-N 3.34Å; E355-L357 PolarHBondContact O-N 3.14Å; L357-N359 VanDerWaalsContact C-N 3.3Å; L357-N359 PolarHBondContact O-N 2.97Å; L357-F360 PolarHBondContact O-N 2.69Å; L357-K361 VanDerWaalsContact O-CB 3.3Å; L357-K361 WeakPolarHBondContact O-CB 3.45Å; L357-K361 VanDerWaalsContact O-CG 3.23Å; L357-K361 WeakPolarHBondContact O-CG 3.36Å; L357-K361 PolarHBondContact O-N 2.9Å; L357-K377 HydrophobicContact CD2-CB 4.36Å; L357-K377 HydrophobicContact CD2-CG 3.86Å; L357-M384 HydrophobicContact CD1-CE 3.14Å; L357-M384 HydrophobicContact CG-CE 4.02Å
358	K	97.4	Very high	95.6	Very high	147 Å²	147	49.1 Å²	49.1	64%	0.639	24%	0.24	S	C	*	.	H	α-helix	trans	-59.6	-44.3	175.6	-70.8	174.9	-175.4	175.7	0	110.6	Q354 E355 A356 R362	Q354-K358 WeakPolarHBondContact O-CG 3.43Å; Q354-K358 PolarHBondContact O-N 2.82Å; E355-K358 PolarHBondContact O-N 2.98Å; A356-K358 VanDerWaalsContact C-N 3.33Å; A356-K358 PolarHBondContact O-N 3.24Å; K358-R362 PolarHBondContact O-N 3.49Å
359	N	97.9	Very high	95.2	Very high	16 Å²	16	57.8 Å²	57.8	9%	0.086	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-46.3	177.6	-74.7	-88	0	0	0	111.9	L340 L347 E355 A356 L357 K361 R362 C363	L340-N359 WeakPolarHBondContact O-CB 3.48Å; L347-N359 WeakPolarHBondContact CD1-ND2 3.47Å; E355-N359 PolarHBondContact O-N 2.83Å; E355-N359 PolarHBondContact O-ND2 3.14Å; A356-N359 WeakPolarHBondContact O-CB 3.44Å; A356-N359 PolarHBondContact O-N 2.84Å; A356-N359 VanDerWaalsContact O-N 3.12Å; L357-N359 VanDerWaalsContact C-N 3.3Å; L357-N359 PolarHBondContact O-N 2.97Å; N359-K361 PolarHBondContact O-N 3.03Å; N359-R362 PolarHBondContact O-N 2.95Å; N359-C363 WeakPolarHBondContact O-CB 3.44Å; N359-C363 PolarHBondContact O-N 3.29Å
360	F	98.1	Very high	95.1	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-37.8	178.3	-59.8	-47	0	0	0	112.8	G344 M345 A356 L357 R362 C363 L364 C373 M376 K377	G344-F360 WeakPolarHBondContact O-CZ 3.27Å; M345-F360 HydrophobicContact CG-CE1 4.25Å; M345-F360 HydrophobicContact CG-CZ 4.23Å; A356-F360 HydrophobicContact CB-CD2 4.41Å; A356-F360 HydrophobicContact CB-CE2 3.88Å; A356-F360 WeakPolarHBondContact O-CD2 3.45Å; A356-F360 WeakPolarHBondContact O-CG 3.48Å; A356-F360 PolarHBondContact O-N 3.41Å; L357-F360 PolarHBondContact O-N 2.69Å; F360-R362 VanDerWaalsContact C-N 3.32Å; F360-R362 PolarHBondContact O-N 3.36Å; F360-C363 WeakPolarHBondContact O-CB 3.25Å; F360-C363 PolarHBondContact O-N 3.01Å; F360-L364 WeakPolarHBondContact O-CB 2.94Å; F360-L364 WeakPolarHBondContact O-CD1 3.43Å; F360-L364 VanDerWaalsContact O-CG 3.24Å; F360-L364 WeakPolarHBondContact O-CG 3.4Å; F360-L364 PolarHBondContact O-N 3.16Å; F360-C373 HydrophobicContact CD1-CB 4.33Å; F360-M376 HydrophobicContact CD1-CB 4.06Å; F360-M376 HydrophobicContact CD2-CB 3.98Å; F360-M376 HydrophobicContact CE1-CB 3.61Å; F360-M376 HydrophobicContact CE1-CG 4.16Å; F360-M376 HydrophobicContact CE2-CB 3.51Å; F360-M376 HydrophobicContact CG-CB 4.25Å; F360-M376 HydrophobicContact CZ-CB 3.31Å; F360-M376 HydrophobicContact CZ-CE 4.14Å; F360-M376 HydrophobicContact CZ-CG 3.96Å; F360-K377 HydrophobicContact CB-CB 4.09Å
361	K	97.6	Very high	95.1	Very high	99 Å²	99	58.4 Å²	58.4	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-41.9	172.5	-75.3	174.4	-178.6	179.2	0	111.2	L357 N359 L364 Q365	L357-K361 VanDerWaalsContact O-CB 3.3Å; L357-K361 WeakPolarHBondContact O-CB 3.45Å; L357-K361 VanDerWaalsContact O-CG 3.23Å; L357-K361 WeakPolarHBondContact O-CG 3.36Å; L357-K361 PolarHBondContact O-N 2.9Å; N359-K361 PolarHBondContact O-N 3.03Å; K361-L364 PolarHBondContact O-N 3.07Å; K361-Q365 VanDerWaalsContact O-CG 3.32Å; K361-Q365 WeakPolarHBondContact O-CG 3.44Å; K361-Q365 PolarHBondContact O-N 3.46Å
362	R	97.3	Very high	95.1	Very high	91 Å²	91	58.5 Å²	58.5	34%	0.343	27%	0.274	S	S	.	.	H	α-helix	trans	-66.4	-43.4	176.1	-175.3	58.1	177.6	172.9	-0.6	111.9	N335 L340 K358 N359 F360 L364 Q365 L366	N335-R362 PolarHBondContact OD1-NH2 2.64Å; L340-R362 HydrophobicContact CD1-CB 4.19Å; L340-R362 HydrophobicContact CD1-CG 3.59Å; L340-R362 HydrophobicContact CD2-CB 4.43Å; L340-R362 HydrophobicContact CD2-CG 4.17Å; K358-R362 PolarHBondContact O-N 3.49Å; N359-R362 PolarHBondContact O-N 2.95Å; F360-R362 VanDerWaalsContact C-N 3.32Å; F360-R362 PolarHBondContact O-N 3.36Å; R362-L364 VanDerWaalsContact C-N 3.31Å; R362-L364 PolarHBondContact O-N 3.19Å; R362-Q365 VanDerWaalsContact CD-OE1 3.28Å; R362-Q365 WeakPolarHBondContact O-CB 3.24Å; R362-Q365 PolarHBondContact O-N 3.22Å; R362-Q365 VanDerWaalsContact O-N 3.17Å; R362-L366 WeakPolarHBondContact O-CG 3.3Å; R362-L366 PolarHBondContact O-N 2.99Å
363	C	97.1	Very high	95.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-53.3	-48.7	172.9	174.1	0	0	0	0	111.3	V337 L340 N359 F360 Q365 L366 E367 C373	V337-C363 HydrophobicContact CG1-CB 4.48Å; V337-C363 VanDerWaalsContact CG1-SG 3.54Å; L340-C363 HydrophobicContact CB-CB 4.47Å; N359-C363 WeakPolarHBondContact O-CB 3.44Å; N359-C363 PolarHBondContact O-N 3.29Å; F360-C363 WeakPolarHBondContact O-CB 3.25Å; F360-C363 PolarHBondContact O-N 3.01Å; C363-Q365 VanDerWaalsContact C-N 3.31Å; C363-Q365 PolarHBondContact O-N 3.38Å; C363-L366 PolarHBondContact O-N 3.5Å; C363-L366 VanDerWaalsContact O-N 3.12Å; C363-E367 PolarHBondContact O-N 3.38Å; C363-C373 HydrophobicContact CB-CB 3.78Å; C363-C373 WeakPolarHBondContact CB-SG 3.19Å; C363-C373 WeakPolarHBondContact SG-CB 3.39Å; C363-C373 CovalentContact SG-SG 2.03Å; C363-C373 PolarHBondContact SG-SG 3.47Å
364	L	96.1	Very high	95.3	Very high	21 Å²	21	57.5 Å²	57.5	11%	0.11	27%	0.266	C	S	.	.	H	α-helix	trans	-73.9	-17.2	-179.2	-66.2	164.3	0	0	0	114.5	F360 K361 R362 L366 P368 N370 C373 Q374 K377	F360-L364 WeakPolarHBondContact O-CB 2.94Å; F360-L364 WeakPolarHBondContact O-CD1 3.43Å; F360-L364 VanDerWaalsContact O-CG 3.24Å; F360-L364 WeakPolarHBondContact O-CG 3.4Å; F360-L364 PolarHBondContact O-N 3.16Å; K361-L364 PolarHBondContact O-N 3.07Å; R362-L364 VanDerWaalsContact C-N 3.31Å; R362-L364 PolarHBondContact O-N 3.19Å; L364-L366 VanDerWaalsContact C-N 3.34Å; L364-P368 VanDerWaalsContact O-CA 3.31Å; L364-P368 WeakPolarHBondContact O-CA 3.44Å; L364-N370 HydrophobicContact CD2-CB 4.48Å; L364-C373 HydrophobicContact CD2-CB 3.97Å; L364-C373 HydrophobicContact CG-CB 3.93Å; L364-Q374 HydrophobicContact CD2-CB 3.93Å; L364-K377 HydrophobicContact CD1-CB 4.25Å; L364-K377 HydrophobicContact CD1-CD 3.62Å
365	Q	97	Very high	95.4	Very high	128 Å²	128	53.2 Å²	53.2	60%	0.598	25%	0.246	S	C	*	.	H	α-helix	trans	-72	-33	168.9	-76.1	169.7	-3.4	0	0	111.4	K361 R362 C363	K361-Q365 VanDerWaalsContact O-CG 3.32Å; K361-Q365 WeakPolarHBondContact O-CG 3.44Å; K361-Q365 PolarHBondContact O-N 3.46Å; R362-Q365 VanDerWaalsContact CD-OE1 3.28Å; R362-Q365 WeakPolarHBondContact O-CB 3.24Å; R362-Q365 PolarHBondContact O-N 3.22Å; R362-Q365 VanDerWaalsContact O-N 3.17Å; C363-Q365 VanDerWaalsContact C-N 3.31Å; C363-Q365 PolarHBondContact O-N 3.38Å
366	L	96.2	Very high	95.5	Very high	56 Å²	56	48.9 Å²	48.9	29%	0.293	23%	0.226	S	C	.	.	H	α-helix	trans	-86.1	-43.5	-179.2	-61.2	168.6	0	0	0	111	N335 V337 L340 R362 C363 L364	N335-L366 HydrophobicContact CB-CD1 3.95Å; N335-L366 HydrophobicContact CB-CD2 3.98Å; N335-L366 WeakPolarHBondContact O-CD1 3.34Å; V337-L366 HydrophobicContact CG2-CB 3.78Å; V337-L366 HydrophobicContact CG2-CD1 3.91Å; L340-L366 HydrophobicContact CD1-CD1 3.73Å; R362-L366 WeakPolarHBondContact O-CG 3.3Å; R362-L366 PolarHBondContact O-N 2.99Å; C363-L366 PolarHBondContact O-N 3.5Å; C363-L366 VanDerWaalsContact O-N 3.12Å; L364-L366 VanDerWaalsContact C-N 3.34Å
367	E	94.8	Very high	95.5	Very high	78 Å²	78	50.6 Å²	50.6	36%	0.364	23%	0.233	S	C	.	.			trans	-127.5	89.8	177.6	-71.5	179.6	-174	0	0	110.5	V337 C363 Y369 N370	V337-E367 HydrophobicContact CG1-CG 4.33Å; V337-E367 HydrophobicContact CG2-CG 4.09Å; C363-E367 PolarHBondContact O-N 3.38Å; E367-Y369 PolarHBondContact O-N 3.31Å; E367-Y369 VanDerWaalsContact O-N 3.09Å; E367-N370 HydrophobicContact CB-CB 3.85Å; E367-N370 WeakPolarHBondContact O-CB 3.28Å; E367-N370 PolarHBondContact O-N 3.38Å; E367-N370 VanDerWaalsContact O-N 3.09Å; E367-N370 PolarHBondContact OE2-ND2 2.94Å
368	P	91.7	Very high	95.5	Very high	83 Å²	83	50.5 Å²	50.5	54%	0.539	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.5	-175.8	-27.3	36.2	0	0	0	115.4	L364	L364-P368 VanDerWaalsContact O-CA 3.31Å; L364-P368 WeakPolarHBondContact O-CA 3.44Å
369	Y	88.3	Confident	95.5	Very high	190 Å²	190	43.5 Å²	43.5	75%	0.745	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	8.9	-178.8	-56.6	-78.3	0	0	0	113.2	E367 E371	E367-Y369 PolarHBondContact O-N 3.31Å; E367-Y369 VanDerWaalsContact O-N 3.09Å; Y369-E371 PolarHBondContact O-N 3.22Å
370	N	91.2	Very high	95.5	Very high	23 Å²	23	42.7 Å²	42.7	12%	0.123	20%	0.198	C	C	.	.			trans	-65.8	105.5	177.5	-172.3	-62.3	0	0	0	110.3	L364 E367 V372 C373 Q374	L364-N370 HydrophobicContact CD2-CB 4.48Å; E367-N370 HydrophobicContact CB-CB 3.85Å; E367-N370 WeakPolarHBondContact O-CB 3.28Å; E367-N370 PolarHBondContact O-N 3.38Å; E367-N370 VanDerWaalsContact O-N 3.09Å; E367-N370 PolarHBondContact OE2-ND2 2.94Å; N370-V372 PolarHBondContact O-N 3.06Å; N370-V372 PolarHBondContact OD1-N 3.3Å; N370-C373 HydrophobicContact CB-CB 4.26Å; N370-C373 WeakPolarHBondContact OD1-CB 3.49Å; N370-C373 PolarHBondContact OD1-N 3.35Å; N370-C373 PolarHBondContact OD1-SG 3.3Å; N370-Q374 VanDerWaalsContact O-CB 3.29Å; N370-Q374 WeakPolarHBondContact O-CB 3.24Å; N370-Q374 PolarHBondContact O-N 3.49Å
371	E	91.8	Very high	95.4	Very high	42 Å²	42	43.1 Å²	43.1	20%	0.196	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-44.3	-173	178.2	170.2	-162.4	0	0	112.8	Y369 Q374 Y375 V397 S409 E411 Y412	Y369-E371 PolarHBondContact O-N 3.22Å; E371-Q374 WeakPolarHBondContact O-CB 3.39Å; E371-Q374 PolarHBondContact O-N 3.3Å; E371-Y375 WeakPolarHBondContact O-CB 3.47Å; E371-Y375 PolarHBondContact O-N 3.21Å; E371-V397 HydrophobicContact CG-CG1 3.77Å; E371-V397 VanDerWaalsContact OE1-CG1 3.24Å; E371-V397 WeakPolarHBondContact OE1-CG1 3.48Å; E371-S409 PolarHBondContact OE1-OG 2.89Å; E371-S409 VanDerWaalsContact OE2-CB 3.26Å; E371-S409 WeakPolarHBondContact OE2-CB 3.27Å; E371-S409 PolarHBondContact OE2-OG 3.28Å; E371-E411 HydrophobicContact CG-CB 3.94Å; E371-Y412 VanDerWaalsContact OE1-CA 3.26Å; E371-Y412 WeakPolarHBondContact OE1-CA 3.09Å; E371-Y412 WeakPolarHBondContact OE1-CB 3.08Å; E371-Y412 PolarHBondContact OE1-N 3.41Å
372	V	93.1	Very high	95.4	Very high	22 Å²	22	38.4 Å²	38.4	13%	0.133	18%	0.179	C	C	.	.	H	α-helix	trans	-67.9	-44.8	-175.7	-172.9	0	0	0	0	110.9	Q341 M345 N370 Q374 Y375 M376 E411	Q341-V372 HydrophobicContact CG-CG1 4.4Å; M345-V372 HydrophobicContact SD-CG1 4.37Å; N370-V372 PolarHBondContact O-N 3.06Å; N370-V372 PolarHBondContact OD1-N 3.3Å; V372-Q374 PolarHBondContact O-N 2.88Å; V372-Y375 PolarHBondContact O-N 3.33Å; V372-M376 HydrophobicContact CG1-CG 4.15Å; V372-M376 WeakPolarHBondContact O-CB 3.21Å; V372-M376 VanDerWaalsContact O-CG 3.28Å; V372-M376 WeakPolarHBondContact O-CG 3.24Å; V372-M376 PolarHBondContact O-N 2.93Å; V372-E411 HydrophobicContact CB-CG 4.41Å; V372-E411 HydrophobicContact CG1-CG 4.35Å; V372-E411 HydrophobicContact CG2-CG 4.06Å
373	C	95.6	Very high	95.3	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-35.7	175	-70.2	0	0	0	0	111.8	F360 C363 L364 N370 K377	F360-C373 HydrophobicContact CD1-CB 4.33Å; C363-C373 HydrophobicContact CB-CB 3.78Å; C363-C373 WeakPolarHBondContact CB-SG 3.19Å; C363-C373 WeakPolarHBondContact SG-CB 3.39Å; C363-C373 CovalentContact SG-SG 2.03Å; C363-C373 PolarHBondContact SG-SG 3.47Å; L364-C373 HydrophobicContact CD2-CB 3.97Å; L364-C373 HydrophobicContact CG-CB 3.93Å; N370-C373 HydrophobicContact CB-CB 4.26Å; N370-C373 WeakPolarHBondContact OD1-CB 3.49Å; N370-C373 PolarHBondContact OD1-N 3.35Å; N370-C373 PolarHBondContact OD1-SG 3.3Å; C373-K377 WeakPolarHBondContact O-CB 3.36Å; C373-K377 PolarHBondContact O-N 3.47Å
374	Q	96.4	Very high	95.2	Very high	13 Å²	13	34.6 Å²	34.6	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-69.6	-43.4	178	-170.8	61	26.9	0	0	111.9	L364 N370 E371 V372 G378 A393 K396 V397	L364-Q374 HydrophobicContact CD2-CB 3.93Å; N370-Q374 VanDerWaalsContact O-CB 3.29Å; N370-Q374 WeakPolarHBondContact O-CB 3.24Å; N370-Q374 PolarHBondContact O-N 3.49Å; E371-Q374 WeakPolarHBondContact O-CB 3.39Å; E371-Q374 PolarHBondContact O-N 3.3Å; V372-Q374 PolarHBondContact O-N 2.88Å; Q374-G378 PolarHBondContact O-N 3.17Å; Q374-G378 VanDerWaalsContact O-N 3.1Å; Q374-A393 WeakPolarHBondContact CG-O 3.47Å; Q374-A393 PolarHBondContact NE2-O 3.04Å; Q374-K396 HydrophobicContact CG-CB 4.07Å; Q374-V397 HydrophobicContact CB-CG2 3.87Å; Q374-V397 HydrophobicContact CG-CG2 3.6Å
375	Y	96.4	Very high	95.2	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.027	16%	0.16	C	C	.	.	H	α-helix	trans	-60.1	-54.4	173	177.6	-96.6	0	0	0	111.4	E371 V372 K377 G378 L379 E411 R414 V415 L418 D565	E371-Y375 WeakPolarHBondContact O-CB 3.47Å; E371-Y375 PolarHBondContact O-N 3.21Å; V372-Y375 PolarHBondContact O-N 3.33Å; Y375-K377 VanDerWaalsContact C-N 3.29Å; Y375-K377 PolarHBondContact O-N 3.19Å; Y375-G378 WeakPolarHBondContact O-CA 3.5Å; Y375-G378 PolarHBondContact O-N 2.82Å; Y375-L379 HydrophobicContact CE1-CD2 4.11Å; Y375-L379 PolarHBondContact O-N 3.31Å; Y375-E411 HydrophobicContact CD1-CG 4.26Å; Y375-E411 HydrophobicContact CD2-CB 4.35Å; Y375-E411 HydrophobicContact CG-CB 4.12Å; Y375-E411 HydrophobicContact CG-CG 4.17Å; Y375-R414 HydrophobicContact CE2-CB 3.85Å; Y375-R414 WeakPolarHBondContact OH-CB 3.38Å; Y375-V415 HydrophobicContact CD2-CB 3.84Å; Y375-V415 HydrophobicContact CD2-CG2 3.93Å; Y375-V415 HydrophobicContact CE2-CB 4.04Å; Y375-V415 HydrophobicContact CE2-CG2 4.33Å; Y375-L418 HydrophobicContact CE2-CD2 3.84Å; Y375-D565 PolarHBondContact OH-OD1 3.29Å
376	M	97.4	Very high	95.1	Very high	8 Å²	8	30.2 Å²	30.2	4%	0.039	15%	0.145	C	C	.	.	H	α-helix	trans	-65.8	-31.2	-177.3	-67.8	-60	-64.6	0	0	112.6	M345 Y348 F360 V372 L379 S380	M345-M376 HydrophobicContact CG-CE 4.17Å; M345-M376 HydrophobicContact CG-CG 4.24Å; Y348-M376 HydrophobicContact CD1-CE 3.67Å; Y348-M376 HydrophobicContact CD2-CE 4.34Å; Y348-M376 HydrophobicContact CE1-CE 4.3Å; Y348-M376 HydrophobicContact CG-CE 3.72Å; F360-M376 HydrophobicContact CD1-CB 4.06Å; F360-M376 HydrophobicContact CD2-CB 3.98Å; F360-M376 HydrophobicContact CE1-CB 3.61Å; F360-M376 HydrophobicContact CE1-CG 4.16Å; F360-M376 HydrophobicContact CE2-CB 3.51Å; F360-M376 HydrophobicContact CG-CB 4.25Å; F360-M376 HydrophobicContact CZ-CB 3.31Å; F360-M376 HydrophobicContact CZ-CE 4.14Å; F360-M376 HydrophobicContact CZ-CG 3.96Å; V372-M376 HydrophobicContact CG1-CG 4.15Å; V372-M376 WeakPolarHBondContact O-CB 3.21Å; V372-M376 VanDerWaalsContact O-CG 3.28Å; V372-M376 WeakPolarHBondContact O-CG 3.24Å; V372-M376 PolarHBondContact O-N 2.93Å; M376-L379 HydrophobicContact CE-CD2 4.14Å; M376-L379 HydrophobicContact SD-CD2 3.96Å; M376-S380 VanDerWaalsContact O-CB 3.29Å; M376-S380 WeakPolarHBondContact O-CB 3.42Å; M376-S380 PolarHBondContact O-N 3.45Å; M376-S380 PolarHBondContact O-OG 3.02Å
377	K	97.5	Very high	95.2	Very high	36 Å²	36	27.5 Å²	27.5	16%	0.157	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-49.3	168.6	176.1	-178	171.2	-170.8	0	111.2	L357 F360 L364 C373 Y375 S380 H381 A393	L357-K377 HydrophobicContact CD2-CB 4.36Å; L357-K377 HydrophobicContact CD2-CG 3.86Å; F360-K377 HydrophobicContact CB-CB 4.09Å; L364-K377 HydrophobicContact CD1-CB 4.25Å; L364-K377 HydrophobicContact CD1-CD 3.62Å; C373-K377 WeakPolarHBondContact O-CB 3.36Å; C373-K377 PolarHBondContact O-N 3.47Å; Y375-K377 VanDerWaalsContact C-N 3.29Å; Y375-K377 PolarHBondContact O-N 3.19Å; K377-S380 PolarHBondContact O-N 3.06Å; K377-H381 PolarHBondContact O-CD2 2.98Å; K377-H381 PolarHBondContact O-N 2.86Å; K377-H381 VanDerWaalsContact O-N 3.08Å; K377-A393 HydrophobicContact CG-CB 4.47Å
378	G	97.1	Very high	95.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-47	178	0	0	0	0	0	112	Q374 Y375 S380 H381 V382	Q374-G378 PolarHBondContact O-N 3.17Å; Q374-G378 VanDerWaalsContact O-N 3.1Å; Y375-G378 WeakPolarHBondContact O-CA 3.5Å; Y375-G378 PolarHBondContact O-N 2.82Å; G378-S380 PolarHBondContact O-N 2.79Å; G378-H381 PolarHBondContact O-N 2.84Å; G378-V382 WeakPolarHBondContact O-CG2 3.4Å; G378-V382 PolarHBondContact O-N 3.33Å
379	L	97.2	Very high	95.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.1	-44.9	175.9	178.5	62.9	0	0	0	112.7	Y348 Y375 M376 H381 V382 A383 L418 P564 D565	Y348-L379 HydrophobicContact CE1-CD2 3.89Å; Y348-L379 HydrophobicContact CE1-CG 4.49Å; Y348-L379 HydrophobicContact CE2-CD2 4.03Å; Y348-L379 HydrophobicContact CE2-CG 3.82Å; Y348-L379 WeakPolarHBondContact OH-CG 3.17Å; Y375-L379 HydrophobicContact CE1-CD2 4.11Å; Y375-L379 PolarHBondContact O-N 3.31Å; M376-L379 HydrophobicContact CE-CD2 4.14Å; M376-L379 HydrophobicContact SD-CD2 3.96Å; L379-H381 VanDerWaalsContact C-N 3.32Å; L379-H381 PolarHBondContact O-N 2.98Å; L379-V382 PolarHBondContact O-N 3.39Å; L379-A383 WeakPolarHBondContact O-CB 3.44Å; L379-A383 PolarHBondContact O-N 3.18Å; L379-L418 HydrophobicContact CB-CD2 3.91Å; L379-L418 HydrophobicContact CD1-CD1 3.81Å; L379-L418 HydrophobicContact CD1-CD2 3.92Å; L379-P564 HydrophobicContact CD1-CG 3.93Å; L379-D565 HydrophobicContact CD1-CB 3.74Å; L379-D565 HydrophobicContact CD2-CB 3.71Å; L379-D565 HydrophobicContact CG-CB 4.35Å
380	S	97.1	Very high	95.7	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-39.5	177.7	-60.4	0	0	0	0	112	Y348 M376 K377 G378 M384	Y348-S380 WeakPolarHBondContact CD2-OG 3.41Å; M376-S380 VanDerWaalsContact O-CB 3.29Å; M376-S380 WeakPolarHBondContact O-CB 3.42Å; M376-S380 PolarHBondContact O-N 3.45Å; M376-S380 PolarHBondContact O-OG 3.02Å; K377-S380 PolarHBondContact O-N 3.06Å; G378-S380 PolarHBondContact O-N 2.79Å; S380-M384 WeakPolarHBondContact O-CE 3.02Å; S380-M384 WeakPolarHBondContact O-CG 3.15Å; S380-M384 PolarHBondContact O-N 2.68Å
381	H	97.4	Very high	96	Very high	8 Å²	8	20 Å²	20	4%	0.037	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-44.7	174.3	-81.9	-60.5	0	0	0	112	K377 G378 L379 M384 G385 Q386	K377-H381 PolarHBondContact O-CD2 2.98Å; K377-H381 PolarHBondContact O-N 2.86Å; K377-H381 VanDerWaalsContact O-N 3.08Å; G378-H381 PolarHBondContact O-N 2.84Å; L379-H381 VanDerWaalsContact C-N 3.32Å; L379-H381 PolarHBondContact O-N 2.98Å; H381-M384 CarbonylContact O-C 3.56Å; H381-M384 PolarHBondContact O-N 3.06Å; H381-M384 VanDerWaalsContact O-N 3.12Å; H381-G385 PolarHBondContact O-N 2.89Å; H381-G385 VanDerWaalsContact O-N 3.12Å; H381-Q386 HydrophobicContact CB-CB 4.15Å; H381-Q386 PolarHBondContact CE1-OE1 3.02Å; H381-Q386 PolarHBondContact ND1-OE1 3.46Å; H381-Q386 PolarHBondContact O-N 3.05Å
382	V	96.8	Very high	96.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.4	-42.7	177.1	175.2	0	0	0	0	111.9	G378 L379 M384 G385 F387 Q394 S422 L425 P564 M831	G378-V382 WeakPolarHBondContact O-CG2 3.4Å; G378-V382 PolarHBondContact O-N 3.33Å; L379-V382 PolarHBondContact O-N 3.39Å; V382-M384 PolarHBondContact O-N 2.83Å; V382-G385 PolarHBondContact O-N 2.85Å; V382-F387 HydrophobicContact CG1-CE1 4.18Å; V382-Q394 VanDerWaalsContact CG2-NE2 3.3Å; V382-S422 WeakPolarHBondContact CG2-OG 3.47Å; V382-L425 HydrophobicContact CG1-CD1 4.32Å; V382-P564 HydrophobicContact CG1-CB 4.17Å; V382-P564 HydrophobicContact CG1-CG 4.05Å; V382-M831 WeakPolarHBondContact O-CE 3.27Å
383	A	95.8	Very high	96.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-31.2	175.3	0	0	0	0	0	112	Y348 L353 L379 R512 P564 N835	Y348-A383 HydrophobicContact CE2-CB 4.29Å; L353-A383 HydrophobicContact CD1-CB 3.7Å; L353-A383 HydrophobicContact CD2-CB 4.35Å; L379-A383 WeakPolarHBondContact O-CB 3.44Å; L379-A383 PolarHBondContact O-N 3.18Å; A383-R512 PolarHBondContact O-NH2 2.74Å; A383-P564 HydrophobicContact CB-CG 4.01Å; A383-N835 PolarHBondContact O-OD1 3.03Å
384	M	94.9	Very high	96.3	Very high	11 Å²	11	21.5 Å²	21.5	5%	0.054	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-3	173.6	-64.9	-173	-64.8	0	0	114.6	L353 Q354 L357 S380 H381 V382 Q386 N835	L353-M384 HydrophobicContact CB-CG 3.92Å; L353-M384 HydrophobicContact CB-SD 3.9Å; L353-M384 HydrophobicContact CD1-CG 3.56Å; L353-M384 HydrophobicContact CG-CG 4.4Å; Q354-M384 HydrophobicContact CG-SD 4.16Å; Q354-M384 PolarHBondContact NE2-SD 3.47Å; L357-M384 HydrophobicContact CD1-CE 3.14Å; L357-M384 HydrophobicContact CG-CE 4.02Å; S380-M384 WeakPolarHBondContact O-CE 3.02Å; S380-M384 WeakPolarHBondContact O-CG 3.15Å; S380-M384 PolarHBondContact O-N 2.68Å; H381-M384 CarbonylContact O-C 3.56Å; H381-M384 PolarHBondContact O-N 3.06Å; H381-M384 VanDerWaalsContact O-N 3.12Å; V382-M384 PolarHBondContact O-N 2.83Å; M384-Q386 VanDerWaalsContact C-N 3.35Å; M384-Q386 HydrophobicContact CB-CG 4.31Å; M384-N835 VanDerWaalsContact C-ND2 3.35Å; M384-N835 VanDerWaalsContact CA-ND2 3.27Å; M384-N835 WeakPolarHBondContact CA-ND2 3.2Å; M384-N835 PolarHBondContact O-ND2 2.9Å
385	G	95.6	Very high	96.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	21.5	-175.2	0	0	0	0	0	114.7	H381 V382 F387 D473 V474	H381-G385 PolarHBondContact O-N 2.89Å; H381-G385 VanDerWaalsContact O-N 3.12Å; V382-G385 PolarHBondContact O-N 2.85Å; G385-F387 VanDerWaalsContact O-CD2 3.26Å; G385-F387 WeakPolarHBondContact O-CD2 3.33Å; G385-F387 WeakPolarHBondContact O-CE2 3.48Å; G385-F387 PolarHBondContact O-N 3.43Å; G385-D473 WeakPolarHBondContact O-CB 3.26Å; G385-V474 PolarHBondContact O-N 3.03Å
386	Q	96.1	Very high	96	Very high	57 Å²	57	28.1 Å²	28.1	27%	0.266	13%	0.128	S	C	.	.			trans	-94.5	72.3	175	-63.5	177	-17.3	0	0	109.7	H381 M384 Y388 G390 D473	H381-Q386 HydrophobicContact CB-CB 4.15Å; H381-Q386 PolarHBondContact CE1-OE1 3.02Å; H381-Q386 PolarHBondContact ND1-OE1 3.46Å; H381-Q386 PolarHBondContact O-N 3.05Å; M384-Q386 VanDerWaalsContact C-N 3.35Å; M384-Q386 HydrophobicContact CB-CG 4.31Å; Q386-Y388 PolarHBondContact O-N 3.24Å; Q386-G390 PolarHBondContact O-N 3.48Å; Q386-D473 VanDerWaalsContact C-OD2 3.3Å; Q386-D473 WeakPolarHBondContact CA-OD2 3.11Å
387	F	96.4	Very high	95.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-70.3	-31.5	-167.5	-61.7	-82.4	0	0	0	113.2	V382 G385 G390 I391 S422 L425 H426 L429 L467 D473 M831	V382-F387 HydrophobicContact CG1-CE1 4.18Å; G385-F387 VanDerWaalsContact O-CD2 3.26Å; G385-F387 WeakPolarHBondContact O-CD2 3.33Å; G385-F387 WeakPolarHBondContact O-CE2 3.48Å; G385-F387 PolarHBondContact O-N 3.43Å; F387-G390 PolarHBondContact O-N 3.21Å; F387-I391 WeakPolarHBondContact O-CB 3.43Å; F387-I391 WeakPolarHBondContact O-CG1 3.38Å; F387-I391 PolarHBondContact O-N 2.87Å; F387-S422 VanDerWaalsContact CD1-O 3.27Å; F387-S422 WeakPolarHBondContact CD1-O 3.26Å; F387-L425 HydrophobicContact CE1-CB 3.53Å; F387-L425 HydrophobicContact CE1-CD1 4.24Å; F387-L425 HydrophobicContact CZ-CB 3.8Å; F387-H426 HydrophobicContact CB-CB 4.09Å; F387-H426 HydrophobicContact CD1-CB 4.09Å; F387-H426 HydrophobicContact CD2-CB 4.07Å; F387-H426 AromaticContact CD2-CD2 3.73Å; F387-H426 HydrophobicContact CG-CB 3.81Å; F387-H426 AromaticContact CG-CD2 3.98Å; F387-L429 HydrophobicContact CD2-CD2 4.32Å; F387-L429 HydrophobicContact CE2-CD1 3.86Å; F387-L429 HydrophobicContact CE2-CD2 3.86Å; F387-L429 HydrophobicContact CE2-CG 4.42Å; F387-L429 HydrophobicContact CZ-CD1 4.29Å; F387-L467 HydrophobicContact CB-CD2 3.85Å; F387-D473 PolarHBondContact N-OD1 3Å; F387-D473 PolarHBondContact N-OD2 3.41Å; F387-D473 VanDerWaalsContact N-OD2 3.16Å; F387-M831 HydrophobicContact CE1-CE 4.45Å; F387-M831 HydrophobicContact CE2-SD 4.25Å; F387-M831 HydrophobicContact CZ-CE 3.83Å; F387-M831 HydrophobicContact CZ-SD 3.87Å
388	Y	95.3	Very high	95.4	Very high	137 Å²	137	28.3 Å²	28.3	54%	0.537	13%	0.129	S	C	.	.	H	α-helix	trans	-62.2	-53.9	178.6	178	-100.1	0	0	0	112.2	Q386 G390 K392 L467 D473	Q386-Y388 PolarHBondContact O-N 3.24Å; Y388-G390 VanDerWaalsContact C-N 3.29Å; Y388-G390 PolarHBondContact O-N 3.18Å; Y388-K392 HydrophobicContact CE1-CD 4.4Å; Y388-K392 VanDerWaalsContact O-CB 3.22Å; Y388-K392 WeakPolarHBondContact O-CB 3.27Å; Y388-K392 PolarHBondContact O-N 3.34Å; Y388-L467 HydrophobicContact CD2-CD1 3.92Å; Y388-D473 PolarHBondContact N-OD2 3.37Å
389	E	95.3	Very high	94.9	Very high	58 Å²	58	34.5 Å²	34.5	27%	0.271	16%	0.162	S	C	.	.	H	α-helix	trans	-69.3	-30	177.8	-73.1	-64.1	132.4	0	0	111.9	K392 A393	E389-K392 IonicContact OE1-NZ 2.77Å; E389-K392 PolarHBondContact OE1-NZ 3.19Å; E389-K392 VanDerWaalsContact OE1-NZ 3.12Å; E389-K392 IonicContact OE2-NZ 3.29Å; E389-A393 WeakPolarHBondContact O-CB 3.45Å; E389-A393 PolarHBondContact O-N 3.18Å
390	G	96.5	Very high	94.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-56.9	173.3	0	0	0	0	0	112.9	Q386 F387 Y388 K392 A393 Q394	Q386-G390 PolarHBondContact O-N 3.48Å; F387-G390 PolarHBondContact O-N 3.21Å; Y388-G390 VanDerWaalsContact C-N 3.29Å; Y388-G390 PolarHBondContact O-N 3.18Å; G390-K392 PolarHBondContact O-N 2.87Å; G390-A393 WeakPolarHBondContact O-CB 3.49Å; G390-A393 PolarHBondContact O-N 3.44Å; G390-A393 VanDerWaalsContact O-N 3.1Å; G390-Q394 VanDerWaalsContact O-CG 3.26Å; G390-Q394 WeakPolarHBondContact O-CG 3.43Å; G390-Q394 PolarHBondContact O-N 2.89Å
391	I	96.2	Very high	93	Very high	20 Å²	20	42.7 Å²	42.7	10%	0.103	21%	0.206	C	C	.	.	H	α-helix	trans	-64.6	-42.2	-179.9	-68.8	174.8	0	0	0	110.9	F387 A393 Q394 T395 R419 R423 L467	F387-I391 WeakPolarHBondContact O-CB 3.43Å; F387-I391 WeakPolarHBondContact O-CG1 3.38Å; F387-I391 PolarHBondContact O-N 2.87Å; I391-A393 PolarHBondContact O-N 3.25Å; I391-Q394 PolarHBondContact O-N 3.46Å; I391-Q394 VanDerWaalsContact O-N 3.16Å; I391-T395 PolarHBondContact O-N 3.12Å; I391-T395 PolarHBondContact O-OG1 3.2Å; I391-R419 HydrophobicContact CG2-CG 4.48Å; I391-R423 HydrophobicContact CD1-CG 3.67Å; I391-L467 HydrophobicContact CD1-CD1 4.1Å; I391-L467 HydrophobicContact CD1-CD2 3.64Å; I391-L467 HydrophobicContact CD1-CG 3.8Å
392	K	95.4	Very high	92	Very high	94 Å²	94	44.2 Å²	44.2	41%	0.409	22%	0.216	S	C	.	.	H	α-helix	trans	-55.3	-40.2	173.3	178.8	-178.4	175.7	-173.4	0	111.7	Y388 E389 G390 K396	Y388-K392 HydrophobicContact CE1-CD 4.4Å; Y388-K392 VanDerWaalsContact O-CB 3.22Å; Y388-K392 WeakPolarHBondContact O-CB 3.27Å; Y388-K392 PolarHBondContact O-N 3.34Å; E389-K392 IonicContact OE1-NZ 2.77Å; E389-K392 PolarHBondContact OE1-NZ 3.19Å; E389-K392 VanDerWaalsContact OE1-NZ 3.12Å; E389-K392 IonicContact OE2-NZ 3.29Å; G390-K392 PolarHBondContact O-N 2.87Å; K392-K396 PolarHBondContact O-N 2.88Å
393	A	95.8	Very high	91.1	Very high	2 Å²	2	50 Å²	50	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-70.8	-41.9	178.5	0	0	0	0	0	112.5	Q374 K377 E389 G390 I391 K396 V397	Q374-A393 WeakPolarHBondContact CG-O 3.47Å; Q374-A393 PolarHBondContact NE2-O 3.04Å; K377-A393 HydrophobicContact CG-CB 4.47Å; E389-A393 WeakPolarHBondContact O-CB 3.45Å; E389-A393 PolarHBondContact O-N 3.18Å; G390-A393 WeakPolarHBondContact O-CB 3.49Å; G390-A393 PolarHBondContact O-N 3.44Å; G390-A393 VanDerWaalsContact O-N 3.1Å; I391-A393 PolarHBondContact O-N 3.25Å; A393-K396 WeakPolarHBondContact O-CB 3.49Å; A393-K396 PolarHBondContact O-N 2.71Å; A393-V397 PolarHBondContact O-N 3.18Å
394	Q	95.3	Very high	89.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-43.4	176.7	-68.7	156.8	1.9	0	0	112.4	V382 G390 I391 K396 V397 M398 V415 L418 R419 S422	V382-Q394 VanDerWaalsContact CG2-NE2 3.3Å; G390-Q394 VanDerWaalsContact O-CG 3.26Å; G390-Q394 WeakPolarHBondContact O-CG 3.43Å; G390-Q394 PolarHBondContact O-N 2.89Å; I391-Q394 PolarHBondContact O-N 3.46Å; I391-Q394 VanDerWaalsContact O-N 3.16Å; Q394-K396 PolarHBondContact O-N 2.95Å; Q394-V397 WeakPolarHBondContact O-CB 3.29Å; Q394-V397 PolarHBondContact O-N 3.12Å; Q394-M398 PolarHBondContact O-N 2.9Å; Q394-M398 VanDerWaalsContact O-N 3.11Å; Q394-V415 HydrophobicContact CB-CG2 3.57Å; Q394-V415 HydrophobicContact CG-CG2 3.76Å; Q394-L418 HydrophobicContact CG-CD2 4.33Å; Q394-R419 HydrophobicContact CB-CB 4.38Å; Q394-S422 PolarHBondContact NE2-OG 3.12Å; Q394-S422 VanDerWaalsContact NE2-OG 3.09Å
395	T	93.7	Very high	88.8	Confident	52 Å²	52	60.4 Å²	60.4	32%	0.319	33%	0.331	S	S	.	.	H	α-helix	trans	-58.7	-37.4	176.8	-59.6	0	0	0	0	111.4	I391 V397 M398 L399	I391-T395 PolarHBondContact O-N 3.12Å; I391-T395 PolarHBondContact O-OG1 3.2Å; T395-V397 VanDerWaalsContact C-N 3.32Å; T395-V397 PolarHBondContact O-N 3.23Å; T395-M398 PolarHBondContact O-N 3.12Å; T395-L399 WeakPolarHBondContact O-CG 3.32Å; T395-L399 PolarHBondContact O-N 3.44Å
396	K	93.3	Very high	87.9	Confident	108 Å²	108	66.1 Å²	66.1	47%	0.47	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-35.7	175.2	-72.8	-179.3	169.9	-161.5	0	113.4	Q374 K392 A393 Q394 L399	Q374-K396 HydrophobicContact CG-CB 4.07Å; K392-K396 PolarHBondContact O-N 2.88Å; A393-K396 WeakPolarHBondContact O-CB 3.49Å; A393-K396 PolarHBondContact O-N 2.71Å; Q394-K396 PolarHBondContact O-N 2.95Å; K396-L399 PolarHBondContact O-N 2.97Å
397	V	92.3	Very high	87	Confident	1 Å²	1	71 Å²	71	1%	0.006	38%	0.379	C	S	.	.	H	α-helix	trans	-65.1	-44.3	173.5	178.5	0	0	0	0	110.1	E371 Q374 A393 Q394 T395 L399 N400 V415	E371-V397 HydrophobicContact CG-CG1 3.77Å; E371-V397 VanDerWaalsContact OE1-CG1 3.24Å; E371-V397 WeakPolarHBondContact OE1-CG1 3.48Å; Q374-V397 HydrophobicContact CB-CG2 3.87Å; Q374-V397 HydrophobicContact CG-CG2 3.6Å; A393-V397 PolarHBondContact O-N 3.18Å; Q394-V397 WeakPolarHBondContact O-CB 3.29Å; Q394-V397 PolarHBondContact O-N 3.12Å; T395-V397 VanDerWaalsContact C-N 3.32Å; T395-V397 PolarHBondContact O-N 3.23Å; V397-L399 PolarHBondContact O-N 3.2Å; V397-N400 PolarHBondContact O-N 3.03Å; V397-N400 VanDerWaalsContact O-N 3.1Å; V397-V415 HydrophobicContact CB-CB 4.34Å; V397-V415 HydrophobicContact CB-CG1 4.08Å; V397-V415 HydrophobicContact CB-CG2 3.98Å; V397-V415 HydrophobicContact CG1-CB 4.11Å; V397-V415 HydrophobicContact CG1-CG1 3.75Å; V397-V415 HydrophobicContact CG1-CG2 4.29Å; V397-V415 HydrophobicContact CG2-CG2 4.3Å
398	M	89.8	Confident	86.3	Confident	46 Å²	46	72.3 Å²	72.3	23%	0.227	39%	0.389	C	S	.	.	H	α-helix	trans	-65.6	-21.2	179.6	-64.7	173.8	59.2	0	0	113.9	Q394 T395 N400 D401 V415 K416 R419	Q394-M398 PolarHBondContact O-N 2.9Å; Q394-M398 VanDerWaalsContact O-N 3.11Å; T395-M398 PolarHBondContact O-N 3.12Å; M398-N400 VanDerWaalsContact C-N 3.29Å; M398-D401 VanDerWaalsContact O-OD1 3.12Å; M398-V415 HydrophobicContact CG-CG1 3.51Å; M398-V415 HydrophobicContact SD-CG1 4.49Å; M398-K416 HydrophobicContact CE-CG 4.12Å; M398-K416 HydrophobicContact CG-CG 4.3Å; M398-K416 HydrophobicContact SD-CG 4.31Å; M398-R419 HydrophobicContact SD-CB 4.39Å; M398-R419 WeakPolarHBondContact SD-CD 2.96Å
399	L	88.1	Confident	85.9	Confident	131 Å²	131	67 Å²	67	69%	0.686	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-21	175.2	-70.5	173.2	0	0	0	112.7	T395 K396 V397 D401	T395-L399 WeakPolarHBondContact O-CG 3.32Å; T395-L399 PolarHBondContact O-N 3.44Å; K396-L399 PolarHBondContact O-N 2.97Å; V397-L399 PolarHBondContact O-N 3.2Å; L399-D401 PolarHBondContact O-N 3.2Å; L399-D401 VanDerWaalsContact O-N 3.14Å
400	N	79.1	Confident	85.5	Confident	70 Å²	70	67 Å²	67	37%	0.374	38%	0.377	S	S	.	.	S	Bend	trans	-88.9	59.8	178.7	-66.2	-13.7	0	0	0	110.2	V397 M398	V397-N400 PolarHBondContact O-N 3.03Å; V397-N400 VanDerWaalsContact O-N 3.1Å; M398-N400 VanDerWaalsContact C-N 3.29Å
401	D	75	Confident	85.2	Confident	102 Å²	102	68.5 Å²	68.5	55%	0.545	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-59.5	132.3	-178.7	-86.6	-10.9	0	0	0	111.5	M398 L399 L403 Y412	M398-D401 VanDerWaalsContact O-OD1 3.12Å; L399-D401 PolarHBondContact O-N 3.2Å; L399-D401 VanDerWaalsContact O-N 3.14Å; D401-L403 PolarHBondContact O-N 3.36Å; D401-Y412 VanDerWaalsContact OD1-CE2 3.24Å; D401-Y412 WeakPolarHBondContact OD1-CE2 3.4Å; D401-Y412 PolarHBondContact OD1-OH 3.34Å
402	P	75.8	Confident	84.8	Confident	40 Å²	40	68.6 Å²	68.6	26%	0.26	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-58.6	135.5	173.6	-20.3	30	0	0	0	110.7	Q406 A408 Y412	P402-Q406 HydrophobicContact CB-CB 4.26Å; P402-A408 HydrophobicContact CG-CB 3.8Å; P402-Y412 HydrophobicContact CG-CD1 4.19Å; P402-Y412 HydrophobicContact CG-CD2 4.47Å; P402-Y412 HydrophobicContact CG-CE1 4.25Å; P402-Y412 HydrophobicContact CG-CG 4.3Å
403	L	76.9	Confident	84.5	Confident	122 Å²	122	65.6 Å²	65.6	64%	0.639	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-62.7	154.9	176.3	-67	173.2	0	0	0	111.1	D401 G405 Q406	D401-L403 PolarHBondContact O-N 3.36Å; L403-G405 PolarHBondContact O-N 3.44Å; L403-G405 VanDerWaalsContact O-N 3.17Å; L403-Q406 HydrophobicContact CB-CB 4.34Å; L403-Q406 WeakPolarHBondContact O-CA 3.21Å; L403-Q406 WeakPolarHBondContact O-CB 3.36Å; L403-Q406 PolarHBondContact O-N 3.06Å
404	P	71.9	Confident	84.3	Confident	136 Å²	136	68.2 Å²	68.2	88%	0.883	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	124.1	175.1	-26.3	34.7	0	0	0	111.8	Q406	P404-Q406 VanDerWaalsContact C-N 3.32Å
405	G	70.3	Confident	84.2	Confident	92 Å²	92	68.2 Å²	68.2	95%	0.948	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-10.7	-176	0	0	0	0	0	115	L403	L403-G405 PolarHBondContact O-N 3.44Å; L403-G405 VanDerWaalsContact O-N 3.17Å
406	Q	77.4	Confident	84.2	Confident	121 Å²	121	68.1 Å²	68.1	57%	0.565	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-81.9	131.7	170.5	-168.2	178.1	5.1	0	0	110.2	P402 L403 P404 A408	P402-Q406 HydrophobicContact CB-CB 4.26Å; L403-Q406 HydrophobicContact CB-CB 4.34Å; L403-Q406 WeakPolarHBondContact O-CA 3.21Å; L403-Q406 WeakPolarHBondContact O-CB 3.36Å; L403-Q406 PolarHBondContact O-N 3.06Å; P404-Q406 VanDerWaalsContact C-N 3.32Å; Q406-A408 PolarHBondContact O-N 3.45Å
407	K	77.3	Confident	84.2	Confident	160 Å²	160	63 Å²	63	70%	0.696	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-71.6	126.9	175.3	-169.1	177.3	-179	179	0	109.6
408	A	81.7	Confident	84.4	Confident	26 Å²	26	63 Å²	63	22%	0.215	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-58	139	172.3	0	0	0	0	0	111.3	P402 Q406 Y412 L413	P402-A408 HydrophobicContact CG-CB 3.8Å; Q406-A408 PolarHBondContact O-N 3.45Å; A408-Y412 HydrophobicContact CB-CD1 3.79Å; A408-Y412 HydrophobicContact CB-CE1 4.47Å; A408-Y412 HydrophobicContact CB-CG 4.49Å; A408-L413 HydrophobicContact CB-CD2 3.92Å; A408-L413 HydrophobicContact CB-CG 4.14Å
409	S	86.6	Confident	84.7	Confident	27 Å²	27	63 Å²	63	19%	0.189	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-67.4	155.7	171.6	62	0	0	0	0	110.8	E371 E411 Y412 L413	E371-S409 PolarHBondContact OE1-OG 2.89Å; E371-S409 VanDerWaalsContact OE2-CB 3.26Å; E371-S409 WeakPolarHBondContact OE2-CB 3.27Å; E371-S409 PolarHBondContact OE2-OG 3.28Å; S409-E411 PolarHBondContact O-N 2.72Å; S409-Y412 PolarHBondContact O-N 3Å; S409-Y412 WeakPolarHBondContact OG-CB 3.3Å; S409-Y412 PolarHBondContact OG-N 2.92Å; S409-Y412 VanDerWaalsContact OG-N 3.14Å; S409-L413 WeakPolarHBondContact O-CG 3.48Å; S409-L413 PolarHBondContact O-N 3.37Å
410	P	86.7	Confident	85	Confident	56 Å²	56	57 Å²	57	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-56.8	-38.1	173.6	-24.6	34.7	0	0	0	113.1	L413 R414	P410-L413 PolarHBondContact O-N 2.95Å; P410-R414 WeakPolarHBondContact O-CG 3.39Å; P410-R414 PolarHBondContact O-N 3.35Å
411	E	89.9	Confident	85.8	Confident	32 Å²	32	53.9 Å²	53.9	15%	0.15	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-44.4	178.8	-67.6	71.1	-154.9	0	0	111	E371 V372 Y375 S409 L413 R414 V415	E371-E411 HydrophobicContact CG-CB 3.94Å; V372-E411 HydrophobicContact CB-CG 4.41Å; V372-E411 HydrophobicContact CG1-CG 4.35Å; V372-E411 HydrophobicContact CG2-CG 4.06Å; Y375-E411 HydrophobicContact CD1-CG 4.26Å; Y375-E411 HydrophobicContact CD2-CB 4.35Å; Y375-E411 HydrophobicContact CG-CB 4.12Å; Y375-E411 HydrophobicContact CG-CG 4.17Å; S409-E411 PolarHBondContact O-N 2.72Å; E411-L413 VanDerWaalsContact C-N 3.29Å; E411-L413 PolarHBondContact O-N 2.96Å; E411-R414 PolarHBondContact O-N 3.23Å; E411-V415 WeakPolarHBondContact O-CB 3.47Å; E411-V415 PolarHBondContact O-N 2.94Å
412	Y	89.1	Confident	86.8	Confident	22 Å²	22	49 Å²	49	9%	0.086	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-39.5	174.8	-177.7	-91.2	0	0	0	112.2	E371 D401 P402 A408 S409 V415 K416	E371-Y412 VanDerWaalsContact OE1-CA 3.26Å; E371-Y412 WeakPolarHBondContact OE1-CA 3.09Å; E371-Y412 WeakPolarHBondContact OE1-CB 3.08Å; E371-Y412 PolarHBondContact OE1-N 3.41Å; D401-Y412 VanDerWaalsContact OD1-CE2 3.24Å; D401-Y412 WeakPolarHBondContact OD1-CE2 3.4Å; D401-Y412 PolarHBondContact OD1-OH 3.34Å; P402-Y412 HydrophobicContact CG-CD1 4.19Å; P402-Y412 HydrophobicContact CG-CD2 4.47Å; P402-Y412 HydrophobicContact CG-CE1 4.25Å; P402-Y412 HydrophobicContact CG-CG 4.3Å; A408-Y412 HydrophobicContact CB-CD1 3.79Å; A408-Y412 HydrophobicContact CB-CE1 4.47Å; A408-Y412 HydrophobicContact CB-CG 4.49Å; S409-Y412 PolarHBondContact O-N 3Å; S409-Y412 WeakPolarHBondContact OG-CB 3.3Å; S409-Y412 PolarHBondContact OG-N 2.92Å; S409-Y412 VanDerWaalsContact OG-N 3.14Å; Y412-V415 WeakPolarHBondContact O-CG1 3.38Å; Y412-K416 VanDerWaalsContact OH-CE 3.32Å; Y412-K416 WeakPolarHBondContact OH-CE 3.46Å; Y412-K416 PolarHBondContact OH-NZ 3.49Å
413	L	88.6	Confident	87.7	Confident	31 Å²	31	48.2 Å²	48.2	16%	0.162	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-43.9	178.2	-63	172.8	0	0	0	111.1	A408 S409 P410 E411 Y417 P455	A408-L413 HydrophobicContact CB-CD2 3.92Å; A408-L413 HydrophobicContact CB-CG 4.14Å; S409-L413 WeakPolarHBondContact O-CG 3.48Å; S409-L413 PolarHBondContact O-N 3.37Å; P410-L413 PolarHBondContact O-N 2.95Å; E411-L413 VanDerWaalsContact C-N 3.29Å; E411-L413 PolarHBondContact O-N 2.96Å; L413-Y417 VanDerWaalsContact O-CD2 3.28Å; L413-Y417 WeakPolarHBondContact O-CD2 3.41Å; L413-Y417 WeakPolarHBondContact O-CE2 3.44Å; L413-P455 HydrophobicContact CD2-CB 4.1Å; L413-P455 HydrophobicContact CD2-CG 4.11Å
414	R	91.2	Very high	88.6	Confident	58 Å²	58	42.4 Å²	42.4	22%	0.219	24%	0.238	C	C	.	.	H	α-helix	trans	-73.2	-33.5	-177.3	-68.7	175.6	-170.4	162.7	5.5	113.2	Y375 P410 E411 K416 Y417 L418 N453	Y375-R414 HydrophobicContact CE2-CB 3.85Å; Y375-R414 WeakPolarHBondContact OH-CB 3.38Å; P410-R414 WeakPolarHBondContact O-CG 3.39Å; P410-R414 PolarHBondContact O-N 3.35Å; E411-R414 PolarHBondContact O-N 3.23Å; R414-K416 PolarHBondContact O-N 2.92Å; R414-Y417 PolarHBondContact O-N 2.9Å; R414-Y417 VanDerWaalsContact O-N 3.12Å; R414-L418 PolarHBondContact O-N 2.91Å; R414-N453 WeakPolarHBondContact CG-OD1 3.42Å; R414-N453 PolarHBondContact NE-OD1 3.01Å
415	V	94.2	Very high	89.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-31.6	-171.7	80.3	0	0	0	0	113	Y375 Q394 V397 M398 E411 Y412 L418 R419	Y375-V415 HydrophobicContact CD2-CB 3.84Å; Y375-V415 HydrophobicContact CD2-CG2 3.93Å; Y375-V415 HydrophobicContact CE2-CB 4.04Å; Y375-V415 HydrophobicContact CE2-CG2 4.33Å; Q394-V415 HydrophobicContact CB-CG2 3.57Å; Q394-V415 HydrophobicContact CG-CG2 3.76Å; V397-V415 HydrophobicContact CB-CB 4.34Å; V397-V415 HydrophobicContact CB-CG1 4.08Å; V397-V415 HydrophobicContact CB-CG2 3.98Å; V397-V415 HydrophobicContact CG1-CB 4.11Å; V397-V415 HydrophobicContact CG1-CG1 3.75Å; V397-V415 HydrophobicContact CG1-CG2 4.29Å; V397-V415 HydrophobicContact CG2-CG2 4.3Å; M398-V415 HydrophobicContact CG-CG1 3.51Å; M398-V415 HydrophobicContact SD-CG1 4.49Å; E411-V415 WeakPolarHBondContact O-CB 3.47Å; E411-V415 PolarHBondContact O-N 2.94Å; Y412-V415 WeakPolarHBondContact O-CG1 3.38Å; V415-L418 PolarHBondContact O-N 3.28Å; V415-R419 WeakPolarHBondContact O-CB 3.39Å; V415-R419 PolarHBondContact O-N 3.17Å
416	K	92.7	Very high	90.9	Very high	49 Å²	49	31.9 Å²	31.9	21%	0.213	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-45.9	177.7	-63.5	-176.8	-180	-173.6	0	111.2	M398 Y412 R414 R419 E420 F456	M398-K416 HydrophobicContact CE-CG 4.12Å; M398-K416 HydrophobicContact CG-CG 4.3Å; M398-K416 HydrophobicContact SD-CG 4.31Å; Y412-K416 VanDerWaalsContact OH-CE 3.32Å; Y412-K416 WeakPolarHBondContact OH-CE 3.46Å; Y412-K416 PolarHBondContact OH-NZ 3.49Å; R414-K416 PolarHBondContact O-N 2.92Å; K416-R419 PolarHBondContact O-N 3.44Å; K416-E420 PolarHBondContact O-N 2.59Å; K416-F456 HydrophobicContact CB-CB 3.89Å; K416-F456 HydrophobicContact CB-CD1 4.49Å; K416-F456 HydrophobicContact CB-CD2 3.72Å; K416-F456 HydrophobicContact CB-CE2 4.4Å; K416-F456 HydrophobicContact CB-CG 3.78Å; K416-F456 HydrophobicContact CD-CB 3.55Å; K416-F456 HydrophobicContact CD-CD1 4.42Å; K416-F456 HydrophobicContact CD-CG 4.05Å; K416-F456 HydrophobicContact CG-CB 4.33Å
417	Y	94.5	Very high	91.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-44.2	173.9	-59.2	-75.6	0	0	0	111.6	L413 R414 R419 E420 Y421 F446 H449 W450 L454 P455 F456 I458	L413-Y417 VanDerWaalsContact O-CD2 3.28Å; L413-Y417 WeakPolarHBondContact O-CD2 3.41Å; L413-Y417 WeakPolarHBondContact O-CE2 3.44Å; R414-Y417 PolarHBondContact O-N 2.9Å; R414-Y417 VanDerWaalsContact O-N 3.12Å; Y417-R419 VanDerWaalsContact C-N 3.3Å; Y417-R419 PolarHBondContact O-N 3.35Å; Y417-E420 PolarHBondContact O-N 3.42Å; Y417-Y421 VanDerWaalsContact O-CB 3.27Å; Y417-Y421 WeakPolarHBondContact O-CB 3.47Å; Y417-Y421 PolarHBondContact O-N 3.31Å; Y417-F446 HydrophobicContact CD1-CD2 4.05Å; Y417-F446 HydrophobicContact CD1-CE1 4.41Å; Y417-F446 AromaticContact CD1-CE2 3.72Å; Y417-F446 HydrophobicContact CD1-CE2 3.72Å; Y417-F446 AromaticContact CD1-CZ 3.9Å; Y417-F446 HydrophobicContact CD1-CZ 3.9Å; Y417-F446 HydrophobicContact CE1-CD2 4.41Å; Y417-F446 HydrophobicContact CE1-CE2 4.49Å; Y417-H449 HydrophobicContact CE1-CB 4.08Å; Y417-H449 WeakPolarHBondContact OH-CB 3.05Å; Y417-W450 HydrophobicContact CD1-CB 3.53Å; Y417-W450 AromaticContact CD1-CG 3.88Å; Y417-W450 HydrophobicContact CD1-CG 3.88Å; Y417-W450 HydrophobicContact CE1-CB 3.88Å; Y417-W450 HydrophobicContact CG-CB 3.92Å; Y417-W450 AromaticContact CG-CD1 3.67Å; Y417-W450 AromaticContact CG-CG 3.81Å; Y417-W450 HydrophobicContact CG-CG 3.81Å; Y417-L454 WeakPolarHBondContact CE2-O 3.44Å; Y417-L454 PolarHBondContact OH-O 2.84Å; Y417-P455 PolarHBondContact OH-O 3.35Å; Y417-F456 AromaticContact CD1-CD2 3.67Å; Y417-F456 HydrophobicContact CD1-CD2 3.67Å; Y417-F456 AromaticContact CD1-CE2 3.8Å; Y417-F456 HydrophobicContact CD1-CE2 3.8Å; Y417-F456 HydrophobicContact CD2-CD2 4.34Å; Y417-F456 AromaticContact CE1-CD2 3.4Å; Y417-F456 HydrophobicContact CE1-CD2 3.4Å; Y417-F456 VanDerWaalsContact CE1-CD2 3.4Å; Y417-F456 AromaticContact CE1-CE2 3.79Å; Y417-F456 HydrophobicContact CE1-CE2 3.79Å; Y417-F456 HydrophobicContact CE1-CG 4.48Å; Y417-F456 HydrophobicContact CE2-CB 4.48Å; Y417-F456 HydrophobicContact CE2-CD2 4.12Å; Y417-F456 HydrophobicContact CG-CD2 4.13Å; Y417-F456 HydrophobicContact CG-CE2 4.47Å; Y417-F456 AromaticContact CZ-CD2 3.63Å; Y417-I458 HydrophobicContact CE1-CD1 4.35Å
418	L	95.6	Very high	92.5	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-61.6	-39.1	179.2	-176.8	64.2	0	0	0	111.4	Y375 L379 Q394 R414 V415 S422	Y375-L418 HydrophobicContact CE2-CD2 3.84Å; L379-L418 HydrophobicContact CB-CD2 3.91Å; L379-L418 HydrophobicContact CD1-CD1 3.81Å; L379-L418 HydrophobicContact CD1-CD2 3.92Å; Q394-L418 HydrophobicContact CG-CD2 4.33Å; R414-L418 PolarHBondContact O-N 2.91Å; V415-L418 PolarHBondContact O-N 3.28Å; L418-S422 VanDerWaalsContact O-CB 3.29Å; L418-S422 WeakPolarHBondContact O-CB 3.29Å; L418-S422 PolarHBondContact O-N 3.15Å; L418-S422 PolarHBondContact O-OG 3.42Å
419	R	95.6	Very high	93.1	Very high	44 Å²	44	20.6 Å²	20.6	17%	0.166	10%	0.102	C	C	.	.	H	α-helix	trans	-61.5	-52.1	175.5	177.4	-174.4	171.9	-114	12	112.2	I391 Q394 M398 V415 K416 Y417 Y421 S422 R423 E463	I391-R419 HydrophobicContact CG2-CG 4.48Å; Q394-R419 HydrophobicContact CB-CB 4.38Å; M398-R419 HydrophobicContact SD-CB 4.39Å; M398-R419 WeakPolarHBondContact SD-CD 2.96Å; V415-R419 WeakPolarHBondContact O-CB 3.39Å; V415-R419 PolarHBondContact O-N 3.17Å; K416-R419 PolarHBondContact O-N 3.44Å; Y417-R419 VanDerWaalsContact C-N 3.3Å; Y417-R419 PolarHBondContact O-N 3.35Å; R419-Y421 VanDerWaalsContact C-N 3.3Å; R419-Y421 PolarHBondContact O-N 2.91Å; R419-S422 WeakPolarHBondContact O-CB 3.39Å; R419-S422 PolarHBondContact O-N 3.23Å; R419-S422 VanDerWaalsContact O-N 3.16Å; R419-R423 VanDerWaalsContact CZ-NH1 3.3Å; R419-R423 VanDerWaalsContact NH1-NH1 3.16Å; R419-R423 WeakPolarHBondContact O-CG 3.34Å; R419-R423 PolarHBondContact O-N 3.48Å; R419-E463 IonicContact CZ-OE1 2.87Å; R419-E463 IonicContact NH1-OE1 2.95Å; R419-E463 PolarHBondContact NH1-OE1 3.12Å; R419-E463 IonicContact NH2-OE1 3.94Å; R419-E463 IonicContact NH2-OE2 2.92Å
420	E	95.1	Very high	93.5	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.023	11%	0.113	C	C	.	.	H	α-helix	trans	-65.4	-37.7	-179.5	-65.4	-51.7	118.6	0	0	111.4	K416 Y417 S422 R423 Y424 F446 F456 Y461 Q464	K416-E420 PolarHBondContact O-N 2.59Å; Y417-E420 PolarHBondContact O-N 3.42Å; E420-S422 VanDerWaalsContact C-N 3.35Å; E420-S422 PolarHBondContact O-N 3.19Å; E420-R423 WeakPolarHBondContact O-CB 3.45Å; E420-R423 PolarHBondContact O-N 3.38Å; E420-R423 IonicContact OE1-CZ 3.6Å; E420-R423 IonicContact OE1-NH1 3.7Å; E420-R423 PolarHBondContact OE1-NH1 2.84Å; E420-R423 IonicContact OE2-CZ 3.75Å; E420-R423 IonicContact OE2-NH1 2.68Å; E420-Y424 PolarHBondContact O-N 2.91Å; E420-F446 HydrophobicContact CB-CE2 3.76Å; E420-F446 HydrophobicContact CB-CZ 4.13Å; E420-F446 HydrophobicContact CG-CE2 4.37Å; E420-F456 HydrophobicContact CG-CZ 4.33Å; E420-Y461 WeakPolarHBondContact CB-OH 3.45Å; E420-Y461 HydrophobicContact CG-CE1 3.9Å; E420-Y461 WeakPolarHBondContact CG-OH 3.29Å; E420-Q464 HydrophobicContact CB-CG 4.2Å; E420-Q464 WeakPolarHBondContact O-CG 3.47Å; E420-Q464 PolarHBondContact OE2-N 2.87Å
421	Y	95.2	Very high	93.6	Very high	5 Å²	5	22.1 Å²	22.1	2%	0.02	11%	0.106	C	C	.	.	H	α-helix	trans	-64.9	-38.4	172.9	-174	-133.1	0	0	0	112.3	Y417 R419 R423 Y424 L425 I438 W450 P564	Y417-Y421 VanDerWaalsContact O-CB 3.27Å; Y417-Y421 WeakPolarHBondContact O-CB 3.47Å; Y417-Y421 PolarHBondContact O-N 3.31Å; R419-Y421 VanDerWaalsContact C-N 3.3Å; R419-Y421 PolarHBondContact O-N 2.91Å; Y421-R423 VanDerWaalsContact C-N 3.35Å; Y421-R423 PolarHBondContact O-N 3.09Å; Y421-Y424 HydrophobicContact CD2-CD1 4.26Å; Y421-Y424 HydrophobicContact CE2-CD1 4.28Å; Y421-Y424 PolarHBondContact O-N 2.87Å; Y421-L425 HydrophobicContact CD1-CD1 4.03Å; Y421-L425 HydrophobicContact CD2-CG 4.2Å; Y421-L425 HydrophobicContact CE1-CD1 3.72Å; Y421-L425 HydrophobicContact CE1-CG 4.32Å; Y421-L425 HydrophobicContact CE2-CD1 4.22Å; Y421-L425 HydrophobicContact CE2-CD2 3.95Å; Y421-L425 HydrophobicContact CE2-CG 3.9Å; Y421-L425 HydrophobicContact CG-CD1 4.42Å; Y421-L425 WeakPolarHBondContact O-CB 3.15Å; Y421-L425 VanDerWaalsContact O-CG 3.29Å; Y421-L425 WeakPolarHBondContact O-CG 3.45Å; Y421-L425 PolarHBondContact O-N 3.41Å; Y421-I438 HydrophobicContact CE2-CD1 3.85Å; Y421-I438 HydrophobicContact CE2-CG1 4.31Å; Y421-W450 AromaticContact CD1-CH2 3.63Å; Y421-W450 HydrophobicContact CD1-CH2 3.63Å; Y421-W450 HydrophobicContact CD1-CZ2 4.12Å; Y421-W450 HydrophobicContact CD2-CH2 4.09Å; Y421-W450 HydrophobicContact CD2-CZ3 4.33Å; Y421-W450 AromaticContact CE1-CH2 3.92Å; Y421-W450 HydrophobicContact CE1-CH2 3.92Å; Y421-W450 HydrophobicContact CE2-CH2 4.36Å; Y421-W450 AromaticContact CG-CH2 3.73Å; Y421-W450 HydrophobicContact CG-CH2 3.73Å; Y421-W450 HydrophobicContact CG-CZ2 4.43Å; Y421-W450 HydrophobicContact CG-CZ3 4.3Å; Y421-P564 HydrophobicContact CD1-CB 4.32Å; Y421-P564 HydrophobicContact CE1-CB 3.88Å
422	S	96.4	Very high	93.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.8	-41.2	175.6	-58.3	0	0	0	0	111.9	V382 F387 Q394 L418 R419 E420 L425 H426	V382-S422 WeakPolarHBondContact CG2-OG 3.47Å; F387-S422 VanDerWaalsContact CD1-O 3.27Å; F387-S422 WeakPolarHBondContact CD1-O 3.26Å; Q394-S422 PolarHBondContact NE2-OG 3.12Å; Q394-S422 VanDerWaalsContact NE2-OG 3.09Å; L418-S422 VanDerWaalsContact O-CB 3.29Å; L418-S422 WeakPolarHBondContact O-CB 3.29Å; L418-S422 PolarHBondContact O-N 3.15Å; L418-S422 PolarHBondContact O-OG 3.42Å; R419-S422 WeakPolarHBondContact O-CB 3.39Å; R419-S422 PolarHBondContact O-N 3.23Å; R419-S422 VanDerWaalsContact O-N 3.16Å; E420-S422 VanDerWaalsContact C-N 3.35Å; E420-S422 PolarHBondContact O-N 3.19Å; S422-L425 PolarHBondContact O-N 2.93Å; S422-H426 WeakPolarHBondContact O-CB 3.48Å; S422-H426 PolarHBondContact O-N 3.25Å
423	R	95.6	Very high	93.5	Very high	23 Å²	23	23.2 Å²	23.2	9%	0.087	12%	0.118	C	C	.	.	H	α-helix	trans	-63	-46.8	174.9	-74.7	171	78.6	166.9	8.1	111.7	I391 R419 E420 Y421 H426 A427 E463 Q464 P465	I391-R423 HydrophobicContact CD1-CG 3.67Å; R419-R423 VanDerWaalsContact CZ-NH1 3.3Å; R419-R423 VanDerWaalsContact NH1-NH1 3.16Å; R419-R423 WeakPolarHBondContact O-CG 3.34Å; R419-R423 PolarHBondContact O-N 3.48Å; E420-R423 WeakPolarHBondContact O-CB 3.45Å; E420-R423 PolarHBondContact O-N 3.38Å; E420-R423 IonicContact OE1-CZ 3.6Å; E420-R423 IonicContact OE1-NH1 3.7Å; E420-R423 PolarHBondContact OE1-NH1 2.84Å; E420-R423 IonicContact OE2-CZ 3.75Å; E420-R423 IonicContact OE2-NH1 2.68Å; Y421-R423 VanDerWaalsContact C-N 3.35Å; Y421-R423 PolarHBondContact O-N 3.09Å; R423-H426 PolarHBondContact O-N 2.98Å; R423-A427 WeakPolarHBondContact O-CB 3.44Å; R423-A427 PolarHBondContact O-N 3.4Å; R423-E463 IonicContact CZ-OE2 2.87Å; R423-E463 IonicContact NH1-OE1 3.84Å; R423-E463 IonicContact NH1-OE2 3.44Å; R423-E463 PolarHBondContact NH1-OE2 2.8Å; R423-E463 IonicContact NH2-OE2 3.68Å; R423-E463 PolarHBondContact NH2-OE2 3Å; R423-Q464 HydrophobicContact CB-CB 3.7Å; R423-Q464 PolarHBondContact NE-O 3.35Å; R423-Q464 PolarHBondContact NH2-O 3.4Å; R423-P465 WeakPolarHBondContact CB-O 3.26Å; R423-P465 PolarHBondContact NE-O 3.49Å
424	Y	94.5	Very high	93.1	Very high	1 Å²	1	25.3 Å²	25.3	0%	0.004	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-47.4	175.8	171.9	-94.2	0	0	0	111.8	E420 Y421 H426 A427 H428 Y436 I438 D441 L442	E420-Y424 PolarHBondContact O-N 2.91Å; Y421-Y424 HydrophobicContact CD2-CD1 4.26Å; Y421-Y424 HydrophobicContact CE2-CD1 4.28Å; Y421-Y424 PolarHBondContact O-N 2.87Å; Y424-H426 VanDerWaalsContact C-N 3.35Å; Y424-H426 PolarHBondContact O-N 3.31Å; Y424-A427 PolarHBondContact O-N 3Å; Y424-H428 AromaticContact CD2-CE1 3.58Å; Y424-H428 AromaticContact CD2-ND1 3.67Å; Y424-H428 AromaticContact CE2-CE1 3.34Å; Y424-H428 WeakPolarHBondContact CE2-CE1 3.5Å; Y424-H428 AromaticContact CE2-ND1 3.57Å; Y424-H428 AromaticContact CE2-NE2 4Å; Y424-H428 AromaticContact CZ-ND1 3.98Å; Y424-H428 PolarHBondContact O-N 2.74Å; Y424-H428 PolarHBondContact O-ND1 3.16Å; Y424-Y436 HydrophobicContact CE1-CD2 4.29Å; Y424-Y436 AromaticContact CE1-CE2 3.48Å; Y424-Y436 HydrophobicContact CE1-CE2 3.48Å; Y424-Y436 VanDerWaalsContact CE1-CE2 3.48Å; Y424-Y436 AromaticContact CZ-CE2 3.92Å; Y424-I438 HydrophobicContact CD1-CG1 4.39Å; Y424-I438 HydrophobicContact CE1-CG1 3.49Å; Y424-I438 VanDerWaalsContact CE1-CG1 3.49Å; Y424-I438 PolarHBondContact OH-N 3.33Å; Y424-D441 HydrophobicContact CE2-CB 3.6Å; Y424-D441 PolarHBondContact OH-OD2 2.98Å; Y424-L442 HydrophobicContact CD2-CD2 3.91Å; Y424-L442 HydrophobicContact CE2-CD2 4.43Å; Y424-L442 HydrophobicContact CG-CD2 4.06Å
425	L	94.7	Very high	92.7	Very high	3 Å²	3	29 Å²	29	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-61.3	-41.4	177.3	-73.2	176.8	0	0	0	112.3	V382 F387 Y421 S422 H428 L429 Y436 L827 M831	V382-L425 HydrophobicContact CG1-CD1 4.32Å; F387-L425 HydrophobicContact CE1-CB 3.53Å; F387-L425 HydrophobicContact CE1-CD1 4.24Å; F387-L425 HydrophobicContact CZ-CB 3.8Å; Y421-L425 HydrophobicContact CD1-CD1 4.03Å; Y421-L425 HydrophobicContact CD2-CG 4.2Å; Y421-L425 HydrophobicContact CE1-CD1 3.72Å; Y421-L425 HydrophobicContact CE1-CG 4.32Å; Y421-L425 HydrophobicContact CE2-CD1 4.22Å; Y421-L425 HydrophobicContact CE2-CD2 3.95Å; Y421-L425 HydrophobicContact CE2-CG 3.9Å; Y421-L425 HydrophobicContact CG-CD1 4.42Å; Y421-L425 WeakPolarHBondContact O-CB 3.15Å; Y421-L425 VanDerWaalsContact O-CG 3.29Å; Y421-L425 WeakPolarHBondContact O-CG 3.45Å; Y421-L425 PolarHBondContact O-N 3.41Å; S422-L425 PolarHBondContact O-N 2.93Å; L425-H428 PolarHBondContact O-N 2.74Å; L425-L429 PolarHBondContact O-N 3.09Å; L425-L429 VanDerWaalsContact O-N 3.12Å; L425-Y436 WeakPolarHBondContact CD2-OH 3.2Å; L425-L827 HydrophobicContact CD2-CD1 4.17Å; L425-M831 HydrophobicContact CD1-CE 4.37Å
426	H	96.3	Very high	92.2	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.019	15%	0.152	C	C	.	.	H	α-helix	trans	-62.6	-47.3	176	-179.4	-98.1	0	0	0	111.5	F387 S422 R423 Y424 H428 L429 L467 Q468 I471	F387-H426 HydrophobicContact CB-CB 4.09Å; F387-H426 HydrophobicContact CD1-CB 4.09Å; F387-H426 HydrophobicContact CD2-CB 4.07Å; F387-H426 AromaticContact CD2-CD2 3.73Å; F387-H426 HydrophobicContact CG-CB 3.81Å; F387-H426 AromaticContact CG-CD2 3.98Å; S422-H426 WeakPolarHBondContact O-CB 3.48Å; S422-H426 PolarHBondContact O-N 3.25Å; R423-H426 PolarHBondContact O-N 2.98Å; Y424-H426 VanDerWaalsContact C-N 3.35Å; Y424-H426 PolarHBondContact O-N 3.31Å; H426-H428 PolarHBondContact O-N 3.44Å; H426-H428 VanDerWaalsContact O-N 3.14Å; H426-L429 VanDerWaalsContact O-CB 3.28Å; H426-L429 WeakPolarHBondContact O-CB 3.48Å; H426-L429 PolarHBondContact O-N 3.13Å; H426-L429 VanDerWaalsContact O-N 3.15Å; H426-L467 HydrophobicContact CB-CD2 3.84Å; H426-L467 WeakPolarHBondContact ND1-CD2 3.4Å; H426-Q468 PolarHBondContact CE1-N 3.38Å; H426-Q468 PolarHBondContact CE1-O 3.48Å; H426-I471 PolarHBondContact CE1-O 3.02Å; H426-I471 PolarHBondContact NE2-O 2.89Å; H426-I471 WeakPolarHBondContact O-CG2 3.28Å
427	A	94.9	Very high	91.9	Very high	24 Å²	24	29.3 Å²	29.3	20%	0.198	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-25.7	-179.4	0	0	0	0	0	113.6	R423 Y424 P465	R423-A427 WeakPolarHBondContact O-CB 3.44Å; R423-A427 PolarHBondContact O-N 3.4Å; Y424-A427 PolarHBondContact O-N 3Å; A427-P465 HydrophobicContact CB-CB 4.16Å; A427-P465 HydrophobicContact CB-CG 4.27Å
428	H	93.8	Very high	91.5	Very high	46 Å²	46	29.4 Å²	29.4	21%	0.213	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	10	-178.8	-62.1	82.3	0	0	0	113.5	Y424 L425 H426 D430 T431 Y436 L827	Y424-H428 AromaticContact CD2-CE1 3.58Å; Y424-H428 AromaticContact CD2-ND1 3.67Å; Y424-H428 AromaticContact CE2-CE1 3.34Å; Y424-H428 WeakPolarHBondContact CE2-CE1 3.5Å; Y424-H428 AromaticContact CE2-ND1 3.57Å; Y424-H428 AromaticContact CE2-NE2 4Å; Y424-H428 AromaticContact CZ-ND1 3.98Å; Y424-H428 PolarHBondContact O-N 2.74Å; Y424-H428 PolarHBondContact O-ND1 3.16Å; L425-H428 PolarHBondContact O-N 2.74Å; H426-H428 PolarHBondContact O-N 3.44Å; H426-H428 VanDerWaalsContact O-N 3.14Å; H428-D430 PolarHBondContact O-N 2.68Å; H428-T431 WeakPolarHBondContact CA-OG1 3.28Å; H428-T431 WeakPolarHBondContact O-CB 3.4Å; H428-T431 PolarHBondContact O-N 3.04Å; H428-Y436 HydrophobicContact CB-CD2 4.2Å; H428-L827 HydrophobicContact CB-CD1 4Å; H428-L827 WeakPolarHBondContact O-CD1 3.34Å
429	L	94.6	Very high	91	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-37.8	-169.4	-170.8	59.2	0	0	0	113	F387 L425 H426 I471 K472 V474 L827 R828 M831	F387-L429 HydrophobicContact CD2-CD2 4.32Å; F387-L429 HydrophobicContact CE2-CD1 3.86Å; F387-L429 HydrophobicContact CE2-CD2 3.86Å; F387-L429 HydrophobicContact CE2-CG 4.42Å; F387-L429 HydrophobicContact CZ-CD1 4.29Å; L425-L429 PolarHBondContact O-N 3.09Å; L425-L429 VanDerWaalsContact O-N 3.12Å; H426-L429 VanDerWaalsContact O-CB 3.28Å; H426-L429 WeakPolarHBondContact O-CB 3.48Å; H426-L429 PolarHBondContact O-N 3.13Å; H426-L429 VanDerWaalsContact O-N 3.15Å; L429-I471 HydrophobicContact CB-CG2 3.94Å; L429-I471 HydrophobicContact CD2-CG2 4.08Å; L429-K472 WeakPolarHBondContact CD2-O 3.46Å; L429-V474 HydrophobicContact CD1-CG2 3.78Å; L429-V474 HydrophobicContact CD2-CG2 3.98Å; L429-V474 HydrophobicContact CG-CG2 4.36Å; L429-L827 HydrophobicContact CD1-CB 4.23Å; L429-R828 HydrophobicContact CD1-CB 4.14Å; L429-R828 HydrophobicContact CG-CB 4.04Å; L429-R828 WeakPolarHBondContact O-CB 3.26Å; L429-R828 PolarHBondContact O-N 2.83Å; L429-M831 HydrophobicContact CD1-SD 4.05Å
430	D	93.4	Very high	90.5	Very high	80 Å²	80	32.4 Å²	32.4	43%	0.428	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	1	-179.7	-66.2	-51.7	0	0	0	113.3	H428 R828	H428-D430 PolarHBondContact O-N 2.68Å; D430-R828 IonicContact OD1-CZ 2.93Å; D430-R828 IonicContact OD1-NE 3.71Å; D430-R828 PolarHBondContact OD1-NE 3.46Å; D430-R828 IonicContact OD1-NH2 2.98Å; D430-R828 PolarHBondContact OD1-NH2 2.93Å; D430-R828 IonicContact OD2-CZ 3.24Å; D430-R828 IonicContact OD2-NE 3.84Å; D430-R828 IonicContact OD2-NH2 3.54Å; D430-R828 PolarHBondContact OD2-NH2 3.34Å
431	T	90.1	Very high	90.2	Very high	34 Å²	34	35.4 Å²	35.4	21%	0.209	20%	0.195	C	C	.	.	S	Bend	trans	-74.7	137.3	178.7	-55.3	0	0	0	0	110.2	H428 E435	H428-T431 WeakPolarHBondContact CA-OG1 3.28Å; H428-T431 WeakPolarHBondContact O-CB 3.4Å; H428-T431 PolarHBondContact O-N 3.04Å; T431-E435 HydrophobicContact CG2-CB 3.87Å
432	P	90	Very high	90	Very high	56 Å²	56	35.4 Å²	35.4	36%	0.364	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-57.3	139.1	173.5	-24.7	34.4	0	0	0	112.3	T434 E435 Y436	P432-T434 PolarHBondContact O-N 3.07Å; P432-E435 PolarHBondContact O-N 2.59Å; P432-Y436 PolarHBondContact O-N 2.86Å
433	L	87.2	Confident	89.7	Confident	22 Å²	22	37.7 Å²	37.7	12%	0.115	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-13	-177.9	-68.6	170	0	0	0	114.9	E435 Y436 K557 F824 P825 L827 M830	L433-E435 VanDerWaalsContact C-N 3.32Å; L433-Y436 HydrophobicContact CD2-CD1 4.45Å; L433-K557 PolarHBondContact O-NZ 2.96Å; L433-F824 VanDerWaalsContact CD1-O 3.27Å; L433-F824 WeakPolarHBondContact CD1-O 3.43Å; L433-P825 WeakPolarHBondContact CG-O 3.45Å; L433-P825 PolarHBondContact N-O 3.16Å; L433-L827 HydrophobicContact CD2-CD2 3.77Å; L433-L827 HydrophobicContact CD2-CG 4.18Å; L433-M830 HydrophobicContact CD1-CG 4.01Å; L433-M830 HydrophobicContact CD1-SD 3.39Å; L433-M830 WeakPolarHBondContact CD1-SD 3.19Å; L433-M830 HydrophobicContact CD2-SD 3.49Å; L433-M830 WeakPolarHBondContact CD2-SD 3.41Å; L433-M830 HydrophobicContact CG-SD 4.05Å
434	T	80.4	Confident	89.4	Confident	75 Å²	75	37.8 Å²	37.8	46%	0.46	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.5	172.7	49.9	0	0	0	0	113.3	P432 N540	P432-T434 PolarHBondContact O-N 3.07Å; T434-N540 VanDerWaalsContact O-CG 3.25Å; T434-N540 PolarHBondContact O-OD1 3.44Å
435	E	82.5	Confident	89.1	Confident	134 Å²	134	40 Å²	40	63%	0.626	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-13.1	178.9	-66.1	172.8	-156.1	0	0	111.8	T431 P432 L433	T431-E435 HydrophobicContact CG2-CB 3.87Å; P432-E435 PolarHBondContact O-N 2.59Å; L433-E435 VanDerWaalsContact C-N 3.32Å
436	Y	83.4	Confident	89	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.016	23%	0.233	C	C	.	.			trans	-80.7	118.7	179.7	177.6	-104.3	0	0	0	112.9	Y424 L425 H428 P432 L433 I438 L827	Y424-Y436 HydrophobicContact CE1-CD2 4.29Å; Y424-Y436 AromaticContact CE1-CE2 3.48Å; Y424-Y436 HydrophobicContact CE1-CE2 3.48Å; Y424-Y436 VanDerWaalsContact CE1-CE2 3.48Å; Y424-Y436 AromaticContact CZ-CE2 3.92Å; L425-Y436 WeakPolarHBondContact CD2-OH 3.2Å; H428-Y436 HydrophobicContact CB-CD2 4.2Å; P432-Y436 PolarHBondContact O-N 2.86Å; L433-Y436 HydrophobicContact CD2-CD1 4.45Å; Y436-I438 HydrophobicContact CE1-CD1 3.99Å; Y436-I438 HydrophobicContact CE1-CG1 4.17Å; Y436-I438 HydrophobicContact CE2-CD1 4.46Å; Y436-I438 HydrophobicContact CE2-CG1 4.1Å; Y436-I438 WeakPolarHBondContact OH-CD1 3.21Å; Y436-I438 WeakPolarHBondContact OH-CG1 3.49Å; Y436-L827 HydrophobicContact CD1-CD2 4.27Å; Y436-L827 HydrophobicContact CD2-CD1 3.85Å; Y436-L827 HydrophobicContact CD2-CD2 4.35Å; Y436-L827 HydrophobicContact CD2-CG 4.29Å; Y436-L827 HydrophobicContact CE1-CD2 3.95Å; Y436-L827 HydrophobicContact CE2-CD1 3.53Å; Y436-L827 HydrophobicContact CE2-CD2 4.04Å; Y436-L827 HydrophobicContact CE2-CG 4.22Å; Y436-L827 HydrophobicContact CG-CD2 4.43Å
437	N	85.6	Confident	88.8	Confident	52 Å²	52	39.9 Å²	39.9	28%	0.278	23%	0.233	S	C	.	.			trans	-150.8	87.1	175.8	-171	-14.2	0	0	0	114.1	D439 T440 D441	N437-D439 PolarHBondContact O-N 3.46Å; N437-D439 VanDerWaalsContact O-N 3.09Å; N437-D439 PolarHBondContact OD1-N 3.37Å; N437-D439 VanDerWaalsContact OD1-N 3.16Å; N437-T440 PolarHBondContact ND2-OG1 3.19Å; N437-T440 VanDerWaalsContact ND2-OG1 3.13Å; N437-T440 PolarHBondContact O-N 3.4Å; N437-T440 PolarHBondContact OD1-N 3.13Å; N437-D441 VanDerWaalsContact C-OD2 3.23Å; N437-D441 PolarHBondContact N-OD2 3.37Å; N437-D441 WeakPolarHBondContact O-CB 3.36Å; N437-D441 PolarHBondContact O-N 3.44Å; N437-D441 VanDerWaalsContact O-OD2 3.08Å
438	I	86.9	Confident	88.5	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-49.3	-39.6	176.5	-67	159.7	0	0	0	113.8	Y421 Y424 Y436 T440 D441 L442 L569	Y421-I438 HydrophobicContact CE2-CD1 3.85Å; Y421-I438 HydrophobicContact CE2-CG1 4.31Å; Y424-I438 HydrophobicContact CD1-CG1 4.39Å; Y424-I438 HydrophobicContact CE1-CG1 3.49Å; Y424-I438 VanDerWaalsContact CE1-CG1 3.49Å; Y424-I438 PolarHBondContact OH-N 3.33Å; Y436-I438 HydrophobicContact CE1-CD1 3.99Å; Y436-I438 HydrophobicContact CE1-CG1 4.17Å; Y436-I438 HydrophobicContact CE2-CD1 4.46Å; Y436-I438 HydrophobicContact CE2-CG1 4.1Å; Y436-I438 WeakPolarHBondContact OH-CD1 3.21Å; Y436-I438 WeakPolarHBondContact OH-CG1 3.49Å; I438-T440 PolarHBondContact O-N 2.94Å; I438-D441 PolarHBondContact O-N 2.9Å; I438-L442 HydrophobicContact CG2-CD1 3.67Å; I438-L442 HydrophobicContact CG2-CG 4.11Å; I438-L442 PolarHBondContact O-N 3.01Å; I438-L442 VanDerWaalsContact O-N 3.14Å; I438-L569 HydrophobicContact CG2-CD2 3.93Å
439	D	84.9	Confident	88.3	Confident	9 Å²	9	39.4 Å²	39.4	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-68.1	-23.9	-174.7	-59.8	-80.5	0	0	0	112.1	N437 K447 R560 W570 Q573	N437-D439 PolarHBondContact O-N 3.46Å; N437-D439 VanDerWaalsContact O-N 3.09Å; N437-D439 PolarHBondContact OD1-N 3.37Å; N437-D439 VanDerWaalsContact OD1-N 3.16Å; D439-K447 PolarHBondContact O-NZ 3.11Å; D439-R560 IonicContact OD1-CZ 3.99Å; D439-R560 IonicContact OD1-NH2 3.94Å; D439-R560 PolarHBondContact OD1-NH2 2.76Å; D439-R560 IonicContact OD2-CZ 2.66Å; D439-R560 IonicContact OD2-NH1 3.41Å; D439-R560 PolarHBondContact OD2-NH1 2.95Å; D439-R560 IonicContact OD2-NH2 3.99Å; D439-R560 PolarHBondContact OD2-NH2 3.34Å; D439-W570 PolarHBondContact OD1-N 3.42Å; D439-Q573 HydrophobicContact CB-CB 4.49Å; D439-Q573 HydrophobicContact CB-CG 4.5Å
440	T	85.6	Confident	88.1	Confident	102 Å²	102	40.2 Å²	40.2	63%	0.626	23%	0.23	S	C	*	.	H	α-helix	trans	-97.9	-37.1	175.7	-49.7	0	0	0	0	111.6	N437 I438	N437-T440 PolarHBondContact ND2-OG1 3.19Å; N437-T440 VanDerWaalsContact ND2-OG1 3.13Å; N437-T440 PolarHBondContact O-N 3.4Å; N437-T440 PolarHBondContact OD1-N 3.13Å; I438-T440 PolarHBondContact O-N 2.94Å
441	D	88.7	Confident	87.9	Confident	68 Å²	68	37 Å²	37	36%	0.364	22%	0.215	S	C	.	.	H	α-helix	trans	-76.1	-32.8	-170.8	-56.9	-19.4	0	0	0	112.8	Y424 N437 I438	Y424-D441 HydrophobicContact CE2-CB 3.6Å; Y424-D441 PolarHBondContact OH-OD2 2.98Å; N437-D441 VanDerWaalsContact C-OD2 3.23Å; N437-D441 PolarHBondContact N-OD2 3.37Å; N437-D441 WeakPolarHBondContact O-CB 3.36Å; N437-D441 PolarHBondContact O-N 3.44Å; N437-D441 VanDerWaalsContact O-OD2 3.08Å; I438-D441 PolarHBondContact O-N 2.9Å
442	L	90.1	Very high	87.7	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	22%	0.223	C	C	.	.	S	Bend	trans	-90.8	139.9	-179.8	-64.5	-174.3	0	0	0	112.5	Y424 I438 F446 K447	Y424-L442 HydrophobicContact CD2-CD2 3.91Å; Y424-L442 HydrophobicContact CE2-CD2 4.43Å; Y424-L442 HydrophobicContact CG-CD2 4.06Å; I438-L442 HydrophobicContact CG2-CD1 3.67Å; I438-L442 HydrophobicContact CG2-CG 4.11Å; I438-L442 PolarHBondContact O-N 3.01Å; I438-L442 VanDerWaalsContact O-N 3.14Å; L442-F446 HydrophobicContact CB-CD1 4.41Å; L442-F446 HydrophobicContact CD1-CD1 4.08Å; L442-F446 HydrophobicContact CD1-CE1 3.77Å; L442-K447 HydrophobicContact CB-CD 4.46Å; L442-K447 HydrophobicContact CB-CG 4.19Å
443	P	90.8	Very high	87.6	Confident	48 Å²	48	39 Å²	39	31%	0.312	22%	0.217	S	C	.	.			trans	-55.4	140.2	178.3	-26.2	34.4	0	0	0	113.3	S445 F446 K447 Y461	P443-S445 VanDerWaalsContact C-N 3.31Å; P443-S445 PolarHBondContact O-N 3.16Å; P443-F446 HydrophobicContact CB-CB 4.2Å; P443-F446 WeakPolarHBondContact O-CB 3.44Å; P443-F446 PolarHBondContact O-N 3.23Å; P443-F446 VanDerWaalsContact O-N 3.16Å; P443-K447 PolarHBondContact O-N 2.88Å; P443-K447 VanDerWaalsContact O-N 3.09Å; P443-Y461 HydrophobicContact CG-CD2 4.23Å; P443-Y461 HydrophobicContact CG-CE2 4.04Å
444	G	88.6	Confident	87.6	Confident	25 Å²	25	41 Å²	41	26%	0.258	23%	0.228	S	C	.	.	H	α-helix	trans	-59.3	-37.9	-179.8	0	0	0	0	0	113.9	K447 D448 P575	G444-K447 PolarHBondContact O-N 3.22Å; G444-D448 WeakPolarHBondContact O-CB 3.43Å; G444-D448 PolarHBondContact O-N 3.46Å; G444-P575 WeakPolarHBondContact O-CD 3.37Å; G444-P575 WeakPolarHBondContact O-CG 3.44Å
445	S	89.1	Confident	88	Confident	46 Å²	46	40.4 Å²	40.4	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-40.8	176.4	50.7	0	0	0	0	112.3	P443 D448 H449 I458	P443-S445 VanDerWaalsContact C-N 3.31Å; P443-S445 PolarHBondContact O-N 3.16Å; S445-D448 PolarHBondContact O-N 3.38Å; S445-H449 PolarHBondContact O-N 3.48Å; S445-H449 PolarHBondContact O-ND1 2.92Å; S445-I458 VanDerWaalsContact OG-CG2 3.28Å; S445-I458 WeakPolarHBondContact OG-CG2 3.42Å
446	F	92.3	Very high	88.3	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.3	-51.2	173.7	176.4	-82.3	0	0	0	111	Y417 E420 L442 P443 D448 H449 W450 F456 I458 Y461	Y417-F446 HydrophobicContact CD1-CD2 4.05Å; Y417-F446 HydrophobicContact CD1-CE1 4.41Å; Y417-F446 AromaticContact CD1-CE2 3.72Å; Y417-F446 HydrophobicContact CD1-CE2 3.72Å; Y417-F446 AromaticContact CD1-CZ 3.9Å; Y417-F446 HydrophobicContact CD1-CZ 3.9Å; Y417-F446 HydrophobicContact CE1-CD2 4.41Å; Y417-F446 HydrophobicContact CE1-CE2 4.49Å; E420-F446 HydrophobicContact CB-CE2 3.76Å; E420-F446 HydrophobicContact CB-CZ 4.13Å; E420-F446 HydrophobicContact CG-CE2 4.37Å; L442-F446 HydrophobicContact CB-CD1 4.41Å; L442-F446 HydrophobicContact CD1-CD1 4.08Å; L442-F446 HydrophobicContact CD1-CE1 3.77Å; P443-F446 HydrophobicContact CB-CB 4.2Å; P443-F446 WeakPolarHBondContact O-CB 3.44Å; P443-F446 PolarHBondContact O-N 3.23Å; P443-F446 VanDerWaalsContact O-N 3.16Å; F446-D448 VanDerWaalsContact C-N 3.33Å; F446-D448 PolarHBondContact O-N 2.9Å; F446-H449 PolarHBondContact O-N 3.38Å; F446-W450 HydrophobicContact CD1-CE3 4.35Å; F446-W450 HydrophobicContact CE1-CD2 4.24Å; F446-W450 AromaticContact CE1-CE3 3.59Å; F446-W450 HydrophobicContact CE1-CE3 3.59Å; F446-W450 HydrophobicContact CE1-CZ3 4.16Å; F446-W450 HydrophobicContact CZ-CE3 4.39Å; F446-W450 VanDerWaalsContact O-CB 3.25Å; F446-W450 WeakPolarHBondContact O-CB 3.43Å; F446-W450 PolarHBondContact O-N 3.19Å; F446-F456 AromaticContact CD2-CE2 3.79Å; F446-F456 HydrophobicContact CD2-CE2 3.79Å; F446-F456 HydrophobicContact CD2-CZ 4.21Å; F446-F456 AromaticContact CE2-CE2 3.72Å; F446-F456 HydrophobicContact CE2-CE2 3.72Å; F446-F456 HydrophobicContact CE2-CZ 4.33Å; F446-I458 HydrophobicContact CB-CD1 4.05Å; F446-I458 HydrophobicContact CD2-CD1 4.23Å; F446-Y461 HydrophobicContact CB-CD2 4.45Å; F446-Y461 HydrophobicContact CB-CE2 4.04Å; F446-Y461 HydrophobicContact CD2-CD2 4.36Å; F446-Y461 AromaticContact CD2-CE2 3.53Å; F446-Y461 HydrophobicContact CD2-CE2 3.53Å; F446-Y461 AromaticContact CD2-CZ 3.78Å; F446-Y461 HydrophobicContact CE2-CE2 4.33Å; F446-Y461 HydrophobicContact CG-CE2 4.09Å
447	K	91	Very high	88.5	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-44.2	178.4	-70.1	-172.2	-58.3	172.2	0	112.1	D439 L442 P443 G444 A451 L569 Q573 M574	D439-K447 PolarHBondContact O-NZ 3.11Å; L442-K447 HydrophobicContact CB-CD 4.46Å; L442-K447 HydrophobicContact CB-CG 4.19Å; P443-K447 PolarHBondContact O-N 2.88Å; P443-K447 VanDerWaalsContact O-N 3.09Å; G444-K447 PolarHBondContact O-N 3.22Å; K447-A451 VanDerWaalsContact O-CB 3.3Å; K447-A451 WeakPolarHBondContact O-CB 3.45Å; K447-A451 PolarHBondContact O-N 3.38Å; K447-L569 HydrophobicContact CB-CD1 3.83Å; K447-L569 HydrophobicContact CD-CD1 4.48Å; K447-L569 HydrophobicContact CD-CD2 4.35Å; K447-L569 HydrophobicContact CG-CD1 3.99Å; K447-L569 HydrophobicContact CG-CD2 4.49Å; K447-Q573 PolarHBondContact NZ-O 3.48Å; K447-M574 HydrophobicContact CB-CE 4.14Å; K447-M574 HydrophobicContact CB-SD 3.78Å
448	D	89.1	Confident	88.7	Confident	13 Å²	13	41 Å²	41	7%	0.07	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-48	-179.6	-172.3	68.9	0	0	0	112.5	G444 S445 F446 K452 M574 P575 S578	G444-D448 WeakPolarHBondContact O-CB 3.43Å; G444-D448 PolarHBondContact O-N 3.46Å; S445-D448 PolarHBondContact O-N 3.38Å; F446-D448 VanDerWaalsContact C-N 3.33Å; F446-D448 PolarHBondContact O-N 2.9Å; D448-K452 WeakPolarHBondContact O-CB 3.4Å; D448-K452 WeakPolarHBondContact O-CG 3.44Å; D448-K452 PolarHBondContact O-N 3.34Å; D448-K452 WeakPolarHBondContact OD1-CE 3.35Å; D448-K452 IonicContact OD1-NZ 3.65Å; D448-K452 PolarHBondContact OD1-NZ 3.26Å; D448-K452 IonicContact OD2-NZ 2.99Å; D448-K452 PolarHBondContact OD2-NZ 2.92Å; D448-M574 HydrophobicContact CB-SD 4.41Å; D448-P575 HydrophobicContact CB-CG 4.45Å; D448-S578 VanDerWaalsContact OD1-CB 3.24Å; D448-S578 WeakPolarHBondContact OD1-CB 3.37Å; D448-S578 PolarHBondContact OD1-OG 3.18Å; D448-S578 PolarHBondContact OD2-OG 3.13Å
449	H	90.7	Very high	88.6	Confident	47 Å²	47	48.7 Å²	48.7	22%	0.218	27%	0.271	C	S	.	.	H	α-helix	trans	-69.7	-37.7	-179	-71.7	62.5	0	0	0	111.6	Y417 S445 F446 K452 N453 L454	Y417-H449 HydrophobicContact CE1-CB 4.08Å; Y417-H449 WeakPolarHBondContact OH-CB 3.05Å; S445-H449 PolarHBondContact O-N 3.48Å; S445-H449 PolarHBondContact O-ND1 2.92Å; F446-H449 PolarHBondContact O-N 3.38Å; H449-K452 CarbonylContact O-C 3.57Å; H449-K452 PolarHBondContact O-N 2.78Å; H449-N453 PolarHBondContact O-N 2.96Å; H449-L454 HydrophobicContact CB-CB 4.07Å; H449-L454 PolarHBondContact O-N 2.91Å
450	W	90.8	Very high	88.6	Confident	16 Å²	16	52.2 Å²	52.2	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-48.4	176.3	-173	18.8	0	0	0	111.6	Y417 Y421 F446 K452 N453 P567 L569	Y417-W450 HydrophobicContact CD1-CB 3.53Å; Y417-W450 AromaticContact CD1-CG 3.88Å; Y417-W450 HydrophobicContact CD1-CG 3.88Å; Y417-W450 HydrophobicContact CE1-CB 3.88Å; Y417-W450 HydrophobicContact CG-CB 3.92Å; Y417-W450 AromaticContact CG-CD1 3.67Å; Y417-W450 AromaticContact CG-CG 3.81Å; Y417-W450 HydrophobicContact CG-CG 3.81Å; Y421-W450 AromaticContact CD1-CH2 3.63Å; Y421-W450 HydrophobicContact CD1-CH2 3.63Å; Y421-W450 HydrophobicContact CD1-CZ2 4.12Å; Y421-W450 HydrophobicContact CD2-CH2 4.09Å; Y421-W450 HydrophobicContact CD2-CZ3 4.33Å; Y421-W450 AromaticContact CE1-CH2 3.92Å; Y421-W450 HydrophobicContact CE1-CH2 3.92Å; Y421-W450 HydrophobicContact CE2-CH2 4.36Å; Y421-W450 AromaticContact CG-CH2 3.73Å; Y421-W450 HydrophobicContact CG-CH2 3.73Å; Y421-W450 HydrophobicContact CG-CZ2 4.43Å; Y421-W450 HydrophobicContact CG-CZ3 4.3Å; F446-W450 HydrophobicContact CD1-CE3 4.35Å; F446-W450 HydrophobicContact CE1-CD2 4.24Å; F446-W450 AromaticContact CE1-CE3 3.59Å; F446-W450 HydrophobicContact CE1-CE3 3.59Å; F446-W450 HydrophobicContact CE1-CZ3 4.16Å; F446-W450 HydrophobicContact CZ-CE3 4.39Å; F446-W450 VanDerWaalsContact O-CB 3.25Å; F446-W450 WeakPolarHBondContact O-CB 3.43Å; F446-W450 PolarHBondContact O-N 3.19Å; W450-K452 PolarHBondContact O-N 2.88Å; W450-N453 PolarHBondContact O-N 2.91Å; W450-N453 VanDerWaalsContact O-N 3.1Å; W450-P567 HydrophobicContact CD2-CB 3.59Å; W450-P567 HydrophobicContact CD2-CG 4.21Å; W450-P567 HydrophobicContact CE3-CB 3.85Å; W450-P567 HydrophobicContact CG-CB 4.02Å; W450-P567 HydrophobicContact CG-CG 4.21Å; W450-P567 HydrophobicContact CH2-CB 4.19Å; W450-P567 HydrophobicContact CZ2-CB 3.94Å; W450-P567 HydrophobicContact CZ3-CB 4.14Å; W450-L569 HydrophobicContact CE3-CD1 4.16Å
451	A	89.1	Confident	88.8	Confident	14 Å²	14	49.2 Å²	49.2	12%	0.116	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-31.5	178.8	0	0	0	0	0	112.9	K447 M574 F583	K447-A451 VanDerWaalsContact O-CB 3.3Å; K447-A451 WeakPolarHBondContact O-CB 3.45Å; K447-A451 PolarHBondContact O-N 3.38Å; A451-M574 HydrophobicContact CB-CE 3.99Å; A451-F583 HydrophobicContact CB-CE2 4.05Å; A451-F583 HydrophobicContact CB-CZ 4.1Å
452	K	86.1	Confident	88.9	Confident	87 Å²	87	53.9 Å²	53.9	38%	0.378	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-1.8	178.9	-67	171.6	-176.8	164.1	0	114.1	D448 H449 W450 L454 S578 F583	D448-K452 WeakPolarHBondContact O-CB 3.4Å; D448-K452 WeakPolarHBondContact O-CG 3.44Å; D448-K452 PolarHBondContact O-N 3.34Å; D448-K452 WeakPolarHBondContact OD1-CE 3.35Å; D448-K452 IonicContact OD1-NZ 3.65Å; D448-K452 PolarHBondContact OD1-NZ 3.26Å; D448-K452 IonicContact OD2-NZ 2.99Å; D448-K452 PolarHBondContact OD2-NZ 2.92Å; H449-K452 CarbonylContact O-C 3.57Å; H449-K452 PolarHBondContact O-N 2.78Å; W450-K452 PolarHBondContact O-N 2.88Å; K452-L454 VanDerWaalsContact C-N 3.28Å; K452-L454 HydrophobicContact CB-CD1 4.01Å; K452-L454 HydrophobicContact CB-CD2 4.47Å; K452-L454 HydrophobicContact CB-CG 3.74Å; K452-L454 HydrophobicContact CD-CD1 4.07Å; K452-L454 PolarHBondContact O-N 3.25Å; K452-S578 PolarHBondContact NZ-OG 2.77Å; K452-F583 HydrophobicContact CG-CE2 4Å
453	N	86.8	Confident	89	Confident	44 Å²	44	59 Å²	59	24%	0.235	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	54	41	-175.3	-165.5	58.8	0	0	0	113.3	R414 H449 W450	R414-N453 WeakPolarHBondContact CG-OD1 3.42Å; R414-N453 PolarHBondContact NE-OD1 3.01Å; H449-N453 PolarHBondContact O-N 2.96Å; W450-N453 PolarHBondContact O-N 2.91Å; W450-N453 VanDerWaalsContact O-N 3.1Å
454	L	88	Confident	89.1	Confident	65 Å²	65	58 Å²	58	34%	0.34	32%	0.321	S	S	.	.			trans	-83.1	157.4	178.8	-64.5	176.7	0	0	0	111.4	Y417 H449 K452 F456	Y417-L454 WeakPolarHBondContact CE2-O 3.44Å; Y417-L454 PolarHBondContact OH-O 2.84Å; H449-L454 HydrophobicContact CB-CB 4.07Å; H449-L454 PolarHBondContact O-N 2.91Å; K452-L454 VanDerWaalsContact C-N 3.28Å; K452-L454 HydrophobicContact CB-CD1 4.01Å; K452-L454 HydrophobicContact CB-CD2 4.47Å; K452-L454 HydrophobicContact CB-CG 3.74Å; K452-L454 HydrophobicContact CD-CD1 4.07Å; K452-L454 PolarHBondContact O-N 3.25Å; L454-F456 PolarHBondContact O-N 2.95Å
455	P	88	Confident	89.3	Confident	62 Å²	62	59.8 Å²	59.8	40%	0.403	33%	0.329	S	S	.	.			trans	-51.1	139.8	170.1	-25.4	34.7	0	0	0	112.5	L413 Y417 L457	L413-P455 HydrophobicContact CD2-CB 4.1Å; L413-P455 HydrophobicContact CD2-CG 4.11Å; Y417-P455 PolarHBondContact OH-O 3.35Å; P455-L457 HydrophobicContact CB-CD1 4.06Å; P455-L457 HydrophobicContact CB-CG 4.1Å; P455-L457 PolarHBondContact O-N 3.01Å
456	F	89.4	Confident	89.4	Confident	44 Å²	44	59 Å²	59	19%	0.193	33%	0.328	C	S	.	.	S	Bend	trans	-73.8	76.3	178.1	-162.2	-82.5	0	0	0	110.1	K416 Y417 E420 F446 L454 I458 Y461	K416-F456 HydrophobicContact CB-CB 3.89Å; K416-F456 HydrophobicContact CB-CD1 4.49Å; K416-F456 HydrophobicContact CB-CD2 3.72Å; K416-F456 HydrophobicContact CB-CE2 4.4Å; K416-F456 HydrophobicContact CB-CG 3.78Å; K416-F456 HydrophobicContact CD-CB 3.55Å; K416-F456 HydrophobicContact CD-CD1 4.42Å; K416-F456 HydrophobicContact CD-CG 4.05Å; K416-F456 HydrophobicContact CG-CB 4.33Å; Y417-F456 AromaticContact CD1-CD2 3.67Å; Y417-F456 HydrophobicContact CD1-CD2 3.67Å; Y417-F456 AromaticContact CD1-CE2 3.8Å; Y417-F456 HydrophobicContact CD1-CE2 3.8Å; Y417-F456 HydrophobicContact CD2-CD2 4.34Å; Y417-F456 AromaticContact CE1-CD2 3.4Å; Y417-F456 HydrophobicContact CE1-CD2 3.4Å; Y417-F456 VanDerWaalsContact CE1-CD2 3.4Å; Y417-F456 AromaticContact CE1-CE2 3.79Å; Y417-F456 HydrophobicContact CE1-CE2 3.79Å; Y417-F456 HydrophobicContact CE1-CG 4.48Å; Y417-F456 HydrophobicContact CE2-CB 4.48Å; Y417-F456 HydrophobicContact CE2-CD2 4.12Å; Y417-F456 HydrophobicContact CG-CD2 4.13Å; Y417-F456 HydrophobicContact CG-CE2 4.47Å; Y417-F456 AromaticContact CZ-CD2 3.63Å; E420-F456 HydrophobicContact CG-CZ 4.33Å; F446-F456 AromaticContact CD2-CE2 3.79Å; F446-F456 HydrophobicContact CD2-CE2 3.79Å; F446-F456 HydrophobicContact CD2-CZ 4.21Å; F446-F456 AromaticContact CE2-CE2 3.72Å; F446-F456 HydrophobicContact CE2-CE2 3.72Å; F446-F456 HydrophobicContact CE2-CZ 4.33Å; L454-F456 PolarHBondContact O-N 2.95Å; F456-I458 HydrophobicContact CD2-CD1 4.31Å; F456-I458 HydrophobicContact CE1-CD1 4.48Å; F456-I458 HydrophobicContact CE2-CD1 4.01Å; F456-I458 HydrophobicContact CZ-CD1 4.09Å; F456-Y461 HydrophobicContact CE1-CD1 4.01Å; F456-Y461 HydrophobicContact CE1-CE1 4.35Å; F456-Y461 HydrophobicContact CE1-CG 4.49Å; F456-Y461 AromaticContact CZ-CD1 3.75Å; F456-Y461 HydrophobicContact CZ-CD1 3.75Å; F456-Y461 AromaticContact CZ-CE1 3.7Å; F456-Y461 HydrophobicContact CZ-CE1 3.7Å; F456-Y461 HydrophobicContact CZ-CG 4.22Å
457	L	87.4	Confident	89.5	Confident	136 Å²	136	61.8 Å²	61.8	71%	0.712	34%	0.343	S	S	*	.			trans	-125.3	74.1	179.6	-63.4	175.7	0	0	0	107.7	P455	P455-L457 HydrophobicContact CB-CD1 4.06Å; P455-L457 HydrophobicContact CB-CG 4.1Å; P455-L457 PolarHBondContact O-N 3.01Å
458	I	88.6	Confident	89.5	Confident	22 Å²	22	64.9 Å²	64.9	11%	0.113	36%	0.357	C	S	.	.			trans	-111.5	112.3	-174.5	-56	167.3	0	0	0	108.7	Y417 S445 F446 F456 G460 Y461	Y417-I458 HydrophobicContact CE1-CD1 4.35Å; S445-I458 VanDerWaalsContact OG-CG2 3.28Å; S445-I458 WeakPolarHBondContact OG-CG2 3.42Å; F446-I458 HydrophobicContact CB-CD1 4.05Å; F446-I458 HydrophobicContact CD2-CD1 4.23Å; F456-I458 HydrophobicContact CD2-CD1 4.31Å; F456-I458 HydrophobicContact CE1-CD1 4.48Å; F456-I458 HydrophobicContact CE2-CD1 4.01Å; F456-I458 HydrophobicContact CZ-CD1 4.09Å; I458-G460 PolarHBondContact O-N 3.25Å; I458-Y461 HydrophobicContact CG2-CD2 4.4Å; I458-Y461 PolarHBondContact O-N 2.78Å
459	D	85.2	Confident	89.6	Confident	164 Å²	164	70.2 Å²	70.2	88%	0.877	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	130.9	178.4	-62.9	-36.3	0	0	0	111.1	Y461	D459-Y461 VanDerWaalsContact C-N 3.26Å; D459-Y461 PolarHBondContact O-N 3.04Å
460	G	84.5	Confident	89.7	Confident	82 Å²	82	74.9 Å²	74.9	85%	0.845	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	21.2	177.2	0	0	0	0	0	114.8	I458 E462	I458-G460 PolarHBondContact O-N 3.25Å; G460-E462 PolarHBondContact O-N 2.87Å
461	Y	91.1	Very high	89.8	Confident	39 Å²	39	75 Å²	75	15%	0.153	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-69.2	123.5	175.6	-177.7	-100.3	0	0	0	111.5	E420 P443 F446 F456 I458 D459	E420-Y461 WeakPolarHBondContact CB-OH 3.45Å; E420-Y461 HydrophobicContact CG-CE1 3.9Å; E420-Y461 WeakPolarHBondContact CG-OH 3.29Å; P443-Y461 HydrophobicContact CG-CD2 4.23Å; P443-Y461 HydrophobicContact CG-CE2 4.04Å; F446-Y461 HydrophobicContact CB-CD2 4.45Å; F446-Y461 HydrophobicContact CB-CE2 4.04Å; F446-Y461 HydrophobicContact CD2-CD2 4.36Å; F446-Y461 AromaticContact CD2-CE2 3.53Å; F446-Y461 HydrophobicContact CD2-CE2 3.53Å; F446-Y461 AromaticContact CD2-CZ 3.78Å; F446-Y461 HydrophobicContact CE2-CE2 4.33Å; F446-Y461 HydrophobicContact CG-CE2 4.09Å; F456-Y461 HydrophobicContact CE1-CD1 4.01Å; F456-Y461 HydrophobicContact CE1-CE1 4.35Å; F456-Y461 HydrophobicContact CE1-CG 4.49Å; F456-Y461 AromaticContact CZ-CD1 3.75Å; F456-Y461 HydrophobicContact CZ-CD1 3.75Å; F456-Y461 AromaticContact CZ-CE1 3.7Å; F456-Y461 HydrophobicContact CZ-CE1 3.7Å; F456-Y461 HydrophobicContact CZ-CG 4.22Å; I458-Y461 HydrophobicContact CG2-CD2 4.4Å; I458-Y461 PolarHBondContact O-N 2.78Å; D459-Y461 VanDerWaalsContact C-N 3.26Å; D459-Y461 PolarHBondContact O-N 3.04Å
462	E	90.9	Very high	90	Very high	166 Å²	166	82 Å²	82	78%	0.776	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-89.1	127.1	169.8	-65.6	-173.8	170.7	0	0	110.1	G460	G460-E462 PolarHBondContact O-N 2.87Å
463	E	91.3	Very high	90.4	Very high	113 Å²	113	79.8 Å²	79.8	53%	0.528	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-60.9	143.3	176.8	-68.5	-159.4	147.7	0	0	111.7	R419 R423	R419-E463 IonicContact CZ-OE1 2.87Å; R419-E463 IonicContact NH1-OE1 2.95Å; R419-E463 PolarHBondContact NH1-OE1 3.12Å; R419-E463 IonicContact NH2-OE1 3.94Å; R419-E463 IonicContact NH2-OE2 2.92Å; R423-E463 IonicContact CZ-OE2 2.87Å; R423-E463 IonicContact NH1-OE1 3.84Å; R423-E463 IonicContact NH1-OE2 3.44Å; R423-E463 PolarHBondContact NH1-OE2 2.8Å; R423-E463 IonicContact NH2-OE2 3.68Å; R423-E463 PolarHBondContact NH2-OE2 3Å
464	Q	93.6	Very high	90.7	Very high	26 Å²	26	78 Å²	78	12%	0.121	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-63.8	160.2	175.7	-63.7	-57.5	-63.7	0	0	111.4	E420 R423 G466	E420-Q464 HydrophobicContact CB-CG 4.2Å; E420-Q464 WeakPolarHBondContact O-CG 3.47Å; E420-Q464 PolarHBondContact OE2-N 2.87Å; R423-Q464 HydrophobicContact CB-CB 3.7Å; R423-Q464 PolarHBondContact NE-O 3.35Å; R423-Q464 PolarHBondContact NH2-O 3.4Å; Q464-G466 PolarHBondContact O-N 3.5Å
465	P	92.3	Very high	90.6	Very high	64 Å²	64	81 Å²	81	42%	0.416	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-52.9	136.6	177.9	-27	35.3	0	0	0	112.1	R423 A427	R423-P465 WeakPolarHBondContact CB-O 3.26Å; R423-P465 PolarHBondContact NE-O 3.49Å; A427-P465 HydrophobicContact CB-CB 4.16Å; A427-P465 HydrophobicContact CB-CG 4.27Å
466	G	91.9	Very high	90.5	Very high	30 Å²	30	83.7 Å²	83.7	31%	0.309	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-64.1	171.6	173.2	0	0	0	0	0	111.8	Q464 Q468	Q464-G466 PolarHBondContact O-N 3.5Å; G466-Q468 PolarHBondContact O-N 2.95Å; G466-Q468 VanDerWaalsContact O-N 3.13Å; G466-Q468 PolarHBondContact O-NE2 2.9Å
467	L	93.9	Very high	90.4	Very high	58 Å²	58	84.5 Å²	84.5	30%	0.304	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-59.8	118.1	175.8	-67	177.1	0	0	0	110.8	F387 Y388 I391 H426	F387-L467 HydrophobicContact CB-CD2 3.85Å; Y388-L467 HydrophobicContact CD2-CD1 3.92Å; I391-L467 HydrophobicContact CD1-CD1 4.1Å; I391-L467 HydrophobicContact CD1-CD2 3.64Å; I391-L467 HydrophobicContact CD1-CG 3.8Å; H426-L467 HydrophobicContact CB-CD2 3.84Å; H426-L467 WeakPolarHBondContact ND1-CD2 3.4Å
468	Q	91.9	Very high	90.4	Very high	70 Å²	70	82.7 Å²	82.7	33%	0.327	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-84.4	126.2	179.7	-60.1	-55.6	-53.2	0	0	111.5	H426 G466 H470 I471	H426-Q468 PolarHBondContact CE1-N 3.38Å; H426-Q468 PolarHBondContact CE1-O 3.48Å; G466-Q468 PolarHBondContact O-N 2.95Å; G466-Q468 VanDerWaalsContact O-N 3.13Å; G466-Q468 PolarHBondContact O-NE2 2.9Å; Q468-H470 VanDerWaalsContact CB-CE1 3.47Å; Q468-H470 WeakPolarHBondContact CB-CE1 3.42Å; Q468-H470 PolarHBondContact O-N 2.84Å; Q468-H470 VanDerWaalsContact O-N 3.1Å; Q468-I471 HydrophobicContact CB-CB 4.4Å; Q468-I471 HydrophobicContact CB-CD1 3.98Å; Q468-I471 HydrophobicContact CB-CG1 4.02Å; Q468-I471 HydrophobicContact CG-CD1 4.21Å; Q468-I471 PolarHBondContact O-N 2.9Å
469	P	90	Very high	90.5	Very high	126 Å²	126	82.1 Å²	82.1	82%	0.818	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-26.3	-176.8	-25.9	33.8	0	0	0	115
470	H	92.1	Very high	90.7	Very high	144 Å²	144	79.6 Å²	79.6	67%	0.667	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-20.3	-179.9	62	-89	0	0	0	113	Q468	Q468-H470 VanDerWaalsContact CB-CE1 3.47Å; Q468-H470 WeakPolarHBondContact CB-CE1 3.42Å; Q468-H470 PolarHBondContact O-N 2.84Å; Q468-H470 VanDerWaalsContact O-N 3.1Å
471	I	93.6	Very high	90.9	Very high	19 Å²	19	78.2 Å²	78.2	10%	0.097	41%	0.41	C	S	.	.	S	Bend	trans	-93.8	107.9	177	-54.7	177.3	0	0	0	108.5	H426 L429 Q468	H426-I471 PolarHBondContact CE1-O 3.02Å; H426-I471 PolarHBondContact NE2-O 2.89Å; H426-I471 WeakPolarHBondContact O-CG2 3.28Å; L429-I471 HydrophobicContact CB-CG2 3.94Å; L429-I471 HydrophobicContact CD2-CG2 4.08Å; Q468-I471 HydrophobicContact CB-CB 4.4Å; Q468-I471 HydrophobicContact CB-CD1 3.98Å; Q468-I471 HydrophobicContact CB-CG1 4.02Å; Q468-I471 HydrophobicContact CG-CD1 4.21Å; Q468-I471 PolarHBondContact O-N 2.9Å
472	K	93.4	Very high	91	Very high	161 Å²	161	77.8 Å²	77.8	70%	0.7	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-80.4	148.8	179.8	-64.8	-176.6	-179.7	178.7	0	111.3	L429 R828	L429-K472 WeakPolarHBondContact CD2-O 3.46Å; K472-R828 VanDerWaalsContact O-CZ 3.25Å; K472-R828 PolarHBondContact O-NH1 3.5Å; K472-R828 PolarHBondContact O-NH2 3.16Å
473	D	93.8	Very high	91.1	Very high	41 Å²	41	79 Å²	79	22%	0.219	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-57.8	159.5	170.3	-82	-8.5	0	0	0	111.8	G385 Q386 F387 Y388 L475 R828	G385-D473 WeakPolarHBondContact O-CB 3.26Å; Q386-D473 VanDerWaalsContact C-OD2 3.3Å; Q386-D473 WeakPolarHBondContact CA-OD2 3.11Å; F387-D473 PolarHBondContact N-OD1 3Å; F387-D473 PolarHBondContact N-OD2 3.41Å; F387-D473 VanDerWaalsContact N-OD2 3.16Å; Y388-D473 PolarHBondContact N-OD2 3.37Å; D473-L475 PolarHBondContact O-N 2.76Å; D473-R828 PolarHBondContact O-NH1 3.11Å
474	V	93.8	Very high	91.2	Very high	6 Å²	6	78.3 Å²	78.3	4%	0.036	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-67	130	178	179.2	0	0	0	0	109.9	G385 L429 R828 M831 E832	G385-V474 PolarHBondContact O-N 3.03Å; L429-V474 HydrophobicContact CD1-CG2 3.78Å; L429-V474 HydrophobicContact CD2-CG2 3.98Å; L429-V474 HydrophobicContact CG-CG2 4.36Å; V474-R828 HydrophobicContact CG2-CG 4.38Å; V474-M831 HydrophobicContact CG1-CB 4.23Å; V474-M831 HydrophobicContact CG2-CB 4.06Å; V474-M831 HydrophobicContact CG2-SD 4.02Å; V474-E832 HydrophobicContact CG1-CB 4.47Å; V474-E832 HydrophobicContact CG1-CG 3.45Å; V474-E832 VanDerWaalsContact CG1-CG 3.45Å
475	L	87	Confident	91.1	Very high	129 Å²	129	82.4 Å²	82.4	68%	0.675	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-88.3	153.2	178.2	-61.5	180	0	0	0	110.5	D473 Q477	D473-L475 PolarHBondContact O-N 2.76Å; L475-Q477 PolarHBondContact O-N 3.36Å
476	H	85.1	Confident	91.3	Very high	117 Å²	117	80 Å²	80	54%	0.542	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-70.5	125.7	173.4	-176.6	66.4	0	0	0	109.9	N478	H476-N478 PolarHBondContact CD2-OD1 3.16Å; H476-N478 PolarHBondContact NE2-OD1 3.37Å
477	Q	86.3	Confident	91.4	Very high	62 Å²	62	80.2 Å²	80.2	29%	0.29	41%	0.407	S	S	.	.			trans	-106.2	121.3	176.7	-172.3	60.8	26.7	0	0	109.9	L475 Y482 E832 T836	L475-Q477 PolarHBondContact O-N 3.36Å; Q477-Y482 HydrophobicContact CB-CE2 4.34Å; Q477-Y482 HydrophobicContact CG-CD2 4.28Å; Q477-Y482 HydrophobicContact CG-CE1 4.08Å; Q477-Y482 HydrophobicContact CG-CE2 3.5Å; Q477-Y482 VanDerWaalsContact CG-CE2 3.5Å; Q477-Y482 WeakPolarHBondContact CG-OH 3.41Å; Q477-E832 HydrophobicContact CB-CB 4.34Å; Q477-T836 PolarHBondContact O-OG1 3.41Å
478	N	88.5	Confident	91.3	Very high	98 Å²	98	81.1 Å²	81.1	52%	0.524	41%	0.41	S	S	.	.			trans	-72.8	144	174.7	-69.3	-24.3	0	0	0	110.3	H476 E480 G481	H476-N478 PolarHBondContact CD2-OD1 3.16Å; H476-N478 PolarHBondContact NE2-OD1 3.37Å; N478-E480 VanDerWaalsContact C-N 3.28Å; N478-E480 PolarHBondContact O-N 2.99Å; N478-G481 PolarHBondContact O-N 3.1Å
479	F	90.4	Very high	91.5	Very high	10 Å²	10	77.8 Å²	77.8	4%	0.044	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-58.1	-40.9	178.8	-176.8	-100.4	0	0	0	112.1	G481 Y482 Q487 I490 T836 R841	F479-G481 PolarHBondContact O-N 3.4Å; F479-Y482 PolarHBondContact O-N 3.27Å; F479-Q487 HydrophobicContact CD1-CG 4.4Å; F479-Q487 HydrophobicContact CE1-CB 3.97Å; F479-Q487 HydrophobicContact CE1-CG 3.95Å; F479-Q487 HydrophobicContact CE2-CB 4.19Å; F479-Q487 HydrophobicContact CE2-CG 4.36Å; F479-Q487 HydrophobicContact CZ-CB 3.59Å; F479-Q487 HydrophobicContact CZ-CG 3.94Å; F479-Q487 PolarHBondContact O-NE2 3.18Å; F479-I490 HydrophobicContact CD2-CD1 4.42Å; F479-I490 HydrophobicContact CD2-CG2 4.42Å; F479-I490 HydrophobicContact CE2-CB 4.08Å; F479-I490 HydrophobicContact CE2-CD1 4.27Å; F479-I490 HydrophobicContact CE2-CG2 3.89Å; F479-T836 HydrophobicContact CB-CG2 3.76Å; F479-T836 HydrophobicContact CD2-CG2 3.94Å; F479-T836 HydrophobicContact CG-CG2 4.37Å; F479-R841 HydrophobicContact CD1-CB 4.11Å; F479-R841 HydrophobicContact CD1-CG 4.07Å; F479-R841 HydrophobicContact CE1-CB 3.76Å; F479-R841 HydrophobicContact CE1-CG 4.18Å
480	E	89.2	Confident	91.8	Very high	111 Å²	111	71.8 Å²	71.8	52%	0.519	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-65.5	-17.7	176.9	-68.1	80.6	-175.7	0	0	113.8	N478 Y482 R841	N478-E480 VanDerWaalsContact C-N 3.28Å; N478-E480 PolarHBondContact O-N 2.99Å; E480-Y482 VanDerWaalsContact C-N 3.28Å; E480-Y482 PolarHBondContact O-N 3.18Å; E480-R841 IonicContact OE1-CZ 2.83Å; E480-R841 IonicContact OE1-NE 3.63Å; E480-R841 PolarHBondContact OE1-NE 3.44Å; E480-R841 IonicContact OE1-NH2 2.83Å
481	G	89.4	Confident	91.9	Very high	53 Å²	53	65.5 Å²	65.5	55%	0.546	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-75.2	-15.9	177.9	0	0	0	0	0	113.8	N478 F479	N478-G481 PolarHBondContact O-N 3.1Å; F479-G481 PolarHBondContact O-N 3.4Å
482	Y	92.9	Very high	91.9	Very high	30 Å²	30	65.1 Å²	65.1	12%	0.118	33%	0.326	C	S	.	.	S	Bend	trans	-80.7	152.1	175.9	-68.6	-75.9	0	0	0	111.7	Q477 F479 E480 V486 Q487 I490 F824 V833 T836	Q477-Y482 HydrophobicContact CB-CE2 4.34Å; Q477-Y482 HydrophobicContact CG-CD2 4.28Å; Q477-Y482 HydrophobicContact CG-CE1 4.08Å; Q477-Y482 HydrophobicContact CG-CE2 3.5Å; Q477-Y482 VanDerWaalsContact CG-CE2 3.5Å; Q477-Y482 WeakPolarHBondContact CG-OH 3.41Å; F479-Y482 PolarHBondContact O-N 3.27Å; E480-Y482 VanDerWaalsContact C-N 3.28Å; E480-Y482 PolarHBondContact O-N 3.18Å; Y482-V486 HydrophobicContact CD1-CB 4.47Å; Y482-V486 HydrophobicContact CD1-CG1 3.64Å; Y482-V486 HydrophobicContact CE1-CG1 4.36Å; Y482-V486 HydrophobicContact CG-CG1 4.02Å; Y482-Q487 PolarHBondContact O-NE2 3.47Å; Y482-I490 HydrophobicContact CD2-CD1 3.89Å; Y482-I490 HydrophobicContact CE2-CD1 4.03Å; Y482-I490 HydrophobicContact CG-CD1 4.2Å; Y482-F824 HydrophobicContact CE1-CE1 4.27Å; Y482-V833 WeakPolarHBondContact OH-CA 3.44Å; Y482-V833 PolarHBondContact OH-N 3.34Å; Y482-T836 HydrophobicContact CE2-CG2 3.92Å; Y482-T836 WeakPolarHBondContact CE2-OG1 3.5Å; Y482-T836 PolarHBondContact OH-OG1 2.93Å
483	R	93.8	Very high	92	Very high	190 Å²	190	57.4 Å²	57.4	72%	0.717	29%	0.293	S	S	*	.			trans	-59.9	149.4	170.4	-63.7	-178.2	-176	174.4	2.2	110.4	E485 V486 Q487	R483-E485 PolarHBondContact O-N 3.37Å; R483-E485 VanDerWaalsContact O-N 3.14Å; R483-V486 HydrophobicContact CB-CG2 4.36Å; R483-V486 PolarHBondContact O-N 3.26Å; R483-Q487 PolarHBondContact O-N 2.73Å
484	P	92.2	Very high	92.1	Very high	99 Å²	99	56.8 Å²	56.8	64%	0.643	29%	0.289	S	S	*	.	H	α-helix	trans	-52.8	-38.5	-178	-28.8	35.7	0	0	0	114.5	V486 Q487 E488	P484-V486 VanDerWaalsContact C-N 3.35Å; P484-V486 PolarHBondContact O-N 3.32Å; P484-Q487 WeakPolarHBondContact O-CB 3.33Å; P484-Q487 PolarHBondContact O-N 3.35Å; P484-E488 PolarHBondContact O-N 3.03Å
485	E	92.8	Very high	92	Very high	113 Å²	113	59.8 Å²	59.8	53%	0.528	30%	0.3	S	S	.	.	H	α-helix	trans	-63.9	-38	177	-63.5	162.1	-169.2	0	0	112.5	R483 E488 M489 P818	R483-E485 PolarHBondContact O-N 3.37Å; R483-E485 VanDerWaalsContact O-N 3.14Å; E485-E488 PolarHBondContact O-N 3.11Å; E485-M489 PolarHBondContact O-N 3.16Å; E485-P818 HydrophobicContact CB-CG 4.35Å
486	V	94.8	Very high	92.4	Very high	12 Å²	12	53.7 Å²	53.7	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-74.8	-37.2	177.3	178.7	0	0	0	0	110.5	Y482 R483 P484 E488 M489 I490 P818 T823 F824	Y482-V486 HydrophobicContact CD1-CB 4.47Å; Y482-V486 HydrophobicContact CD1-CG1 3.64Å; Y482-V486 HydrophobicContact CE1-CG1 4.36Å; Y482-V486 HydrophobicContact CG-CG1 4.02Å; R483-V486 HydrophobicContact CB-CG2 4.36Å; R483-V486 PolarHBondContact O-N 3.26Å; P484-V486 VanDerWaalsContact C-N 3.35Å; P484-V486 PolarHBondContact O-N 3.32Å; V486-E488 VanDerWaalsContact C-N 3.31Å; V486-E488 PolarHBondContact O-N 3.4Å; V486-M489 HydrophobicContact CB-CE 4.46Å; V486-M489 HydrophobicContact CG1-CE 3.94Å; V486-M489 HydrophobicContact CG2-CE 4.49Å; V486-M489 WeakPolarHBondContact O-CB 3.36Å; V486-M489 PolarHBondContact O-N 2.88Å; V486-I490 HydrophobicContact CG1-CD1 4.14Å; V486-I490 VanDerWaalsContact O-CG1 3.28Å; V486-I490 WeakPolarHBondContact O-CG1 3.29Å; V486-I490 PolarHBondContact O-N 3.07Å; V486-P818 HydrophobicContact CG2-CG 4.2Å; V486-T823 HydrophobicContact CG1-CG2 4.03Å; V486-T823 HydrophobicContact CG2-CG2 3.78Å; V486-F824 HydrophobicContact CG1-CZ 3.99Å
487	Q	94.1	Very high	92.9	Very high	36 Å²	36	48.1 Å²	48.1	17%	0.168	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-43	172.1	-67	178.6	15.8	0	0	111.3	F479 Y482 R483 P484 I490 C491	F479-Q487 HydrophobicContact CD1-CG 4.4Å; F479-Q487 HydrophobicContact CE1-CB 3.97Å; F479-Q487 HydrophobicContact CE1-CG 3.95Å; F479-Q487 HydrophobicContact CE2-CB 4.19Å; F479-Q487 HydrophobicContact CE2-CG 4.36Å; F479-Q487 HydrophobicContact CZ-CB 3.59Å; F479-Q487 HydrophobicContact CZ-CG 3.94Å; F479-Q487 PolarHBondContact O-NE2 3.18Å; Y482-Q487 PolarHBondContact O-NE2 3.47Å; R483-Q487 PolarHBondContact O-N 2.73Å; P484-Q487 WeakPolarHBondContact O-CB 3.33Å; P484-Q487 PolarHBondContact O-N 3.35Å; Q487-I490 PolarHBondContact O-N 2.93Å; Q487-C491 PolarHBondContact O-N 2.93Å; Q487-C491 VanDerWaalsContact O-N 3.07Å; Q487-C491 PolarHBondContact O-SG 3.26Å; Q487-C491 VanDerWaalsContact O-SG 3.35Å
488	E	93	Very high	93.2	Very high	77 Å²	77	47.2 Å²	47.2	36%	0.36	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-46.5	174.6	-174.3	175.9	177.5	0	0	111.4	P484 E485 V486 I490 C491 V492 L817	P484-E488 PolarHBondContact O-N 3.03Å; E485-E488 PolarHBondContact O-N 3.11Å; V486-E488 VanDerWaalsContact C-N 3.31Å; V486-E488 PolarHBondContact O-N 3.4Å; E488-I490 VanDerWaalsContact C-N 3.31Å; E488-I490 PolarHBondContact O-N 3Å; E488-C491 PolarHBondContact O-N 2.89Å; E488-C491 VanDerWaalsContact O-N 3.15Å; E488-V492 HydrophobicContact CG-CG2 4.44Å; E488-V492 WeakPolarHBondContact O-CG2 3.46Å; E488-V492 PolarHBondContact O-N 3.25Å; E488-L817 HydrophobicContact CB-CD2 4.49Å; E488-L817 HydrophobicContact CG-CD2 4.11Å
489	M	95.4	Very high	93.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.4	-42.8	175.4	-177.3	177.4	56.9	0	0	112.4	E485 V486 V492 A493 L519 L522 L817 P818 V820 T823 F824	E485-M489 PolarHBondContact O-N 3.16Å; V486-M489 HydrophobicContact CB-CE 4.46Å; V486-M489 HydrophobicContact CG1-CE 3.94Å; V486-M489 HydrophobicContact CG2-CE 4.49Å; V486-M489 WeakPolarHBondContact O-CB 3.36Å; V486-M489 PolarHBondContact O-N 2.88Å; M489-V492 PolarHBondContact O-N 3.4Å; M489-A493 WeakPolarHBondContact O-CB 3.45Å; M489-A493 PolarHBondContact O-N 2.85Å; M489-L519 HydrophobicContact CG-CD2 4.34Å; M489-L522 HydrophobicContact CG-CD1 3.92Å; M489-L817 HydrophobicContact CB-CD2 4.2Å; M489-P818 HydrophobicContact CE-CG 4.08Å; M489-P818 HydrophobicContact SD-CG 4.03Å; M489-V820 HydrophobicContact SD-CG2 3.73Å; M489-T823 HydrophobicContact CE-CG2 3.83Å; M489-F824 HydrophobicContact CE-CD2 4.41Å; M489-F824 HydrophobicContact CE-CE2 3.41Å; M489-F824 VanDerWaalsContact CE-CE2 3.41Å; M489-F824 HydrophobicContact CE-CZ 3.77Å
490	I	95.7	Very high	93.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-46.5	176.3	-68.1	164.2	0	0	0	110.6	F479 Y482 V486 Q487 E488 V492 A493 D494 V833	F479-I490 HydrophobicContact CD2-CD1 4.42Å; F479-I490 HydrophobicContact CD2-CG2 4.42Å; F479-I490 HydrophobicContact CE2-CB 4.08Å; F479-I490 HydrophobicContact CE2-CD1 4.27Å; F479-I490 HydrophobicContact CE2-CG2 3.89Å; Y482-I490 HydrophobicContact CD2-CD1 3.89Å; Y482-I490 HydrophobicContact CE2-CD1 4.03Å; Y482-I490 HydrophobicContact CG-CD1 4.2Å; V486-I490 HydrophobicContact CG1-CD1 4.14Å; V486-I490 VanDerWaalsContact O-CG1 3.28Å; V486-I490 WeakPolarHBondContact O-CG1 3.29Å; V486-I490 PolarHBondContact O-N 3.07Å; Q487-I490 PolarHBondContact O-N 2.93Å; E488-I490 VanDerWaalsContact C-N 3.31Å; E488-I490 PolarHBondContact O-N 3Å; I490-V492 VanDerWaalsContact C-N 3.33Å; I490-V492 PolarHBondContact O-N 3.45Å; I490-A493 WeakPolarHBondContact O-CB 3.44Å; I490-A493 PolarHBondContact O-N 2.86Å; I490-D494 VanDerWaalsContact O-CG 3.32Å; I490-D494 PolarHBondContact O-N 3.5Å; I490-V833 HydrophobicContact CD1-CG2 3.82Å; I490-V833 HydrophobicContact CG1-CG2 3.72Å
491	C	94	Very high	93.8	Very high	11 Å²	11	40 Å²	40	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-63.7	-38.8	178.5	-65.1	0	0	0	0	112.7	Q487 E488 D494 R495 C842	Q487-C491 PolarHBondContact O-N 2.93Å; Q487-C491 VanDerWaalsContact O-N 3.07Å; Q487-C491 PolarHBondContact O-SG 3.26Å; Q487-C491 VanDerWaalsContact O-SG 3.35Å; E488-C491 PolarHBondContact O-N 2.89Å; E488-C491 VanDerWaalsContact O-N 3.15Å; C491-D494 PolarHBondContact O-N 2.9Å; C491-R495 PolarHBondContact O-N 3.31Å; C491-C842 WeakPolarHBondContact CA-SG 3.3Å; C491-C842 HydrophobicContact CB-CB 3.7Å; C491-C842 WeakPolarHBondContact CB-SG 3.36Å; C491-C842 WeakPolarHBondContact SG-CA 3.34Å; C491-C842 WeakPolarHBondContact SG-CB 3.48Å; C491-C842 CovalentContact SG-SG 2.04Å; C491-C842 PolarHBondContact SG-SG 3.47Å
492	V	93.9	Very high	94	Very high	11 Å²	11	38.5 Å²	38.5	7%	0.067	19%	0.185	C	C	.	.	H	α-helix	trans	-65.1	-42.8	175.3	171.9	0	0	0	0	110.6	E488 M489 I490 R495 L496 L522 Y814 L817	E488-V492 HydrophobicContact CG-CG2 4.44Å; E488-V492 WeakPolarHBondContact O-CG2 3.46Å; E488-V492 PolarHBondContact O-N 3.25Å; M489-V492 PolarHBondContact O-N 3.4Å; I490-V492 VanDerWaalsContact C-N 3.33Å; I490-V492 PolarHBondContact O-N 3.45Å; V492-R495 PolarHBondContact O-N 3.47Å; V492-L496 HydrophobicContact CG1-CD1 3.97Å; V492-L496 HydrophobicContact CG1-CG 4.35Å; V492-L496 WeakPolarHBondContact O-CG 3.45Å; V492-L496 PolarHBondContact O-N 3.42Å; V492-L522 HydrophobicContact CG1-CD1 4.23Å; V492-L522 HydrophobicContact CG1-CD2 4.15Å; V492-Y814 HydrophobicContact CG1-CD1 4.26Å; V492-Y814 HydrophobicContact CG1-CE1 3.42Å; V492-Y814 VanDerWaalsContact CG1-CE1 3.42Å; V492-L817 HydrophobicContact CG1-CD1 4.27Å
493	A	95.9	Very high	93.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-46.6	175.8	0	0	0	0	0	111.9	M489 I490 R495 L496 G497 G518 L519 L522	M489-A493 WeakPolarHBondContact O-CB 3.45Å; M489-A493 PolarHBondContact O-N 2.85Å; I490-A493 WeakPolarHBondContact O-CB 3.44Å; I490-A493 PolarHBondContact O-N 2.86Å; A493-R495 VanDerWaalsContact C-N 3.3Å; A493-R495 PolarHBondContact O-N 2.92Å; A493-L496 PolarHBondContact O-N 3.35Å; A493-G497 PolarHBondContact O-N 2.98Å; A493-G518 WeakPolarHBondContact O-CA 3.25Å; A493-L519 HydrophobicContact CB-CB 4.5Å; A493-L519 HydrophobicContact CB-CD2 3.81Å; A493-L519 HydrophobicContact CB-CG 3.72Å; A493-L522 HydrophobicContact CB-CD1 4.21Å
494	D	95	Very high	93.6	Very high	27 Å²	27	32.6 Å²	32.6	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-58.5	-43.3	177	-68.7	-23.2	0	0	0	111.3	I490 C491 S498 R515 S838	I490-D494 VanDerWaalsContact O-CG 3.32Å; I490-D494 PolarHBondContact O-N 3.5Å; C491-D494 PolarHBondContact O-N 2.9Å; D494-S498 WeakPolarHBondContact O-CB 3.48Å; D494-S498 PolarHBondContact O-N 2.94Å; D494-R515 WeakPolarHBondContact OD1-CB 3.26Å; D494-R515 VanDerWaalsContact OD1-CG 3.31Å; D494-R515 WeakPolarHBondContact OD1-CG 3.45Å; D494-R515 IonicContact OD1-CZ 3.54Å; D494-R515 IonicContact OD1-NE 2.69Å; D494-R515 PolarHBondContact OD1-NE 2.96Å; D494-R515 IonicContact OD1-NH2 3.56Å; D494-R515 IonicContact OD2-NE 2.73Å; D494-R515 IonicContact OD2-NH2 3.54Å; D494-S838 WeakPolarHBondContact OD2-CB 3.42Å; D494-S838 PolarHBondContact OD2-OG 2.67Å
495	R	93	Very high	93.4	Very high	70 Å²	70	29.8 Å²	29.8	26%	0.264	15%	0.149	S	C	.	.	H	α-helix	trans	-60.5	-54.6	174.9	-174.7	-178.2	84.8	-139.8	12.1	111.7	C491 V492 A493 G497 S498 L499 E773 Y814 L846	C491-R495 PolarHBondContact O-N 3.31Å; V492-R495 PolarHBondContact O-N 3.47Å; A493-R495 VanDerWaalsContact C-N 3.3Å; A493-R495 PolarHBondContact O-N 2.92Å; R495-G497 VanDerWaalsContact C-N 3.3Å; R495-G497 PolarHBondContact O-N 2.65Å; R495-S498 PolarHBondContact O-N 3.29Å; R495-S498 VanDerWaalsContact O-N 3.14Å; R495-S498 PolarHBondContact O-OG 3.29Å; R495-L499 PolarHBondContact O-N 3.48Å; R495-E773 IonicContact CZ-OE1 3.85Å; R495-E773 IonicContact NH2-OE1 2.68Å; R495-E773 PolarHBondContact NH2-OE1 3.02Å; R495-Y814 PolarHBondContact NH2-OH 2.77Å; R495-L846 HydrophobicContact CB-CD1 4Å; R495-L846 HydrophobicContact CG-CD1 4.39Å; R495-L846 HydrophobicContact CG-CD2 4.46Å
496	L	94.4	Very high	93.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.5	-44.5	-178.1	-73.1	174.3	0	0	0	111.2	V492 A493 S498 L499 M500 L522 V764 M768 Y814	V492-L496 HydrophobicContact CG1-CD1 3.97Å; V492-L496 HydrophobicContact CG1-CG 4.35Å; V492-L496 WeakPolarHBondContact O-CG 3.45Å; V492-L496 PolarHBondContact O-N 3.42Å; A493-L496 PolarHBondContact O-N 3.35Å; L496-S498 VanDerWaalsContact C-N 3.33Å; L496-S498 PolarHBondContact O-N 2.99Å; L496-L499 WeakPolarHBondContact O-CB 3.49Å; L496-L499 PolarHBondContact O-N 2.72Å; L496-M500 WeakPolarHBondContact O-CG 3.34Å; L496-L522 HydrophobicContact CD1-CD2 3.78Å; L496-L522 HydrophobicContact CD1-CG 3.98Å; L496-V764 HydrophobicContact CD2-CG1 4.26Å; L496-M768 HydrophobicContact CD1-CE 4.01Å; L496-M768 HydrophobicContact CD1-SD 4.01Å; L496-M768 HydrophobicContact CD2-SD 4.13Å; L496-Y814 HydrophobicContact CD1-CE1 4.38Å
497	G	95.2	Very high	92.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-39.9	176.2	0	0	0	0	0	113.5	A493 R495 L499 M500 H514	A493-G497 PolarHBondContact O-N 2.98Å; R495-G497 VanDerWaalsContact C-N 3.3Å; R495-G497 PolarHBondContact O-N 2.65Å; G497-L499 PolarHBondContact O-N 2.95Å; G497-M500 WeakPolarHBondContact O-CB 3.44Å; G497-M500 PolarHBondContact O-N 3.17Å; G497-H514 VanDerWaalsContact CA-O 3.24Å; G497-H514 WeakPolarHBondContact CA-O 3.25Å; G497-H514 PolarHBondContact O-CD2 3.29Å
498	S	93.8	Very high	92.7	Very high	44 Å²	44	26.2 Å²	26.2	31%	0.308	13%	0.134	S	C	.	.	H	α-helix	trans	-63.8	-27.1	178.2	78.3	0	0	0	0	113.5	D494 R495 L496 M500 Q501	D494-S498 WeakPolarHBondContact O-CB 3.48Å; D494-S498 PolarHBondContact O-N 2.94Å; R495-S498 PolarHBondContact O-N 3.29Å; R495-S498 VanDerWaalsContact O-N 3.14Å; R495-S498 PolarHBondContact O-OG 3.29Å; L496-S498 VanDerWaalsContact C-N 3.33Å; L496-S498 PolarHBondContact O-N 2.99Å; S498-M500 PolarHBondContact O-N 3.29Å; S498-Q501 WeakPolarHBondContact O-CB 3.41Å; S498-Q501 PolarHBondContact O-N 2.88Å
499	L	93.8	Very high	92.6	Very high	20 Å²	20	24.3 Å²	24.3	11%	0.105	13%	0.128	C	C	.	.	H	α-helix	trans	-70.1	-21.5	174.5	-60.6	176.7	0	0	0	112.4	R495 L496 G497 Q501 V774 K777	R495-L499 PolarHBondContact O-N 3.48Å; L496-L499 WeakPolarHBondContact O-CB 3.49Å; L496-L499 PolarHBondContact O-N 2.72Å; G497-L499 PolarHBondContact O-N 2.95Å; L499-Q501 VanDerWaalsContact C-N 3.33Å; L499-V774 VanDerWaalsContact CD1-O 3.28Å; L499-V774 WeakPolarHBondContact CD1-O 3.49Å; L499-K777 HydrophobicContact CD2-CG 3.67Å
500	M	94.1	Very high	92.5	Very high	12 Å²	12	25.1 Å²	25.1	6%	0.059	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	1.5	179.4	-44.9	-177.5	-173.5	0	0	112.8	L496 G497 S498 M517 A521 Y760 V764	L496-M500 WeakPolarHBondContact O-CG 3.34Å; G497-M500 WeakPolarHBondContact O-CB 3.44Å; G497-M500 PolarHBondContact O-N 3.17Å; S498-M500 PolarHBondContact O-N 3.29Å; M500-M517 HydrophobicContact SD-CB 3.81Å; M500-A521 HydrophobicContact CE-CB 3.86Å; M500-Y760 HydrophobicContact CB-CD1 3.8Å; M500-Y760 HydrophobicContact CB-CE1 4.14Å; M500-Y760 HydrophobicContact CG-CD1 3.62Å; M500-Y760 HydrophobicContact CG-CE1 3.88Å; M500-Y760 HydrophobicContact SD-CD1 4.25Å; M500-V764 HydrophobicContact CE-CB 3.89Å; M500-V764 HydrophobicContact CE-CG1 4.03Å; M500-V764 HydrophobicContact CE-CG2 3.88Å
501	Q	93.1	Very high	92.4	Very high	36 Å²	36	29.2 Å²	29.2	17%	0.168	15%	0.15	C	C	.	.			trans	-70.2	130.5	178.8	178.4	58	42.8	0	0	111	S498 L499 E503 H514	S498-Q501 WeakPolarHBondContact O-CB 3.41Å; S498-Q501 PolarHBondContact O-N 2.88Å; L499-Q501 VanDerWaalsContact C-N 3.33Å; Q501-E503 PolarHBondContact O-N 2.95Å; Q501-H514 PolarHBondContact OE1-NE2 2.97Å
502	Y	93	Very high	92.4	Very high	21 Å²	21	29.1 Å²	29.1	8%	0.082	15%	0.148	C	C	.	.			trans	-75	122.9	167.1	-69.2	-45.7	0	0	0	111.1	T504 F507 S756 I778 L783 V784	Y502-T504 PolarHBondContact O-N 3.21Å; Y502-F507 AromaticContact CD2-CD1 3.94Å; Y502-F507 HydrophobicContact CD2-CD1 3.94Å; Y502-F507 AromaticContact CD2-CE1 3.69Å; Y502-F507 HydrophobicContact CD2-CE1 3.69Å; Y502-F507 HydrophobicContact CD2-CG 4.46Å; Y502-F507 AromaticContact CD2-CZ 3.99Å; Y502-F507 HydrophobicContact CD2-CZ 3.99Å; Y502-F507 HydrophobicContact CE2-CE1 4.39Å; Y502-S756 PolarHBondContact OH-OG 2.96Å; Y502-I778 HydrophobicContact CD1-CD1 3.84Å; Y502-I778 HydrophobicContact CD1-CG2 4.05Å; Y502-I778 HydrophobicContact CE1-CD1 3.66Å; Y502-I778 HydrophobicContact CE1-CG2 4.22Å; Y502-L783 HydrophobicContact CD1-CD2 3.8Å; Y502-L783 HydrophobicContact CD2-CD2 3.72Å; Y502-L783 HydrophobicContact CE1-CD2 3.99Å; Y502-L783 HydrophobicContact CE2-CD2 3.91Å; Y502-L783 HydrophobicContact CG-CD2 3.67Å; Y502-V784 HydrophobicContact CE1-CG2 4.11Å; Y502-V784 PolarHBondContact OH-N 2.93Å
503	E	90	Very high	92.4	Very high	86 Å²	86	30 Å²	30	40%	0.402	15%	0.152	S	C	.	.			trans	-94	66.5	171.9	-66.5	-173.5	-175.6	0	0	109.8	Q501 K777 K780 G781	Q501-E503 PolarHBondContact O-N 2.95Å; E503-K777 IonicContact OE1-NZ 3.67Å; E503-K780 HydrophobicContact CB-CB 4.39Å; E503-K780 HydrophobicContact CB-CG 4.47Å; E503-K780 WeakPolarHBondContact O-CA 3.39Å; E503-K780 VanDerWaalsContact O-CG 3.31Å; E503-K780 WeakPolarHBondContact O-CG 3.49Å; E503-G781 PolarHBondContact O-N 3.33Å
504	T	89	Confident	92.4	Very high	10 Å²	10	31.1 Å²	31.1	6%	0.061	16%	0.157	C	C	.	.	S	Bend	trans	-143.5	152.4	178.3	-165.5	0	0	0	0	110.2	Y502 G506 F507 L783	Y502-T504 PolarHBondContact O-N 3.21Å; T504-G506 PolarHBondContact O-N 3.03Å; T504-F507 HydrophobicContact CG2-CD2 3.25Å; T504-F507 HydrophobicContact CG2-CE2 3.47Å; T504-F507 VanDerWaalsContact CG2-CE2 3.47Å; T504-F507 HydrophobicContact CG2-CG 4.33Å; T504-F507 PolarHBondContact O-N 2.96Å; T504-L783 HydrophobicContact CG2-CD2 3.85Å
505	P	88.3	Confident	92.5	Very high	40 Å²	40	30.4 Å²	30.4	26%	0.26	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	142.9	176.3	-27.2	36.7	0	0	0	111.8	E315 L316 M597 R598	E315-P505 CarbonylContact O-C 3.45Å; L316-P505 HydrophobicContact CD1-CB 4.33Å; L316-P505 HydrophobicContact CD1-CG 4.04Å; P505-M597 HydrophobicContact CB-CB 4.31Å; P505-M597 HydrophobicContact CB-CG 3.85Å; P505-R598 VanDerWaalsContact O-CG 3.24Å; P505-R598 WeakPolarHBondContact O-CG 3.38Å
506	G	85.8	Confident	92.7	Very high	9 Å²	9	27 Å²	27	9%	0.093	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	-1	179	0	0	0	0	0	114.3	E315 T504 R598	E315-G506 VanDerWaalsContact O-CA 3.29Å; E315-G506 WeakPolarHBondContact O-CA 3.17Å; E315-G506 PolarHBondContact O-N 2.8Å; T504-G506 PolarHBondContact O-N 3.03Å; G506-R598 PolarHBondContact O-NE 3.1Å; G506-R598 VanDerWaalsContact O-NE 3.16Å; G506-R598 PolarHBondContact O-NH2 2.66Å
507	F	89.6	Confident	92.9	Very high	52 Å²	52	27.1 Å²	27.1	23%	0.228	14%	0.14	C	C	.	.			trans	-118.5	110.6	175.9	-64.4	-93.2	0	0	0	110.7	Y502 T504 R598 L783	Y502-F507 AromaticContact CD2-CD1 3.94Å; Y502-F507 HydrophobicContact CD2-CD1 3.94Å; Y502-F507 AromaticContact CD2-CE1 3.69Å; Y502-F507 HydrophobicContact CD2-CE1 3.69Å; Y502-F507 HydrophobicContact CD2-CG 4.46Å; Y502-F507 AromaticContact CD2-CZ 3.99Å; Y502-F507 HydrophobicContact CD2-CZ 3.99Å; Y502-F507 HydrophobicContact CE2-CE1 4.39Å; T504-F507 HydrophobicContact CG2-CD2 3.25Å; T504-F507 HydrophobicContact CG2-CE2 3.47Å; T504-F507 VanDerWaalsContact CG2-CE2 3.47Å; T504-F507 HydrophobicContact CG2-CG 4.33Å; T504-F507 PolarHBondContact O-N 2.96Å; F507-R598 HydrophobicContact CD2-CG 4.2Å; F507-R598 HydrophobicContact CE2-CB 3.97Å; F507-R598 HydrophobicContact CE2-CG 3.7Å; F507-R598 HydrophobicContact CZ-CG 4.44Å; F507-L783 HydrophobicContact CE2-CD2 3.9Å; F507-L783 HydrophobicContact CZ-CD2 4.01Å
508	L	90.6	Very high	93	Very high	25 Å²	25	27.1 Å²	27.1	13%	0.131	14%	0.14	C	C	.	.			trans	-85.2	138.7	171.7	-163.7	72.8	0	0	0	109.4	F319 M346 H349 H350 N510	F319-L508 HydrophobicContact CB-CD1 3.9Å; F319-L508 HydrophobicContact CD2-CD1 4.17Å; F319-L508 HydrophobicContact CD2-CD2 4.24Å; F319-L508 HydrophobicContact CD2-CG 4.49Å; M346-L508 HydrophobicContact CG-CD2 3.88Å; M346-L508 WeakPolarHBondContact O-CD2 3.11Å; H349-L508 HydrophobicContact CB-CD2 4.16Å; H350-L508 HydrophobicContact CB-CD2 4.04Å; L508-N510 PolarHBondContact O-N 3.45Å
509	P	91.8	Very high	93.2	Very high	37 Å²	37	25 Å²	25	24%	0.24	13%	0.126	C	C	.	.			trans	-61.2	131.1	172.8	24.5	-33.2	0	0	0	110.3	H350	H350-P509 WeakPolarHBondContact CA-O 3.26Å; H350-P509 PolarHBondContact ND1-O 3.02Å
510	N	92.8	Very high	93.4	Very high	16 Å²	16	24.1 Å²	24.1	9%	0.086	12%	0.121	C	C	.	.			trans	-122.7	106.2	-179.9	-175.3	-43	0	0	0	110.4	H349 H350 L508 R512 I513 H514	H349-N510 WeakPolarHBondContact O-CB 3.44Å; H349-N510 PolarHBondContact O-ND2 3.45Å; H350-N510 WeakPolarHBondContact O-CA 3.31Å; L508-N510 PolarHBondContact O-N 3.45Å; N510-R512 VanDerWaalsContact C-N 3.27Å; N510-R512 PolarHBondContact O-N 2.81Å; N510-R512 WeakPolarHBondContact OD1-CA 3.37Å; N510-R512 WeakPolarHBondContact OD1-CB 3.47Å; N510-R512 PolarHBondContact OD1-N 2.96Å; N510-I513 HydrophobicContact CB-CB 4.04Å; N510-I513 HydrophobicContact CB-CD1 4.04Å; N510-I513 HydrophobicContact CB-CG1 4.16Å; N510-I513 PolarHBondContact O-N 3.21Å; N510-I513 PolarHBondContact OD1-N 2.97Å; N510-H514 PolarHBondContact O-CD2 3.43Å; N510-H514 PolarHBondContact O-N 3.35Å; N510-H514 PolarHBondContact O-ND1 3.42Å
511	K	92.4	Very high	93.6	Very high	87 Å²	87	23.5 Å²	23.5	38%	0.378	12%	0.118	S	C	.	.	H	α-helix	trans	-61.1	-36.5	-176.2	-63.7	177.5	179.2	172.9	0	112.5	H350 H514 R515	H350-K511 VanDerWaalsContact NE2-CE 3.31Å; H350-K511 WeakPolarHBondContact NE2-CE 3.39Å; H350-K511 PolarHBondContact O-N 2.93Å; K511-H514 PolarHBondContact O-N 3.35Å; K511-R515 PolarHBondContact O-N 3.45Å
512	R	94.4	Very high	93.8	Very high	9 Å²	9	21.9 Å²	21.9	3%	0.034	11%	0.11	C	C	.	.	H	α-helix	trans	-69.3	-41.6	-179.4	-169.3	169.6	-174.6	-88.6	-10.1	111.3	A383 N510 A516 I561 A562 L834 N835	A383-R512 PolarHBondContact O-NH2 2.74Å; N510-R512 VanDerWaalsContact C-N 3.27Å; N510-R512 PolarHBondContact O-N 2.81Å; N510-R512 WeakPolarHBondContact OD1-CA 3.37Å; N510-R512 WeakPolarHBondContact OD1-CB 3.47Å; N510-R512 PolarHBondContact OD1-N 2.96Å; R512-A516 WeakPolarHBondContact O-CB 3.2Å; R512-A516 PolarHBondContact O-N 3.36Å; R512-A516 VanDerWaalsContact O-N 3.07Å; R512-I561 VanDerWaalsContact CZ-O 3.32Å; R512-I561 PolarHBondContact NH1-O 2.95Å; R512-I561 PolarHBondContact NH2-O 2.8Å; R512-A562 PolarHBondContact NH1-O 3.24Å; R512-L834 HydrophobicContact CG-CB 4.16Å; R512-N835 PolarHBondContact NE-OD1 3.34Å
513	I	95.3	Very high	94	Very high	28 Å²	28	22.3 Å²	22.3	14%	0.144	11%	0.113	C	C	.	.	H	α-helix	trans	-68.5	-40.7	174.2	-65.7	176.1	0	0	0	110.6	N510 R515 A516 M517 A562	N510-I513 HydrophobicContact CB-CB 4.04Å; N510-I513 HydrophobicContact CB-CD1 4.04Å; N510-I513 HydrophobicContact CB-CG1 4.16Å; N510-I513 PolarHBondContact O-N 3.21Å; N510-I513 PolarHBondContact OD1-N 2.97Å; I513-R515 PolarHBondContact O-N 3Å; I513-A516 PolarHBondContact O-N 3.14Å; I513-M517 HydrophobicContact CG2-CG 3.93Å; I513-M517 WeakPolarHBondContact O-CB 3.3Å; I513-M517 VanDerWaalsContact O-CG 3.26Å; I513-M517 WeakPolarHBondContact O-CG 3.5Å; I513-M517 PolarHBondContact O-N 3.45Å; I513-A562 HydrophobicContact CG1-CB 4.24Å
514	H	95.7	Very high	94.3	Very high	25 Å²	25	18.2 Å²	18.2	12%	0.116	9%	0.094	C	C	.	.	H	α-helix	trans	-55	-52.8	175.1	-64.8	162.4	0	0	0	110.6	G497 Q501 N510 K511 A516 M517 G518	G497-H514 VanDerWaalsContact CA-O 3.24Å; G497-H514 WeakPolarHBondContact CA-O 3.25Å; G497-H514 PolarHBondContact O-CD2 3.29Å; Q501-H514 PolarHBondContact OE1-NE2 2.97Å; N510-H514 PolarHBondContact O-CD2 3.43Å; N510-H514 PolarHBondContact O-N 3.35Å; N510-H514 PolarHBondContact O-ND1 3.42Å; K511-H514 PolarHBondContact O-N 3.35Å; H514-A516 VanDerWaalsContact C-N 3.35Å; H514-A516 PolarHBondContact O-N 3.21Å; H514-M517 PolarHBondContact O-N 3.44Å; H514-G518 PolarHBondContact O-N 2.95Å
515	R	96.6	Very high	94.7	Very high	11 Å²	11	18.5 Å²	18.5	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-57.3	-48	177.4	-169.4	172.1	-60.2	143.1	3.4	112.5	D494 K511 I513 M517 G518 L519 V833 L834 T836 S838	D494-R515 WeakPolarHBondContact OD1-CB 3.26Å; D494-R515 VanDerWaalsContact OD1-CG 3.31Å; D494-R515 WeakPolarHBondContact OD1-CG 3.45Å; D494-R515 IonicContact OD1-CZ 3.54Å; D494-R515 IonicContact OD1-NE 2.69Å; D494-R515 PolarHBondContact OD1-NE 2.96Å; D494-R515 IonicContact OD1-NH2 3.56Å; D494-R515 IonicContact OD2-NE 2.73Å; D494-R515 IonicContact OD2-NH2 3.54Å; K511-R515 PolarHBondContact O-N 3.45Å; I513-R515 PolarHBondContact O-N 3Å; R515-M517 VanDerWaalsContact C-N 3.32Å; R515-M517 PolarHBondContact O-N 3.48Å; R515-G518 PolarHBondContact O-N 3.19Å; R515-L519 HydrophobicContact CG-CD1 3.91Å; R515-L519 HydrophobicContact CG-CG 4.32Å; R515-L519 WeakPolarHBondContact O-CB 3.41Å; R515-L519 WeakPolarHBondContact O-CG 3.24Å; R515-L519 PolarHBondContact O-N 3.34Å; R515-V833 VanDerWaalsContact CD-O 3.31Å; R515-V833 WeakPolarHBondContact CD-O 3.45Å; R515-V833 PolarHBondContact NH1-O 2.86Å; R515-L834 HydrophobicContact CB-CD2 4.24Å; R515-L834 HydrophobicContact CG-CD2 4.32Å; R515-L834 PolarHBondContact NH1-O 3.11Å; R515-T836 VanDerWaalsContact CZ-O 3.23Å; R515-T836 PolarHBondContact NH1-O 3.46Å; R515-T836 PolarHBondContact NH2-O 3.13Å; R515-S838 PolarHBondContact NH2-OG 2.65Å
516	A	97.6	Very high	95	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.8	-45.3	-179.6	0	0	0	0	0	112	R512 I513 H514 L519 A520 W558 A562 L834	R512-A516 WeakPolarHBondContact O-CB 3.2Å; R512-A516 PolarHBondContact O-N 3.36Å; R512-A516 VanDerWaalsContact O-N 3.07Å; I513-A516 PolarHBondContact O-N 3.14Å; H514-A516 VanDerWaalsContact C-N 3.35Å; H514-A516 PolarHBondContact O-N 3.21Å; A516-L519 PolarHBondContact O-N 3.39Å; A516-A520 VanDerWaalsContact O-CB 3.31Å; A516-A520 WeakPolarHBondContact O-CB 3.47Å; A516-A520 PolarHBondContact O-N 3.2Å; A516-W558 HydrophobicContact CB-CB 4.29Å; A516-W558 HydrophobicContact CB-CE3 4.41Å; A516-A562 HydrophobicContact CB-CB 3.53Å; A516-L834 HydrophobicContact CB-CD2 3.64Å
517	M	97.8	Very high	95.3	Very high	2 Å²	2	18 Å²	18	1%	0.01	9%	0.089	C	C	.	.	H	α-helix	trans	-77.4	-27.1	-177.1	-60.6	-64	90.8	0	0	112.7	M500 I513 H514 R515 A520 A521 W558 R559 V757 S761	M500-M517 HydrophobicContact SD-CB 3.81Å; I513-M517 HydrophobicContact CG2-CG 3.93Å; I513-M517 WeakPolarHBondContact O-CB 3.3Å; I513-M517 VanDerWaalsContact O-CG 3.26Å; I513-M517 WeakPolarHBondContact O-CG 3.5Å; I513-M517 PolarHBondContact O-N 3.45Å; H514-M517 PolarHBondContact O-N 3.44Å; R515-M517 VanDerWaalsContact C-N 3.32Å; R515-M517 PolarHBondContact O-N 3.48Å; M517-A520 HydrophobicContact CE-CB 4.31Å; M517-A521 WeakPolarHBondContact O-CB 3.49Å; M517-A521 PolarHBondContact O-N 3.16Å; M517-W558 HydrophobicContact CE-CB 3.77Å; M517-R559 HydrophobicContact CE-CB 3.61Å; M517-R559 HydrophobicContact SD-CB 4.18Å; M517-V757 HydrophobicContact CB-CG2 4.44Å; M517-V757 HydrophobicContact CG-CG2 3.67Å; M517-V757 HydrophobicContact SD-CG1 4.13Å; M517-V757 HydrophobicContact SD-CG2 3.98Å; M517-S761 PolarHBondContact O-OG 3.04Å
518	G	97.6	Very high	95.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-69.1	-45.1	168.5	0	0	0	0	0	112.9	A493 H514 R515 A520 A521 L522	A493-G518 WeakPolarHBondContact O-CA 3.25Å; H514-G518 PolarHBondContact O-N 2.95Å; R515-G518 PolarHBondContact O-N 3.19Å; G518-A520 VanDerWaalsContact C-N 3.34Å; G518-A521 PolarHBondContact O-N 3.38Å; G518-L522 WeakPolarHBondContact O-CG 3.39Å; G518-L522 PolarHBondContact O-N 3.48Å
519	L	98.3	Very high	95.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.7	-42.2	174	-73.5	171.4	0	0	0	111	M489 A493 R515 A516 A521 L522 E523 W558 V820 F824 V833	M489-L519 HydrophobicContact CG-CD2 4.34Å; A493-L519 HydrophobicContact CB-CB 4.5Å; A493-L519 HydrophobicContact CB-CD2 3.81Å; A493-L519 HydrophobicContact CB-CG 3.72Å; R515-L519 HydrophobicContact CG-CD1 3.91Å; R515-L519 HydrophobicContact CG-CG 4.32Å; R515-L519 WeakPolarHBondContact O-CB 3.41Å; R515-L519 WeakPolarHBondContact O-CG 3.24Å; R515-L519 PolarHBondContact O-N 3.34Å; A516-L519 PolarHBondContact O-N 3.39Å; L519-A521 PolarHBondContact O-N 2.94Å; L519-L522 PolarHBondContact O-N 3.28Å; L519-E523 WeakPolarHBondContact O-CB 3.2Å; L519-E523 PolarHBondContact O-N 2.91Å; L519-W558 HydrophobicContact CB-CD2 4.17Å; L519-W558 HydrophobicContact CB-CE3 4.38Å; L519-W558 HydrophobicContact CB-CH2 4.23Å; L519-W558 HydrophobicContact CB-CZ2 3.99Å; L519-W558 HydrophobicContact CB-CZ3 4.41Å; L519-W558 HydrophobicContact CD1-CE3 4.26Å; L519-W558 HydrophobicContact CD1-CH2 3.57Å; L519-W558 HydrophobicContact CD1-CZ2 4.16Å; L519-W558 HydrophobicContact CD1-CZ3 3.62Å; L519-W558 HydrophobicContact CG-CH2 4.47Å; L519-V820 HydrophobicContact CD2-CG1 4.41Å; L519-F824 HydrophobicContact CD2-CE2 4.06Å; L519-V833 HydrophobicContact CD1-CG1 3.84Å; L519-V833 HydrophobicContact CD1-CG2 4.11Å
520	A	98.1	Very high	95.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.5	-44.7	172.8	0	0	0	0	0	112.3	A516 M517 G518 L522 E523 V524 A555 W558 S761	A516-A520 VanDerWaalsContact O-CB 3.31Å; A516-A520 WeakPolarHBondContact O-CB 3.47Å; A516-A520 PolarHBondContact O-N 3.2Å; M517-A520 HydrophobicContact CE-CB 4.31Å; G518-A520 VanDerWaalsContact C-N 3.34Å; A520-L522 PolarHBondContact O-N 2.89Å; A520-E523 PolarHBondContact O-N 2.95Å; A520-V524 WeakPolarHBondContact O-CB 3.49Å; A520-V524 VanDerWaalsContact O-CG2 3.25Å; A520-V524 WeakPolarHBondContact O-CG2 3.27Å; A520-V524 PolarHBondContact O-N 2.97Å; A520-A555 HydrophobicContact CB-CB 4Å; A520-W558 HydrophobicContact CB-CB 4.02Å; A520-W558 HydrophobicContact CB-CG 4.02Å; A520-S761 WeakPolarHBondContact CB-OG 3.5Å
521	A	98	Very high	95.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.9	-40.9	178	0	0	0	0	0	112	M500 M517 G518 L519 M525 S761 V764 G765	M500-A521 HydrophobicContact CE-CB 3.86Å; M517-A521 WeakPolarHBondContact O-CB 3.49Å; M517-A521 PolarHBondContact O-N 3.16Å; G518-A521 PolarHBondContact O-N 3.38Å; L519-A521 PolarHBondContact O-N 2.94Å; A521-M525 WeakPolarHBondContact O-CB 3.43Å; A521-M525 PolarHBondContact O-N 2.95Å; A521-S761 PolarHBondContact N-OG 2.89Å; A521-V764 HydrophobicContact CB-CB 4.24Å; A521-V764 HydrophobicContact CB-CG1 4.03Å; A521-G765 WeakPolarHBondContact O-CA 3.43Å
522	L	97.6	Very high	95.2	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-64.1	-41.5	174.5	-69.9	176.2	0	0	0	112	M489 V492 A493 L496 G518 L519 A520 M525 Q526 M768 Y814 L817 V820	M489-L522 HydrophobicContact CG-CD1 3.92Å; V492-L522 HydrophobicContact CG1-CD1 4.23Å; V492-L522 HydrophobicContact CG1-CD2 4.15Å; A493-L522 HydrophobicContact CB-CD1 4.21Å; L496-L522 HydrophobicContact CD1-CD2 3.78Å; L496-L522 HydrophobicContact CD1-CG 3.98Å; G518-L522 WeakPolarHBondContact O-CG 3.39Å; G518-L522 PolarHBondContact O-N 3.48Å; L519-L522 PolarHBondContact O-N 3.28Å; A520-L522 PolarHBondContact O-N 2.89Å; L522-M525 HydrophobicContact CD2-CE 4.29Å; L522-M525 WeakPolarHBondContact O-CB 3.31Å; L522-M525 PolarHBondContact O-N 3.38Å; L522-Q526 VanDerWaalsContact O-CG 3.27Å; L522-Q526 WeakPolarHBondContact O-CG 3.48Å; L522-Q526 PolarHBondContact O-N 3.41Å; L522-M768 HydrophobicContact CD2-CE 4.02Å; L522-Y814 HydrophobicContact CD2-CD1 4.03Å; L522-Y814 HydrophobicContact CD2-CE1 4.03Å; L522-L817 HydrophobicContact CD1-CD1 4.45Å; L522-L817 HydrophobicContact CD2-CD1 4.1Å; L522-V820 HydrophobicContact CB-CG2 3.78Å
523	E	96.9	Very high	94.9	Very high	30 Å²	30	19.9 Å²	19.9	14%	0.14	10%	0.097	C	C	.	.	H	α-helix	trans	-68.4	-41.7	178.2	-169.3	177.1	169.3	0	0	111.7	L519 A520 M525 Q526 A527 I554 W558 V820	L519-E523 WeakPolarHBondContact O-CB 3.2Å; L519-E523 PolarHBondContact O-N 2.91Å; A520-E523 PolarHBondContact O-N 2.95Å; E523-M525 VanDerWaalsContact C-N 3.35Å; E523-Q526 PolarHBondContact O-N 3.3Å; E523-A527 VanDerWaalsContact O-CB 3.3Å; E523-A527 WeakPolarHBondContact O-CB 3.46Å; E523-A527 PolarHBondContact O-N 3.45Å; E523-I554 HydrophobicContact CB-CG2 3.69Å; E523-I554 VanDerWaalsContact CD-CG2 3.49Å; E523-I554 HydrophobicContact CG-CG2 3.63Å; E523-W558 PolarHBondContact OE2-NE1 3.17Å; E523-V820 HydrophobicContact CB-CB 3.89Å; E523-V820 HydrophobicContact CB-CG1 3.96Å; E523-V820 HydrophobicContact CB-CG2 4.29Å; E523-V820 HydrophobicContact CG-CB 4.2Å; E523-V820 HydrophobicContact CG-CG1 4.37Å
524	V	97	Very high	94.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60	-45.6	172.4	168.6	0	0	0	0	110.3	A520 Q526 A527 V528 M551 I554 V762	A520-V524 WeakPolarHBondContact O-CB 3.49Å; A520-V524 VanDerWaalsContact O-CG2 3.25Å; A520-V524 WeakPolarHBondContact O-CG2 3.27Å; A520-V524 PolarHBondContact O-N 2.97Å; V524-Q526 VanDerWaalsContact C-N 3.34Å; V524-Q526 PolarHBondContact O-N 3Å; V524-A527 PolarHBondContact O-N 3.45Å; V524-V528 HydrophobicContact CG1-CG2 4.02Å; V524-V528 WeakPolarHBondContact O-CB 3.4Å; V524-V528 VanDerWaalsContact O-CG2 3.23Å; V524-V528 WeakPolarHBondContact O-CG2 3.35Å; V524-V528 PolarHBondContact O-N 3.41Å; V524-M551 HydrophobicContact CG1-CG 3.93Å; V524-M551 HydrophobicContact CG1-SD 4.4Å; V524-I554 HydrophobicContact CG2-CB 4.04Å; V524-I554 HydrophobicContact CG2-CD1 4.32Å; V524-I554 HydrophobicContact CG2-CG2 3.89Å; V524-V762 HydrophobicContact CG1-CG1 4.5Å; V524-V762 HydrophobicContact CG2-CG2 4.32Å
525	M	95.8	Very high	92.8	Very high	16 Å²	16	25.1 Å²	25.1	8%	0.079	13%	0.131	C	C	.	.	H	α-helix	trans	-54.7	-51.2	175.1	175.4	-161.1	70.1	0	0	110.9	A521 L522 E523 H529 G765 M768 A769 I810	A521-M525 WeakPolarHBondContact O-CB 3.43Å; A521-M525 PolarHBondContact O-N 2.95Å; L522-M525 HydrophobicContact CD2-CE 4.29Å; L522-M525 WeakPolarHBondContact O-CB 3.31Å; L522-M525 PolarHBondContact O-N 3.38Å; E523-M525 VanDerWaalsContact C-N 3.35Å; M525-H529 WeakPolarHBondContact O-CB 3.29Å; M525-H529 PolarHBondContact O-N 2.91Å; M525-G765 VanDerWaalsContact CA-O 3.26Å; M525-G765 WeakPolarHBondContact CA-O 3.45Å; M525-G765 WeakPolarHBondContact CB-O 3.13Å; M525-M768 HydrophobicContact CB-CB 4.13Å; M525-M768 HydrophobicContact CG-CB 3.72Å; M525-M768 HydrophobicContact SD-CB 3.8Å; M525-M768 HydrophobicContact SD-CE 3.73Å; M525-A769 HydrophobicContact CG-CB 4.4Å; M525-I810 HydrophobicContact SD-CD1 4.22Å
526	Q	94.3	Very high	91.6	Very high	19 Å²	19	31.5 Å²	31.5	9%	0.089	16%	0.159	C	C	.	.	H	α-helix	trans	-63.4	-42.1	-179.6	-70.5	171.3	-9.2	0	0	111.8	L522 E523 V524 R530 P818	L522-Q526 VanDerWaalsContact O-CG 3.27Å; L522-Q526 WeakPolarHBondContact O-CG 3.48Å; L522-Q526 PolarHBondContact O-N 3.41Å; E523-Q526 PolarHBondContact O-N 3.3Å; V524-Q526 VanDerWaalsContact C-N 3.34Å; V524-Q526 PolarHBondContact O-N 3Å; Q526-R530 VanDerWaalsContact O-CB 3.32Å; Q526-R530 WeakPolarHBondContact O-CB 3.5Å; Q526-R530 WeakPolarHBondContact O-CD 3.23Å; Q526-R530 WeakPolarHBondContact O-CG 3.47Å; Q526-R530 PolarHBondContact O-N 3.29Å; Q526-P818 PolarHBondContact NE2-O 3.23Å
527	A	93	Very high	90.2	Very high	19 Å²	19	33.2 Å²	33.2	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-67.9	-44.6	179.8	0	0	0	0	0	112.7	E523 V524 R530 T531 M546 I554	E523-A527 VanDerWaalsContact O-CB 3.3Å; E523-A527 WeakPolarHBondContact O-CB 3.46Å; E523-A527 PolarHBondContact O-N 3.45Å; V524-A527 PolarHBondContact O-N 3.45Å; A527-R530 PolarHBondContact O-N 3.42Å; A527-T531 WeakPolarHBondContact O-CB 3.35Å; A527-T531 PolarHBondContact O-N 3.02Å; A527-T531 PolarHBondContact O-OG1 2.71Å; A527-M546 HydrophobicContact CB-SD 4.22Å; A527-I554 HydrophobicContact CB-CD1 3.67Å
528	V	93.4	Very high	88.6	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-46.6	177.6	173.6	0	0	0	0	110.4	V524 R530 T531 W532 M546 M551 A769	V524-V528 HydrophobicContact CG1-CG2 4.02Å; V524-V528 WeakPolarHBondContact O-CB 3.4Å; V524-V528 VanDerWaalsContact O-CG2 3.23Å; V524-V528 WeakPolarHBondContact O-CG2 3.35Å; V524-V528 PolarHBondContact O-N 3.41Å; V528-R530 VanDerWaalsContact C-N 3.34Å; V528-R530 PolarHBondContact O-N 3.12Å; V528-T531 WeakPolarHBondContact O-CB 3.32Å; V528-T531 PolarHBondContact O-N 3.49Å; V528-W532 HydrophobicContact CG1-CD2 3.81Å; V528-W532 HydrophobicContact CG1-CE3 4.18Å; V528-W532 HydrophobicContact CG1-CG 4.49Å; V528-W532 HydrophobicContact CG1-CH2 3.73Å; V528-W532 HydrophobicContact CG1-CZ2 3.31Å; V528-W532 HydrophobicContact CG1-CZ3 4.14Å; V528-W532 PolarHBondContact O-N 2.87Å; V528-M546 HydrophobicContact CG2-CE 3.97Å; V528-M551 HydrophobicContact CG2-CG 4.1Å; V528-M551 HydrophobicContact CG2-SD 3.61Å; V528-A769 HydrophobicContact CB-CB 3.81Å; V528-A769 HydrophobicContact CG1-CB 3.62Å
529	H	91.5	Very high	87	Confident	89 Å²	89	44.4 Å²	44.4	41%	0.412	21%	0.214	S	C	.	.	H	α-helix	trans	-60.2	-42.9	177.1	-174.1	71.8	0	0	0	112.1	M525 T531 W532 T533 A769	M525-H529 WeakPolarHBondContact O-CB 3.29Å; M525-H529 PolarHBondContact O-N 2.91Å; H529-T531 VanDerWaalsContact C-N 3.32Å; H529-T531 PolarHBondContact O-N 3Å; H529-W532 PolarHBondContact O-N 3.36Å; H529-T533 WeakPolarHBondContact O-CB 3.41Å; H529-T533 PolarHBondContact O-N 3.48Å; H529-T533 PolarHBondContact O-OG1 3.32Å; H529-A769 HydrophobicContact CB-CB 4.27Å
530	R	89.8	Confident	85.1	Confident	93 Å²	93	49.5 Å²	49.5	35%	0.351	24%	0.241	S	C	.	.	H	α-helix	trans	-60.6	-39.5	172.6	-76.6	171.6	-169.7	169.1	5.8	112.1	Q526 A527 V528 T533 N534 S819	Q526-R530 VanDerWaalsContact O-CB 3.32Å; Q526-R530 WeakPolarHBondContact O-CB 3.5Å; Q526-R530 WeakPolarHBondContact O-CD 3.23Å; Q526-R530 WeakPolarHBondContact O-CG 3.47Å; Q526-R530 PolarHBondContact O-N 3.29Å; A527-R530 PolarHBondContact O-N 3.42Å; V528-R530 VanDerWaalsContact C-N 3.34Å; V528-R530 PolarHBondContact O-N 3.12Å; R530-T533 PolarHBondContact O-N 2.92Å; R530-N534 WeakPolarHBondContact O-CA 3.34Å; R530-N534 WeakPolarHBondContact O-CB 3.32Å; R530-N534 PolarHBondContact O-N 3.11Å; R530-S819 VanDerWaalsContact NH2-CB 3.31Å; R530-S819 PolarHBondContact NH2-OG 3.38Å
531	T	90.1	Very high	83.4	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-69.1	-38.6	-179.6	-59.1	0	0	0	0	112.4	A527 V528 H529 N534 V537 M546	A527-T531 WeakPolarHBondContact O-CB 3.35Å; A527-T531 PolarHBondContact O-N 3.02Å; A527-T531 PolarHBondContact O-OG1 2.71Å; V528-T531 WeakPolarHBondContact O-CB 3.32Å; V528-T531 PolarHBondContact O-N 3.49Å; H529-T531 VanDerWaalsContact C-N 3.32Å; H529-T531 PolarHBondContact O-N 3Å; T531-N534 CarbonylContact C-O 3.51Å; T531-N534 CarbonylContact O-C 3.53Å; T531-N534 VanDerWaalsContact O-O 3.05Å; T531-V537 WeakPolarHBondContact OG1-CG2 3.43Å; T531-M546 HydrophobicContact CG2-CB 4.03Å; T531-M546 HydrophobicContact CG2-CE 4.27Å; T531-M546 WeakPolarHBondContact OG1-CE 3.28Å; T531-M546 PolarHBondContact OG1-SD 3.42Å
532	W	90.4	Very high	81.9	Confident	10 Å²	10	59.5 Å²	59.5	4%	0.038	30%	0.299	C	S	.	.	H	α-helix	trans	-73.3	-31	176.1	-64.5	-12.1	0	0	0	112	V528 H529 L715 K720 I723 V734 A769	V528-W532 HydrophobicContact CG1-CD2 3.81Å; V528-W532 HydrophobicContact CG1-CE3 4.18Å; V528-W532 HydrophobicContact CG1-CG 4.49Å; V528-W532 HydrophobicContact CG1-CH2 3.73Å; V528-W532 HydrophobicContact CG1-CZ2 3.31Å; V528-W532 HydrophobicContact CG1-CZ3 4.14Å; V528-W532 PolarHBondContact O-N 2.87Å; H529-W532 PolarHBondContact O-N 3.36Å; W532-L715 HydrophobicContact CZ2-CD1 3.98Å; W532-L715 HydrophobicContact CZ2-CG 4.24Å; W532-K720 WeakPolarHBondContact O-CG 3.3Å; W532-I723 HydrophobicContact CB-CD1 3.3Å; W532-I723 HydrophobicContact CB-CG1 4.13Å; W532-I723 HydrophobicContact CE3-CD1 4.32Å; W532-I723 HydrophobicContact CE3-CG1 4.48Å; W532-I723 HydrophobicContact CG-CD1 4.43Å; W532-V734 HydrophobicContact CH2-CG1 3.77Å; W532-V734 HydrophobicContact CZ2-CG1 4.34Å; W532-V734 HydrophobicContact CZ3-CG1 4.48Å; W532-A769 HydrophobicContact CE3-CB 4.47Å; W532-A769 HydrophobicContact CH2-CB 4.28Å; W532-A769 HydrophobicContact CZ3-CB 3.97Å
533	T	87.4	Confident	80.8	Confident	70 Å²	70	63.9 Å²	63.9	43%	0.429	33%	0.326	S	S	.	.	H	α-helix	trans	-78.5	-51.8	175.9	-52.9	0	0	0	0	111.5	H529 R530 I723	H529-T533 WeakPolarHBondContact O-CB 3.41Å; H529-T533 PolarHBondContact O-N 3.48Å; H529-T533 PolarHBondContact O-OG1 3.32Å; R530-T533 PolarHBondContact O-N 2.92Å; T533-I723 WeakPolarHBondContact OG1-CD1 3.27Å
534	N	79.1	Confident	80.2	Confident	100 Å²	100	68 Å²	68	54%	0.535	34%	0.341	S	S	.	.	S	Bend	trans	-109.2	109.2	-176.5	-63.4	-35.5	0	0	0	108.1	R530 T531 K536	R530-N534 WeakPolarHBondContact O-CA 3.34Å; R530-N534 WeakPolarHBondContact O-CB 3.32Å; R530-N534 PolarHBondContact O-N 3.11Å; T531-N534 CarbonylContact C-O 3.51Å; T531-N534 CarbonylContact O-C 3.53Å; T531-N534 VanDerWaalsContact O-O 3.05Å; N534-K536 PolarHBondContact O-N 2.97Å
535	S	68.5	Low	79.5	Confident	63 Å²	63	72.5 Å²	72.5	44%	0.441	36%	0.364	S	S	.	.	S	Bend	trans	-59.7	-4	-174.7	-74.5	0	0	0	0	115.5	L545 K720	S535-L545 WeakPolarHBondContact O-CD2 3.38Å; S535-K720 PolarHBondContact OG-NZ 2.98Å
536	K	70.4	Confident	79.2	Confident	145 Å²	145	72 Å²	72	63%	0.63	36%	0.362	S	S	*	.			trans	-139.1	140	173.6	-57.4	-177.3	-178	177.7	0	110.3	N534 T543	N534-K536 PolarHBondContact O-N 2.97Å; K536-T543 HydrophobicContact CB-CG2 3.48Å; K536-T543 VanDerWaalsContact CB-CG2 3.48Å; K536-T543 HydrophobicContact CD-CG2 3.9Å; K536-T543 HydrophobicContact CG-CG2 4.3Å
537	V	68.2	Low	79.1	Confident	35 Å²	35	74.8 Å²	74.8	21%	0.212	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.3	178.1	-175.6	0	0	0	0	108.9	T531 M539 T543 R544 M546	T531-V537 WeakPolarHBondContact OG1-CG2 3.43Å; V537-M539 HydrophobicContact CG1-CG 4.04Å; V537-T543 WeakPolarHBondContact O-CA 3.47Å; V537-R544 PolarHBondContact N-O 2.87Å; V537-R544 PolarHBondContact O-N 2.75Å; V537-M546 HydrophobicContact CG2-CB 4.33Å
538	R	65.1	Low	79.1	Confident	192 Å²	192	74.3 Å²	74.3	73%	0.725	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	112.4	173.3	-165.9	177	-173.6	-173.5	-2.6	108.9	G541 K542	R538-G541 PolarHBondContact NE-O 2.68Å; R538-K542 WeakPolarHBondContact CA-O 3.28Å
539	M	63.3	Low	79.1	Confident	46 Å²	46	76.7 Å²	76.7	23%	0.227	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.4	176	-58.2	-163.2	93.6	0	0	109.2	V537 G541 K542 M546 D550	V537-M539 HydrophobicContact CG1-CG 4.04Å; M539-G541 PolarHBondContact O-N 2.81Å; M539-K542 PolarHBondContact N-O 3.11Å; M539-K542 PolarHBondContact O-N 3.25Å; M539-M546 HydrophobicContact SD-CG 4.42Å; M539-D550 HydrophobicContact CE-CB 3.83Å; M539-D550 HydrophobicContact SD-CB 3.74Å
540	N	58.7	Low	79.1	Confident	106 Å²	106	73.5 Å²	73.5	57%	0.567	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	44.5	-177.5	-55.6	8.1	0	0	0	112.2	T434 K542	T434-N540 VanDerWaalsContact O-CG 3.25Å; T434-N540 PolarHBondContact O-OD1 3.44Å; N540-K542 PolarHBondContact O-N 3.15Å; N540-K542 VanDerWaalsContact O-N 3.1Å
541	G	62.4	Low	79.3	Confident	51 Å²	51	69.2 Å²	69.2	53%	0.526	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	-12.9	-178.8	0	0	0	0	0	115.9	R538 M539	R538-G541 PolarHBondContact NE-O 2.68Å; M539-G541 PolarHBondContact O-N 2.81Å
542	K	68.1	Low	79.6	Confident	159 Å²	159	69.1 Å²	69.1	69%	0.691	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.6	-178.9	-66.1	179.5	-178.6	175.3	0	111.9	R538 M539 N540 R544	R538-K542 WeakPolarHBondContact CA-O 3.28Å; M539-K542 PolarHBondContact N-O 3.11Å; M539-K542 PolarHBondContact O-N 3.25Å; N540-K542 PolarHBondContact O-N 3.15Å; N540-K542 VanDerWaalsContact O-N 3.1Å; K542-R544 PolarHBondContact O-N 2.84Å
543	T	74.5	Confident	79.7	Confident	94 Å²	94	70 Å²	70	58%	0.577	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	105.6	176.4	-56.9	0	0	0	0	109.7	K536 V537	K536-T543 HydrophobicContact CB-CG2 3.48Å; K536-T543 VanDerWaalsContact CB-CG2 3.48Å; K536-T543 HydrophobicContact CD-CG2 3.9Å; K536-T543 HydrophobicContact CG-CG2 4.3Å; V537-T543 WeakPolarHBondContact O-CA 3.47Å
544	R	83.9	Confident	80.1	Confident	117 Å²	117	67.3 Å²	67.3	44%	0.442	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	168.8	179.8	71.7	173.9	-170.8	174.8	0.2	112.3	V537 K542 D550	V537-R544 PolarHBondContact N-O 2.87Å; V537-R544 PolarHBondContact O-N 2.75Å; K542-R544 PolarHBondContact O-N 2.84Å; R544-D550 IonicContact CZ-OD1 3.97Å; R544-D550 IonicContact CZ-OD2 3.71Å; R544-D550 IonicContact NE-OD2 2.8Å; R544-D550 IonicContact NH2-OD1 3.67Å; R544-D550 PolarHBondContact NH2-OD1 3.39Å; R544-D550 IonicContact NH2-OD2 2.85Å; R544-D550 PolarHBondContact NH2-OD2 2.84Å
545	L	82.4	Confident	80.9	Confident	93 Å²	93	62.6 Å²	62.6	49%	0.487	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-70.3	128.5	168.2	-75.7	162.1	0	0	0	109	S535 Q547	S535-L545 WeakPolarHBondContact O-CD2 3.38Å; L545-Q547 PolarHBondContact O-N 3.3Å; L545-Q547 PolarHBondContact O-NE2 3.33Å
546	M	88.6	Confident	82.2	Confident	7 Å²	7	59.6 Å²	59.6	3%	0.034	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-61.4	127.2	172.9	-174	177.2	80.5	0	0	109.1	A527 V528 T531 V537 M539 D550 M551 Y712	A527-M546 HydrophobicContact CB-SD 4.22Å; V528-M546 HydrophobicContact CG2-CE 3.97Å; T531-M546 HydrophobicContact CG2-CB 4.03Å; T531-M546 HydrophobicContact CG2-CE 4.27Å; T531-M546 WeakPolarHBondContact OG1-CE 3.28Å; T531-M546 PolarHBondContact OG1-SD 3.42Å; V537-M546 HydrophobicContact CG2-CB 4.33Å; M539-M546 HydrophobicContact SD-CG 4.42Å; M546-D550 HydrophobicContact CG-CB 3.72Å; M546-M551 HydrophobicContact CE-CB 4.2Å; M546-Y712 WeakPolarHBondContact CE-OH 3.4Å; M546-Y712 WeakPolarHBondContact O-CE1 3.42Å; M546-Y712 PolarHBondContact O-OH 2.97Å
547	Q	91.9	Very high	83.4	Confident	77 Å²	77	54.6 Å²	54.6	36%	0.36	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-89.2	165.2	174.1	-56.3	-55.6	-61.1	0	0	110.7	L545 R549 D550 M551	L545-Q547 PolarHBondContact O-N 3.3Å; L545-Q547 PolarHBondContact O-NE2 3.33Å; Q547-R549 PolarHBondContact O-N 3.45Å; Q547-D550 PolarHBondContact N-OD2 3.4Å; Q547-D550 WeakPolarHBondContact O-CB 3.09Å; Q547-D550 PolarHBondContact O-N 2.77Å; Q547-M551 PolarHBondContact O-N 3.31Å
548	W	94.1	Very high	84.7	Confident	9 Å²	9	53 Å²	53	3%	0.034	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-38.2	174.2	68.5	-93.4	0	0	0	111.2	D550 M551 F552 W570 H705 I708 D709 Y712 F745	W548-D550 VanDerWaalsContact C-N 3.3Å; W548-D550 PolarHBondContact O-N 2.91Å; W548-M551 VanDerWaalsContact O-CB 3.31Å; W548-M551 WeakPolarHBondContact O-CB 3.23Å; W548-M551 PolarHBondContact O-N 3.14Å; W548-M551 VanDerWaalsContact O-N 3.08Å; W548-F552 AromaticContact CE3-CD2 3.94Å; W548-F552 HydrophobicContact CE3-CD2 3.94Å; W548-F552 HydrophobicContact CE3-CE2 4.32Å; W548-F552 WeakPolarHBondContact O-CD2 3.46Å; W548-F552 PolarHBondContact O-N 3.27Å; W548-F552 VanDerWaalsContact O-N 3.14Å; W548-W570 HydrophobicContact CH2-CZ3 4.3Å; W548-W570 AromaticContact CZ3-CH2 3.99Å; W548-W570 HydrophobicContact CZ3-CH2 3.99Å; W548-W570 HydrophobicContact CZ3-CZ3 4.16Å; W548-H705 AromaticContact CH2-CD2 3.91Å; W548-H705 AromaticContact CH2-NE2 3.79Å; W548-H705 AromaticContact CZ2-CD2 3.56Å; W548-H705 AromaticContact CZ2-NE2 3.74Å; W548-I708 HydrophobicContact CB-CG2 4.11Å; W548-I708 HydrophobicContact CD2-CG2 3.52Å; W548-I708 HydrophobicContact CE3-CG2 4.03Å; W548-I708 HydrophobicContact CG-CG2 3.54Å; W548-D709 PolarHBondContact NE1-OD1 3.46Å; W548-Y712 HydrophobicContact CB-CD1 4.21Å; W548-Y712 HydrophobicContact CB-CD2 3.64Å; W548-Y712 HydrophobicContact CB-CE2 4.18Å; W548-Y712 HydrophobicContact CB-CG 3.64Å; W548-F745 HydrophobicContact CZ3-CD2 4.38Å; W548-F745 HydrophobicContact CZ3-CE2 4.31Å
549	R	92.8	Very high	86.2	Confident	52 Å²	52	44.4 Å²	44.4	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-43	179.2	-179.5	166.2	-71.2	-113.8	1.9	111.6	Q547 M551 F552 D553 W570 D572 H705	Q547-R549 PolarHBondContact O-N 3.45Å; R549-M551 PolarHBondContact O-N 3.36Å; R549-F552 PolarHBondContact O-N 3.09Å; R549-D553 WeakPolarHBondContact O-CB 3.33Å; R549-D553 PolarHBondContact O-N 3.24Å; R549-W570 HydrophobicContact CG-CZ2 4.24Å; R549-W570 VanDerWaalsContact NH1-CE3 3.29Å; R549-W570 VanDerWaalsContact NH1-CG 3.27Å; R549-D572 IonicContact CZ-OD1 2.66Å; R549-D572 IonicContact CZ-OD2 3.53Å; R549-D572 IonicContact NH1-OD1 2.99Å; R549-D572 PolarHBondContact NH1-OD1 3.24Å; R549-D572 IonicContact NH1-OD2 3.54Å; R549-D572 PolarHBondContact NH1-OD2 3.11Å; R549-D572 IonicContact NH2-OD1 3.78Å; R549-D572 PolarHBondContact NH2-OD1 2.9Å; R549-D572 IonicContact NH2-OD2 3.69Å; R549-D572 PolarHBondContact NH2-OD2 3.41Å; R549-H705 PolarHBondContact NH2-CE1 2.78Å; R549-H705 PolarHBondContact NH2-NE2 2.71Å
550	D	91.8	Very high	87.6	Confident	22 Å²	22	42.4 Å²	42.4	12%	0.118	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-38.8	176.9	-64.2	-43.6	0	0	0	111.4	M539 R544 M546 Q547 W548 D553	M539-D550 HydrophobicContact CE-CB 3.83Å; M539-D550 HydrophobicContact SD-CB 3.74Å; R544-D550 IonicContact CZ-OD1 3.97Å; R544-D550 IonicContact CZ-OD2 3.71Å; R544-D550 IonicContact NE-OD2 2.8Å; R544-D550 IonicContact NH2-OD1 3.67Å; R544-D550 PolarHBondContact NH2-OD1 3.39Å; R544-D550 IonicContact NH2-OD2 2.85Å; R544-D550 PolarHBondContact NH2-OD2 2.84Å; M546-D550 HydrophobicContact CG-CB 3.72Å; Q547-D550 PolarHBondContact N-OD2 3.4Å; Q547-D550 WeakPolarHBondContact O-CB 3.09Å; Q547-D550 PolarHBondContact O-N 2.77Å; W548-D550 VanDerWaalsContact C-N 3.3Å; W548-D550 PolarHBondContact O-N 2.91Å; D550-D553 PolarHBondContact O-N 2.9Å
551	M	93.7	Very high	89.3	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.02	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-44	176.9	-179.5	179.5	64.1	0	0	112.4	V524 V528 M546 Q547 W548 R549 Y712 L741 V762	V524-M551 HydrophobicContact CG1-CG 3.93Å; V524-M551 HydrophobicContact CG1-SD 4.4Å; V528-M551 HydrophobicContact CG2-CG 4.1Å; V528-M551 HydrophobicContact CG2-SD 3.61Å; M546-M551 HydrophobicContact CE-CB 4.2Å; Q547-M551 PolarHBondContact O-N 3.31Å; W548-M551 VanDerWaalsContact O-CB 3.31Å; W548-M551 WeakPolarHBondContact O-CB 3.23Å; W548-M551 PolarHBondContact O-N 3.14Å; W548-M551 VanDerWaalsContact O-N 3.08Å; R549-M551 PolarHBondContact O-N 3.36Å; M551-Y712 HydrophobicContact CE-CD2 4.31Å; M551-Y712 HydrophobicContact CE-CE2 4.18Å; M551-Y712 HydrophobicContact SD-CE2 4.38Å; M551-L741 HydrophobicContact CE-CD1 4.48Å; M551-L741 HydrophobicContact CE-CD2 4.36Å; M551-V762 HydrophobicContact CE-CG1 3.72Å; M551-V762 HydrophobicContact CG-CG1 4.04Å; M551-V762 HydrophobicContact SD-CG1 4Å
552	F	96	Very high	90.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-72.1	-31.7	177.3	-79.4	-102.1	0	0	0	112.3	W548 R549 I554 A555 V556 W570 L741 V742 F745 I758 A759 V762	W548-F552 AromaticContact CE3-CD2 3.94Å; W548-F552 HydrophobicContact CE3-CD2 3.94Å; W548-F552 HydrophobicContact CE3-CE2 4.32Å; W548-F552 WeakPolarHBondContact O-CD2 3.46Å; W548-F552 PolarHBondContact O-N 3.27Å; W548-F552 VanDerWaalsContact O-N 3.14Å; R549-F552 PolarHBondContact O-N 3.09Å; F552-I554 PolarHBondContact O-N 3.38Å; F552-A555 PolarHBondContact O-N 3.37Å; F552-A555 VanDerWaalsContact O-N 3.07Å; F552-V556 WeakPolarHBondContact O-CG2 3.28Å; F552-V556 PolarHBondContact O-N 3.49Å; F552-W570 HydrophobicContact CB-CH2 3.95Å; F552-W570 HydrophobicContact CB-CZ2 4.11Å; F552-L741 HydrophobicContact CE2-CD2 3.45Å; F552-L741 VanDerWaalsContact CE2-CD2 3.45Å; F552-L741 HydrophobicContact CZ-CD2 3.59Å; F552-V742 HydrophobicContact CZ-CG2 4.08Å; F552-F745 HydrophobicContact CB-CE2 4.5Å; F552-F745 HydrophobicContact CD1-CD1 4.44Å; F552-F745 AromaticContact CD1-CD2 3.68Å; F552-F745 HydrophobicContact CD1-CD2 3.68Å; F552-F745 HydrophobicContact CD1-CE1 4.11Å; F552-F745 AromaticContact CD1-CE2 3.27Å; F552-F745 HydrophobicContact CD1-CE2 3.27Å; F552-F745 HydrophobicContact CD1-CG 4.24Å; F552-F745 AromaticContact CD1-CZ 3.51Å; F552-F745 HydrophobicContact CD1-CZ 3.51Å; F552-F745 HydrophobicContact CE1-CB 4.25Å; F552-F745 AromaticContact CE1-CD1 3.86Å; F552-F745 HydrophobicContact CE1-CD1 3.86Å; F552-F745 AromaticContact CE1-CD2 3.34Å; F552-F745 HydrophobicContact CE1-CD2 3.34Å; F552-F745 AromaticContact CE1-CE1 3.97Å; F552-F745 HydrophobicContact CE1-CE1 3.97Å; F552-F745 AromaticContact CE1-CE2 3.47Å; F552-F745 HydrophobicContact CE1-CE2 3.47Å; F552-F745 VanDerWaalsContact CE1-CE2 3.47Å; F552-F745 AromaticContact CE1-CG 3.54Å; F552-F745 HydrophobicContact CE1-CG 3.54Å; F552-F745 AromaticContact CE1-CZ 3.78Å; F552-F745 HydrophobicContact CE1-CZ 3.78Å; F552-F745 HydrophobicContact CE2-CD2 4.35Å; F552-F745 HydrophobicContact CG-CD2 4.3Å; F552-F745 AromaticContact CG-CE2 3.87Å; F552-F745 HydrophobicContact CG-CE2 3.87Å; F552-F745 HydrophobicContact CG-CZ 4.42Å; F552-F745 HydrophobicContact CZ-CB 4.24Å; F552-F745 AromaticContact CZ-CD2 3.72Å; F552-F745 HydrophobicContact CZ-CD2 3.72Å; F552-F745 HydrophobicContact CZ-CE2 4.21Å; F552-F745 AromaticContact CZ-CG 3.97Å; F552-F745 HydrophobicContact CZ-CG 3.97Å; F552-I758 HydrophobicContact CD1-CG2 4.11Å; F552-A759 HydrophobicContact CE1-CB 4.23Å; F552-V762 HydrophobicContact CD1-CB 4.44Å; F552-V762 HydrophobicContact CD1-CG2 3.9Å; F552-V762 HydrophobicContact CD2-CG1 4.29Å; F552-V762 HydrophobicContact CE1-CB 4.2Å; F552-V762 HydrophobicContact CE1-CG1 4.21Å; F552-V762 HydrophobicContact CE1-CG2 4.17Å; F552-V762 HydrophobicContact CE2-CG1 3.91Å; F552-V762 HydrophobicContact CG-CG2 4.12Å; F552-V762 HydrophobicContact CZ-CB 4.36Å; F552-V762 HydrophobicContact CZ-CG1 3.88Å
553	D	93.8	Very high	92	Very high	27 Å²	27	27.9 Å²	27.9	14%	0.144	13%	0.133	C	C	.	.	H	α-helix	trans	-63.7	-29.9	-177.4	-144	54.4	0	0	0	112.2	R549 D550 V556 K557 W570	R549-D553 WeakPolarHBondContact O-CB 3.33Å; R549-D553 PolarHBondContact O-N 3.24Å; D550-D553 PolarHBondContact O-N 2.9Å; D553-V556 PolarHBondContact O-N 2.85Å; D553-K557 VanDerWaalsContact O-CG 3.3Å; D553-K557 WeakPolarHBondContact O-CG 3.28Å; D553-K557 PolarHBondContact O-N 3.32Å; D553-K557 WeakPolarHBondContact OD2-CE 3.44Å; D553-W570 PolarHBondContact OD1-NE1 3.35Å
554	I	94.9	Very high	92.8	Very high	15 Å²	15	23.4 Å²	23.4	8%	0.077	11%	0.106	C	C	.	.	H	α-helix	trans	-54	-54.5	170	-66.2	167.5	0	0	0	110.4	E523 V524 A527 F552 K557 W558	E523-I554 HydrophobicContact CB-CG2 3.69Å; E523-I554 VanDerWaalsContact CD-CG2 3.49Å; E523-I554 HydrophobicContact CG-CG2 3.63Å; V524-I554 HydrophobicContact CG2-CB 4.04Å; V524-I554 HydrophobicContact CG2-CD1 4.32Å; V524-I554 HydrophobicContact CG2-CG2 3.89Å; A527-I554 HydrophobicContact CB-CD1 3.67Å; F552-I554 PolarHBondContact O-N 3.38Å; I554-K557 PolarHBondContact O-N 3.47Å; I554-W558 PolarHBondContact O-N 2.65Å
555	A	96.8	Very high	93	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-69.3	-34.4	-179.4	0	0	0	0	0	112.5	A520 F552 W558 R559 I758 V762	A520-A555 HydrophobicContact CB-CB 4Å; F552-A555 PolarHBondContact O-N 3.37Å; F552-A555 VanDerWaalsContact O-N 3.07Å; A555-W558 PolarHBondContact O-N 3.4Å; A555-R559 WeakPolarHBondContact O-CB 3.11Å; A555-R559 PolarHBondContact O-N 3.42Å; A555-I758 HydrophobicContact CB-CG2 3.94Å; A555-V762 HydrophobicContact CB-CG2 3.96Å
556	V	95.9	Very high	93.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.6	-46.5	173.4	169.9	0	0	0	0	111	F552 D553 R559 R560 V568 W570 L751 I758	F552-V556 WeakPolarHBondContact O-CG2 3.28Å; F552-V556 PolarHBondContact O-N 3.49Å; D553-V556 PolarHBondContact O-N 2.85Å; V556-R559 PolarHBondContact O-N 3.15Å; V556-R560 HydrophobicContact CG1-CG 4.3Å; V556-R560 WeakPolarHBondContact O-CB 3.38Å; V556-R560 VanDerWaalsContact O-CG 3.27Å; V556-R560 WeakPolarHBondContact O-CG 3.11Å; V556-R560 PolarHBondContact O-N 3.11Å; V556-V568 HydrophobicContact CG1-CG1 4.15Å; V556-W570 HydrophobicContact CG2-CZ2 3.94Å; V556-L751 HydrophobicContact CG2-CD1 3.96Å; V556-L751 HydrophobicContact CG2-CD2 4.39Å; V556-I758 HydrophobicContact CB-CD1 4.48Å; V556-I758 HydrophobicContact CG2-CD1 3.92Å; V556-I758 HydrophobicContact CG2-CG2 4.1Å
557	K	94.1	Very high	93.4	Very high	41 Å²	41	18.2 Å²	18.2	18%	0.178	9%	0.086	C	C	.	.	H	α-helix	trans	-59.1	-49.5	179.6	-74.2	174.4	-176.1	-170.1	0	112	L433 D553 I554 R559 R560 I561	L433-K557 PolarHBondContact O-NZ 2.96Å; D553-K557 VanDerWaalsContact O-CG 3.3Å; D553-K557 WeakPolarHBondContact O-CG 3.28Å; D553-K557 PolarHBondContact O-N 3.32Å; D553-K557 WeakPolarHBondContact OD2-CE 3.44Å; I554-K557 PolarHBondContact O-N 3.47Å; K557-R559 PolarHBondContact O-N 3.25Å; K557-R560 PolarHBondContact O-N 3.27Å; K557-I561 WeakPolarHBondContact O-CG1 3.39Å; K557-I561 PolarHBondContact O-N 3.44Å
558	W	96.3	Very high	93.5	Very high	1 Å²	1	14.6 Å²	14.6	0%	0.004	7%	0.069	C	C	.	.	H	α-helix	trans	-60.3	-43.8	175.2	-78.4	105	0	0	0	112	A516 M517 L519 A520 E523 I554 A555 R560 I561 A562 V820 F824 M830 V833 L834	A516-W558 HydrophobicContact CB-CB 4.29Å; A516-W558 HydrophobicContact CB-CE3 4.41Å; M517-W558 HydrophobicContact CE-CB 3.77Å; L519-W558 HydrophobicContact CB-CD2 4.17Å; L519-W558 HydrophobicContact CB-CE3 4.38Å; L519-W558 HydrophobicContact CB-CH2 4.23Å; L519-W558 HydrophobicContact CB-CZ2 3.99Å; L519-W558 HydrophobicContact CB-CZ3 4.41Å; L519-W558 HydrophobicContact CD1-CE3 4.26Å; L519-W558 HydrophobicContact CD1-CH2 3.57Å; L519-W558 HydrophobicContact CD1-CZ2 4.16Å; L519-W558 HydrophobicContact CD1-CZ3 3.62Å; L519-W558 HydrophobicContact CG-CH2 4.47Å; A520-W558 HydrophobicContact CB-CB 4.02Å; A520-W558 HydrophobicContact CB-CG 4.02Å; E523-W558 PolarHBondContact OE2-NE1 3.17Å; I554-W558 PolarHBondContact O-N 2.65Å; A555-W558 PolarHBondContact O-N 3.4Å; W558-R560 PolarHBondContact O-N 3.38Å; W558-I561 PolarHBondContact O-N 3.39Å; W558-A562 VanDerWaalsContact O-CB 3.25Å; W558-A562 WeakPolarHBondContact O-CB 3.44Å; W558-A562 PolarHBondContact O-N 2.78Å; W558-V820 HydrophobicContact CZ2-CG1 3.92Å; W558-F824 HydrophobicContact CH2-CB 4.32Å; W558-F824 HydrophobicContact CH2-CD2 4.12Å; W558-F824 HydrophobicContact CH2-CG 4.37Å; W558-F824 HydrophobicContact CZ2-CD2 4.33Å; W558-M830 HydrophobicContact CB-CE 4.5Å; W558-M830 HydrophobicContact CD2-CE 3.3Å; W558-M830 VanDerWaalsContact CE2-CE 3.44Å; W558-M830 HydrophobicContact CE3-CE 3.49Å; W558-M830 VanDerWaalsContact CE3-CE 3.49Å; W558-M830 HydrophobicContact CG-CE 3.78Å; W558-M830 HydrophobicContact CH2-CB 3.99Å; W558-M830 HydrophobicContact CH2-CE 3.91Å; W558-M830 HydrophobicContact CH2-CG 3.72Å; W558-M830 HydrophobicContact CZ2-CE 3.76Å; W558-M830 HydrophobicContact CZ2-CG 4.12Å; W558-M830 HydrophobicContact CZ3-CB 3.88Å; W558-M830 HydrophobicContact CZ3-CE 3.79Å; W558-M830 HydrophobicContact CZ3-CG 4.04Å; W558-V833 HydrophobicContact CH2-CG1 3.89Å; W558-V833 HydrophobicContact CZ3-CG1 3.97Å; W558-L834 HydrophobicContact CE3-CD1 4.24Å; W558-L834 HydrophobicContact CE3-CD2 4.21Å; W558-L834 HydrophobicContact CE3-CG 4.37Å; W558-L834 HydrophobicContact CZ3-CD1 4.27Å; W558-L834 HydrophobicContact CZ3-CD2 4.14Å; W558-L834 HydrophobicContact CZ3-CG 4.05Å
559	R	96.4	Very high	93.5	Very high	11 Å²	11	14.3 Å²	14.3	4%	0.042	7%	0.068	C	C	.	.	H	α-helix	trans	-65.7	-38	-178.2	-177.5	57.1	-170.4	79.2	-3.8	112.6	M517 A555 V556 K557 A562 V568 V757 I758	M517-R559 HydrophobicContact CE-CB 3.61Å; M517-R559 HydrophobicContact SD-CB 4.18Å; A555-R559 WeakPolarHBondContact O-CB 3.11Å; A555-R559 PolarHBondContact O-N 3.42Å; V556-R559 PolarHBondContact O-N 3.15Å; K557-R559 PolarHBondContact O-N 3.25Å; R559-A562 PolarHBondContact O-N 2.92Å; R559-V568 HydrophobicContact CG-CG2 4.13Å; R559-V757 HydrophobicContact CG-CG1 4.38Å; R559-I758 HydrophobicContact CB-CD1 3.97Å; R559-I758 HydrophobicContact CB-CG1 3.92Å; R559-I758 HydrophobicContact CG-CD1 4.01Å; R559-I758 HydrophobicContact CG-CG1 4.11Å
560	R	93.6	Very high	93.5	Very high	5 Å²	5	12 Å²	12	2%	0.019	6%	0.059	C	C	.	.	H	α-helix	trans	-61.2	-44.2	177.7	-77.5	167.7	174.1	176.3	0.4	112.4	D439 V556 K557 W558 D563 V568	D439-R560 IonicContact OD1-CZ 3.99Å; D439-R560 IonicContact OD1-NH2 3.94Å; D439-R560 PolarHBondContact OD1-NH2 2.76Å; D439-R560 IonicContact OD2-CZ 2.66Å; D439-R560 IonicContact OD2-NH1 3.41Å; D439-R560 PolarHBondContact OD2-NH1 2.95Å; D439-R560 IonicContact OD2-NH2 3.99Å; D439-R560 PolarHBondContact OD2-NH2 3.34Å; V556-R560 HydrophobicContact CG1-CG 4.3Å; V556-R560 WeakPolarHBondContact O-CB 3.38Å; V556-R560 VanDerWaalsContact O-CG 3.27Å; V556-R560 WeakPolarHBondContact O-CG 3.11Å; V556-R560 PolarHBondContact O-N 3.11Å; K557-R560 PolarHBondContact O-N 3.27Å; W558-R560 PolarHBondContact O-N 3.38Å; R560-D563 CarbonylContact O-C 3.52Å; R560-V568 HydrophobicContact CG-CB 3.77Å; R560-V568 HydrophobicContact CG-CG1 4.19Å; R560-V568 PolarHBondContact NE-O 2.91Å; R560-V568 PolarHBondContact NH2-O 2.79Å
561	I	92.7	Very high	93.4	Very high	2 Å²	2	11 Å²	11	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-77	-29.9	-177.8	-59.4	163.3	0	0	0	110.4	R512 K557 W558 D563 L827 M830 M831 L834	R512-I561 VanDerWaalsContact CZ-O 3.32Å; R512-I561 PolarHBondContact NH1-O 2.95Å; R512-I561 PolarHBondContact NH2-O 2.8Å; K557-I561 WeakPolarHBondContact O-CG1 3.39Å; K557-I561 PolarHBondContact O-N 3.44Å; W558-I561 PolarHBondContact O-N 3.39Å; I561-D563 VanDerWaalsContact C-N 3.28Å; I561-D563 PolarHBondContact O-N 2.65Å; I561-L827 HydrophobicContact CD1-CD2 3.4Å; I561-L827 HydrophobicContact CG1-CD2 4.16Å; I561-M830 HydrophobicContact CD1-CB 4.25Å; I561-M830 HydrophobicContact CD1-CE 3.59Å; I561-M830 HydrophobicContact CD1-SD 3.44Å; I561-M830 WeakPolarHBondContact CD1-SD 3.46Å; I561-M831 HydrophobicContact CG2-CE 4.15Å; I561-M831 HydrophobicContact CG2-CG 3.64Å; I561-L834 HydrophobicContact CB-CD1 4.39Å; I561-L834 HydrophobicContact CG2-CD1 3.92Å
562	A	94.8	Very high	93.1	Very high	3 Å²	3	12.5 Å²	12.5	3%	0.025	6%	0.062	C	C	.	.	H	α-helix	trans	-65.8	-21.5	179.8	0	0	0	0	0	115	R512 I513 A516 W558 R559	R512-A562 PolarHBondContact NH1-O 3.24Å; I513-A562 HydrophobicContact CG1-CB 4.24Å; A516-A562 HydrophobicContact CB-CB 3.53Å; W558-A562 VanDerWaalsContact O-CB 3.25Å; W558-A562 WeakPolarHBondContact O-CB 3.44Å; W558-A562 PolarHBondContact O-N 2.78Å; R559-A562 PolarHBondContact O-N 2.92Å
563	D	92.8	Very high	92.6	Very high	5 Å²	5	16.7 Å²	16.7	3%	0.027	8%	0.082	C	C	.	.			trans	-156.7	93.6	170.7	-177.4	13.5	0	0	0	109.3	Y348 R560 I561 D565 Q566	Y348-D563 PolarHBondContact OH-OD1 2.85Å; R560-D563 CarbonylContact O-C 3.52Å; I561-D563 VanDerWaalsContact C-N 3.28Å; I561-D563 PolarHBondContact O-N 2.65Å; D563-D565 PolarHBondContact O-N 2.99Å; D563-D565 WeakPolarHBondContact OD1-CB 3.12Å; D563-Q566 PolarHBondContact O-N 3Å; D563-Q566 PolarHBondContact OD2-NE2 3.07Å
564	P	92.3	Very high	92.2	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-7.2	-173.2	28	-33.6	0	0	0	114	L379 V382 A383 Y421 Q566	L379-P564 HydrophobicContact CD1-CG 3.93Å; V382-P564 HydrophobicContact CG1-CB 4.17Å; V382-P564 HydrophobicContact CG1-CG 4.05Å; A383-P564 HydrophobicContact CB-CG 4.01Å; Y421-P564 HydrophobicContact CD1-CB 4.32Å; Y421-P564 HydrophobicContact CE1-CB 3.88Å; P564-Q566 VanDerWaalsContact C-N 3.32Å
565	D	88.7	Confident	91.6	Very high	28 Å²	28	17.4 Å²	17.4	15%	0.15	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-33.2	174	-167.5	54.4	0	0	0	112.1	Y375 L379 D563 P567	Y375-D565 PolarHBondContact OH-OD1 3.29Å; L379-D565 HydrophobicContact CD1-CB 3.74Å; L379-D565 HydrophobicContact CD2-CB 3.71Å; L379-D565 HydrophobicContact CG-CB 4.35Å; D563-D565 PolarHBondContact O-N 2.99Å; D563-D565 WeakPolarHBondContact OD1-CB 3.12Å; D565-P567 WeakPolarHBondContact O-CD 3.39Å
566	Q	88.4	Confident	90.5	Very high	65 Å²	65	21 Å²	21	30%	0.304	12%	0.118	S	C	.	.	S	Bend	trans	-95.6	119.4	-173	-64.3	-170.8	13.9	0	0	111.6	D563 P564 V568	D563-Q566 PolarHBondContact O-N 3Å; D563-Q566 PolarHBondContact OD2-NE2 3.07Å; P564-Q566 VanDerWaalsContact C-N 3.32Å; Q566-V568 PolarHBondContact O-N 3.4Å
567	P	90.9	Very high	89.4	Confident	14 Å²	14	29.3 Å²	29.3	9%	0.091	15%	0.149	C	C	.	.			trans	-71	104.2	172.1	25.8	-30.2	0	0	0	109.7	W450 D565 L569 S752	W450-P567 HydrophobicContact CD2-CB 3.59Å; W450-P567 HydrophobicContact CD2-CG 4.21Å; W450-P567 HydrophobicContact CE3-CB 3.85Å; W450-P567 HydrophobicContact CG-CB 4.02Å; W450-P567 HydrophobicContact CG-CG 4.21Å; W450-P567 HydrophobicContact CH2-CB 4.19Å; W450-P567 HydrophobicContact CZ2-CB 3.94Å; W450-P567 HydrophobicContact CZ3-CB 4.14Å; D565-P567 WeakPolarHBondContact O-CD 3.39Å; P567-L569 HydrophobicContact CB-CD1 3.93Å; P567-L569 HydrophobicContact CB-CG 4.19Å; P567-S752 PolarHBondContact O-OG 3.48Å
568	V	94	Very high	88.3	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.012	14%	0.144	C	C	.	.			trans	-96.6	92.4	171.7	176.1	0	0	0	0	107.1	V556 R559 R560 Q566 L751 R753 I758	V556-V568 HydrophobicContact CG1-CG1 4.15Å; R559-V568 HydrophobicContact CG-CG2 4.13Å; R560-V568 HydrophobicContact CG-CB 3.77Å; R560-V568 HydrophobicContact CG-CG1 4.19Å; R560-V568 PolarHBondContact NE-O 2.91Å; R560-V568 PolarHBondContact NH2-O 2.79Å; Q566-V568 PolarHBondContact O-N 3.4Å; V568-L751 HydrophobicContact CG1-CD1 4.19Å; V568-R753 WeakPolarHBondContact CG1-O 3.42Å; V568-R753 HydrophobicContact CG2-CB 4.32Å; V568-I758 HydrophobicContact CG1-CD1 3.71Å
569	L	92.7	Very high	87	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.15	C	C	.	.			trans	-126.1	144.9	-170.9	-60.3	171.7	0	0	0	110.5	I438 K447 W450 P567 L571 M574 L751 S752	I438-L569 HydrophobicContact CG2-CD2 3.93Å; K447-L569 HydrophobicContact CB-CD1 3.83Å; K447-L569 HydrophobicContact CD-CD1 4.48Å; K447-L569 HydrophobicContact CD-CD2 4.35Å; K447-L569 HydrophobicContact CG-CD1 3.99Å; K447-L569 HydrophobicContact CG-CD2 4.49Å; W450-L569 HydrophobicContact CE3-CD1 4.16Å; P567-L569 HydrophobicContact CB-CD1 3.93Å; P567-L569 HydrophobicContact CB-CG 4.19Å; L569-L571 PolarHBondContact O-N 3.36Å; L569-M574 HydrophobicContact CB-CE 3.76Å; L569-M574 HydrophobicContact CD1-CE 3.92Å; L569-L751 VanDerWaalsContact O-CA 3.28Å; L569-L751 WeakPolarHBondContact O-CA 3.47Å; L569-S752 PolarHBondContact N-OG 3.43Å; L569-S752 PolarHBondContact O-N 3.21Å; L569-S752 PolarHBondContact O-OG 3.33Å
570	W	92.4	Very high	85.4	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.011	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-71.2	119.4	174.7	-73.2	107.7	0	0	0	110.2	D439 W548 R549 F552 D553 V556 D572 Q573 F745 P750 L751	D439-W570 PolarHBondContact OD1-N 3.42Å; W548-W570 HydrophobicContact CH2-CZ3 4.3Å; W548-W570 AromaticContact CZ3-CH2 3.99Å; W548-W570 HydrophobicContact CZ3-CH2 3.99Å; W548-W570 HydrophobicContact CZ3-CZ3 4.16Å; R549-W570 HydrophobicContact CG-CZ2 4.24Å; R549-W570 VanDerWaalsContact NH1-CE3 3.29Å; R549-W570 VanDerWaalsContact NH1-CG 3.27Å; F552-W570 HydrophobicContact CB-CH2 3.95Å; F552-W570 HydrophobicContact CB-CZ2 4.11Å; D553-W570 PolarHBondContact OD1-NE1 3.35Å; V556-W570 HydrophobicContact CG2-CZ2 3.94Å; W570-D572 VanDerWaalsContact C-N 3.3Å; W570-D572 PolarHBondContact O-N 3.12Å; W570-Q573 HydrophobicContact CB-CB 4.29Å; W570-Q573 HydrophobicContact CB-CG 3.91Å; W570-Q573 PolarHBondContact O-N 2.99Å; W570-Q573 VanDerWaalsContact O-N 3.13Å; W570-F745 AromaticContact CH2-CE2 3.94Å; W570-F745 HydrophobicContact CH2-CE2 3.94Å; W570-F745 HydrophobicContact CH2-CZ 4.37Å; W570-F745 HydrophobicContact CZ3-CE2 4.04Å; W570-F745 HydrophobicContact CZ3-CZ 4.47Å; W570-P750 HydrophobicContact CE3-CB 4.09Å; W570-P750 HydrophobicContact CE3-CG 4.45Å; W570-P750 HydrophobicContact CZ3-CB 3.9Å; W570-P750 HydrophobicContact CZ3-CG 3.83Å; W570-L751 HydrophobicContact CB-CD2 4.46Å; W570-L751 HydrophobicContact CD2-CD2 3.38Å; W570-L751 HydrophobicContact CE3-CD2 3.43Å; W570-L751 VanDerWaalsContact CE3-CD2 3.43Å; W570-L751 HydrophobicContact CE3-CG 4.41Å; W570-L751 HydrophobicContact CG-CD2 3.86Å; W570-L751 HydrophobicContact CH2-CD2 4.25Å; W570-L751 HydrophobicContact CZ2-CD2 4.22Å; W570-L751 HydrophobicContact CZ3-CD2 3.88Å
571	L	89.7	Confident	84.1	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-68.8	-30.1	-174.4	-66.3	-179.3	0	0	0	112.5	L569 Q573 M574 F583 T696 P750	L569-L571 PolarHBondContact O-N 3.36Å; L571-Q573 PolarHBondContact O-N 3.25Å; L571-M574 HydrophobicContact CD2-CE 4.26Å; L571-M574 VanDerWaalsContact O-CB 3.27Å; L571-M574 WeakPolarHBondContact O-CB 3.31Å; L571-M574 VanDerWaalsContact O-CG 3.28Å; L571-M574 WeakPolarHBondContact O-CG 3.38Å; L571-M574 PolarHBondContact O-N 3.37Å; L571-F583 HydrophobicContact CD1-CB 4.34Å; L571-F583 HydrophobicContact CD1-CD1 3.58Å; L571-F583 HydrophobicContact CD1-CE1 4.16Å; L571-F583 HydrophobicContact CD1-CG 4.12Å; L571-F583 HydrophobicContact CD2-CB 4.36Å; L571-F583 HydrophobicContact CD2-CD1 3.57Å; L571-F583 HydrophobicContact CD2-CD2 3.87Å; L571-F583 HydrophobicContact CD2-CE1 3.71Å; L571-F583 HydrophobicContact CD2-CE2 3.99Å; L571-F583 HydrophobicContact CD2-CG 3.66Å; L571-F583 HydrophobicContact CD2-CZ 3.92Å; L571-F583 HydrophobicContact CG-CD1 4.21Å; L571-F583 HydrophobicContact CG-CG 4.43Å; L571-T696 HydrophobicContact CB-CG2 4.02Å; L571-T696 HydrophobicContact CD1-CG2 4.38Å; L571-P750 WeakPolarHBondContact CB-O 3.48Å; L571-P750 WeakPolarHBondContact CG-O 3.22Å; L571-P750 PolarHBondContact N-O 2.99Å
572	D	87.4	Confident	82.9	Confident	36 Å²	36	41.9 Å²	41.9	19%	0.193	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-70.7	-9.9	175.5	70.8	-59.4	0	0	0	113.6	R549 W570 T701 H705	R549-D572 IonicContact CZ-OD1 2.66Å; R549-D572 IonicContact CZ-OD2 3.53Å; R549-D572 IonicContact NH1-OD1 2.99Å; R549-D572 PolarHBondContact NH1-OD1 3.24Å; R549-D572 IonicContact NH1-OD2 3.54Å; R549-D572 PolarHBondContact NH1-OD2 3.11Å; R549-D572 IonicContact NH2-OD1 3.78Å; R549-D572 PolarHBondContact NH2-OD1 2.9Å; R549-D572 IonicContact NH2-OD2 3.69Å; R549-D572 PolarHBondContact NH2-OD2 3.41Å; W570-D572 VanDerWaalsContact C-N 3.3Å; W570-D572 PolarHBondContact O-N 3.12Å; D572-T701 HydrophobicContact CB-CG2 4.06Å; D572-H705 IonicContact OD2-CE1 3.66Å
573	Q	87.1	Confident	81.7	Confident	88 Å²	88	42.5 Å²	42.5	41%	0.411	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-100.6	13	174.9	-58.4	-63.1	-51.8	0	0	112.4	D439 K447 W570 L571	D439-Q573 HydrophobicContact CB-CB 4.49Å; D439-Q573 HydrophobicContact CB-CG 4.5Å; K447-Q573 PolarHBondContact NZ-O 3.48Å; W570-Q573 HydrophobicContact CB-CB 4.29Å; W570-Q573 HydrophobicContact CB-CG 3.91Å; W570-Q573 PolarHBondContact O-N 2.99Å; W570-Q573 VanDerWaalsContact O-N 3.13Å; L571-Q573 PolarHBondContact O-N 3.25Å
574	M	85.2	Confident	80.7	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.059	23%	0.231	C	C	.	.	S	Bend	trans	-82.8	159.8	174.5	-65.8	-66	-178.4	0	0	111.4	K447 D448 A451 L569 L571 L579	K447-M574 HydrophobicContact CB-CE 4.14Å; K447-M574 HydrophobicContact CB-SD 3.78Å; D448-M574 HydrophobicContact CB-SD 4.41Å; A451-M574 HydrophobicContact CB-CE 3.99Å; L569-M574 HydrophobicContact CB-CE 3.76Å; L569-M574 HydrophobicContact CD1-CE 3.92Å; L571-M574 HydrophobicContact CD2-CE 4.26Å; L571-M574 VanDerWaalsContact O-CB 3.27Å; L571-M574 WeakPolarHBondContact O-CB 3.31Å; L571-M574 VanDerWaalsContact O-CG 3.28Å; L571-M574 WeakPolarHBondContact O-CG 3.38Å; L571-M574 PolarHBondContact O-N 3.37Å; M574-L579 WeakPolarHBondContact O-CD1 3.19Å
575	P	81.9	Confident	80	Confident	45 Å²	45	46.1 Å²	46.1	29%	0.292	24%	0.239	S	C	.	.			trans	-55.3	143.8	177	-24.9	34.1	0	0	0	112.8	G444 D448 R577 S578 L579	G444-P575 WeakPolarHBondContact O-CD 3.37Å; G444-P575 WeakPolarHBondContact O-CG 3.44Å; D448-P575 HydrophobicContact CB-CG 4.45Å; P575-R577 PolarHBondContact O-N 2.93Å; P575-S578 WeakPolarHBondContact O-CA 3.16Å; P575-S578 WeakPolarHBondContact O-CB 3.27Å; P575-S578 PolarHBondContact O-N 2.9Å; P575-L579 PolarHBondContact O-N 3.46Å
576	A	73.9	Confident	79.6	Confident	76 Å²	76	49.5 Å²	49.5	63%	0.628	25%	0.253	S	S	*	.	H	α-helix	trans	-53.6	-33.7	-176.3	0	0	0	0	0	114	S578 L579 S580	A576-S578 VanDerWaalsContact C-N 3.26Å; A576-S578 PolarHBondContact O-N 3.36Å; A576-L579 PolarHBondContact O-N 2.65Å; A576-S580 WeakPolarHBondContact O-CB 3.24Å; A576-S580 PolarHBondContact O-N 3.49Å; A576-S580 PolarHBondContact O-OG 3.37Å
577	R	72.2	Confident	79.5	Confident	174 Å²	174	47.9 Å²	47.9	66%	0.657	25%	0.247	S	C	*	.	H	α-helix	trans	-62.7	-31.2	175.8	-169.4	-179.5	-173.2	-175.9	4	113.2	P575 S580 R581	P575-R577 PolarHBondContact O-N 2.93Å; R577-S580 PolarHBondContact O-OG 2.96Å; R577-R581 WeakPolarHBondContact O-CG 3.38Å; R577-R581 PolarHBondContact O-N 3.22Å
578	S	71.8	Confident	79.4	Confident	11 Å²	11	49.8 Å²	49.8	8%	0.077	26%	0.256	C	S	.	.	H	α-helix	trans	-78.9	-38.8	177	-66.8	0	0	0	0	111.5	D448 K452 P575 A576 G582	D448-S578 VanDerWaalsContact OD1-CB 3.24Å; D448-S578 WeakPolarHBondContact OD1-CB 3.37Å; D448-S578 PolarHBondContact OD1-OG 3.18Å; D448-S578 PolarHBondContact OD2-OG 3.13Å; K452-S578 PolarHBondContact NZ-OG 2.77Å; P575-S578 WeakPolarHBondContact O-CA 3.16Å; P575-S578 WeakPolarHBondContact O-CB 3.27Å; P575-S578 PolarHBondContact O-N 2.9Å; A576-S578 VanDerWaalsContact C-N 3.26Å; A576-S578 PolarHBondContact O-N 3.36Å; S578-G582 CarbonylContact O-C 3.47Å; S578-G582 PolarHBondContact O-N 2.9Å
579	L	67.4	Low	79.2	Confident	22 Å²	22	49.7 Å²	49.7	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-39	175.5	-76	161.3	0	0	0	112.4	M574 P575 A576 R581 G582	M574-L579 WeakPolarHBondContact O-CD1 3.19Å; P575-L579 PolarHBondContact O-N 3.46Å; A576-L579 PolarHBondContact O-N 2.65Å; L579-R581 VanDerWaalsContact C-N 3.32Å; L579-R581 PolarHBondContact O-N 2.76Å; L579-G582 PolarHBondContact O-N 3.41Å
580	S	64.7	Low	79.1	Confident	93 Å²	93	49.8 Å²	49.8	65%	0.65	26%	0.256	S	S	*	.	H	α-helix	trans	-69.9	-28	179.2	64.8	0	0	0	0	113.6	A576 R577 G582	A576-S580 WeakPolarHBondContact O-CB 3.24Å; A576-S580 PolarHBondContact O-N 3.49Å; A576-S580 PolarHBondContact O-OG 3.37Å; R577-S580 PolarHBondContact O-OG 2.96Å; S580-G582 VanDerWaalsContact C-N 3.32Å
581	R	65.3	Low	78.8	Confident	184 Å²	184	53.7 Å²	53.7	69%	0.694	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12	170.9	-72	-179.1	172.6	-173.1	-4.9	113.1	R577 L579	R577-R581 WeakPolarHBondContact O-CG 3.38Å; R577-R581 PolarHBondContact O-N 3.22Å; L579-R581 VanDerWaalsContact C-N 3.32Å; L579-R581 PolarHBondContact O-N 2.76Å
582	G	66.6	Low	78.6	Confident	14 Å²	14	54.7 Å²	54.7	14%	0.144	28%	0.281	C	S	.	.			trans	77.4	128.3	-168.2	0	0	0	0	0	111.5	S578 L579 S580	S578-G582 CarbonylContact O-C 3.47Å; S578-G582 PolarHBondContact O-N 2.9Å; L579-G582 PolarHBondContact O-N 3.41Å; S580-G582 VanDerWaalsContact C-N 3.32Å
583	F	71.1	Confident	78.4	Confident	16 Å²	16	54.9 Å²	54.9	7%	0.07	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.2	162.5	-166.9	-80.2	0	0	0	108.1	A451 K452 L571 N585 T696	A451-F583 HydrophobicContact CB-CE2 4.05Å; A451-F583 HydrophobicContact CB-CZ 4.1Å; K452-F583 HydrophobicContact CG-CE2 4Å; L571-F583 HydrophobicContact CD1-CB 4.34Å; L571-F583 HydrophobicContact CD1-CD1 3.58Å; L571-F583 HydrophobicContact CD1-CE1 4.16Å; L571-F583 HydrophobicContact CD1-CG 4.12Å; L571-F583 HydrophobicContact CD2-CB 4.36Å; L571-F583 HydrophobicContact CD2-CD1 3.57Å; L571-F583 HydrophobicContact CD2-CD2 3.87Å; L571-F583 HydrophobicContact CD2-CE1 3.71Å; L571-F583 HydrophobicContact CD2-CE2 3.99Å; L571-F583 HydrophobicContact CD2-CG 3.66Å; L571-F583 HydrophobicContact CD2-CZ 3.92Å; L571-F583 HydrophobicContact CG-CD1 4.21Å; L571-F583 HydrophobicContact CG-CG 4.43Å; F583-N585 WeakPolarHBondContact CE1-OD1 3.4Å; F583-T696 PolarHBondContact N-O 3.38Å; F583-T696 PolarHBondContact O-N 2.98Å
584	N	71.9	Confident	78.4	Confident	51 Å²	51	52.9 Å²	52.9	27%	0.273	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	112	-177.9	-66.2	-7.6	0	0	0	110.1	H586 Q695	N584-H586 WeakPolarHBondContact CB-NE2 3.47Å; N584-H586 PolarHBondContact O-CD2 3.07Å; N584-H586 PolarHBondContact O-N 3.33Å; N584-Q695 WeakPolarHBondContact OD1-CG 3.38Å
585	N	75.6	Confident	78.5	Confident	32 Å²	32	53.7 Å²	53.7	17%	0.171	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	96.9	167.6	-87.5	-30.6	0	0	0	108.1	F583 E693 T694 L751	F583-N585 WeakPolarHBondContact CE1-OD1 3.4Å; N585-E693 WeakPolarHBondContact O-CA 3.43Å; N585-T694 VanDerWaalsContact CB-OG1 3.29Å; N585-T694 WeakPolarHBondContact CB-OG1 3.39Å; N585-T694 PolarHBondContact N-O 2.95Å; N585-T694 PolarHBondContact O-N 2.97Å; N585-T694 VanDerWaalsContact O-N 3.12Å; N585-L751 PolarHBondContact ND2-O 3.39Å
586	H	80.6	Confident	78.9	Confident	98 Å²	98	53.3 Å²	53.3	45%	0.454	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	121.4	178.1	-64.1	-86.9	0	0	0	111.2	N584 E693	N584-H586 WeakPolarHBondContact CB-NE2 3.47Å; N584-H586 PolarHBondContact O-CD2 3.07Å; N584-H586 PolarHBondContact O-N 3.33Å; H586-E693 IonicContact CE1-OE1 3.06Å; H586-E693 PolarHBondContact CE1-OE1 3.47Å; H586-E693 IonicContact CE1-OE2 3.37Å; H586-E693 WeakPolarHBondContact ND1-CG 3.48Å; H586-E693 IonicContact ND1-OE1 3.92Å; H586-E693 PolarHBondContact ND1-OE1 3.28Å; H586-E693 IonicContact ND1-OE2 2.74Å
587	I	87.3	Confident	79.5	Confident	32 Å²	32	51.3 Å²	51.3	16%	0.164	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	100.1	168.2	-55.8	178.9	0	0	0	107	L589 Y599 S691 V692 F786	I587-L589 HydrophobicContact CG2-CD2 4.03Å; I587-L589 PolarHBondContact O-N 3.17Å; I587-Y599 HydrophobicContact CG2-CD2 3.97Å; I587-Y599 HydrophobicContact CG2-CE1 4.27Å; I587-Y599 HydrophobicContact CG2-CE2 3.39Å; I587-S691 CarbonylContact O-C 3.52Å; I587-S691 VanDerWaalsContact O-CA 3.27Å; I587-S691 WeakPolarHBondContact O-CA 3.47Å; I587-V692 HydrophobicContact CB-CB 4.36Å; I587-V692 WeakPolarHBondContact CB-O 3.37Å; I587-V692 PolarHBondContact N-O 2.86Å; I587-V692 PolarHBondContact O-N 3.4Å; I587-F786 HydrophobicContact CD1-CE2 3.77Å; I587-F786 HydrophobicContact CD1-CZ 4.07Å; I587-F786 HydrophobicContact CG2-CZ 4.28Å
588	N	89.1	Confident	80.2	Confident	53 Å²	53	47.4 Å²	47.4	28%	0.283	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	114.6	173.8	-62.5	-42.8	0	0	0	108.7	R591 N596	N588-R591 HydrophobicContact CB-CB 4.47Å; N588-N596 VanDerWaalsContact O-CB 3.23Å; N588-N596 WeakPolarHBondContact O-CB 3.3Å; N588-N596 PolarHBondContact O-ND2 3.29Å
589	L	90.2	Very high	81.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-43.6	176.1	-60	178.9	0	0	0	110.4	I587 N596 Y599 F603 I606 F690 V692 F786	I587-L589 HydrophobicContact CG2-CD2 4.03Å; I587-L589 PolarHBondContact O-N 3.17Å; L589-N596 WeakPolarHBondContact O-CB 3.34Å; L589-N596 PolarHBondContact O-N 3.17Å; L589-Y599 VanDerWaalsContact CD2-CB 3.44Å; L589-Y599 HydrophobicContact CD2-CD1 4.39Å; L589-Y599 HydrophobicContact CD2-CD2 3.66Å; L589-Y599 HydrophobicContact CD2-CG 3.57Å; L589-F603 HydrophobicContact CB-CE1 3.89Å; L589-F603 HydrophobicContact CB-CZ 4.06Å; L589-F603 HydrophobicContact CD2-CE1 4.28Å; L589-F603 HydrophobicContact CG-CE1 4.47Å; L589-I606 HydrophobicContact CD1-CD1 3.75Å; L589-F690 WeakPolarHBondContact CA-O 3.26Å; L589-F690 HydrophobicContact CB-CD1 3.6Å; L589-F690 HydrophobicContact CB-CE1 3.9Å; L589-F690 HydrophobicContact CB-CG 4Å; L589-F690 WeakPolarHBondContact CB-O 3.45Å; L589-F690 HydrophobicContact CD1-CD1 3.92Å; L589-F690 HydrophobicContact CD1-CD2 4.11Å; L589-F690 HydrophobicContact CD1-CE1 3.43Å; L589-F690 VanDerWaalsContact CD1-CE1 3.43Å; L589-F690 HydrophobicContact CD1-CE2 3.67Å; L589-F690 HydrophobicContact CD1-CG 4.24Å; L589-F690 HydrophobicContact CD1-CZ 3.31Å; L589-F690 HydrophobicContact CG-CD1 4.4Å; L589-F690 HydrophobicContact CG-CE1 4.32Å; L589-F690 PolarHBondContact N-O 3.33Å; L589-V692 HydrophobicContact CD1-CG2 3.7Å; L589-V692 HydrophobicContact CG-CG2 4.4Å; L589-F786 HydrophobicContact CD2-CZ 4.42Å
590	I	89	Confident	82	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.1	168.5	-54.5	171.8	0	0	0	107.7	V594 I595 F603 I688 L689 F690	I590-V594 WeakPolarHBondContact CA-O 3.28Å; I590-I595 HydrophobicContact CG1-CG1 4.49Å; I590-F603 HydrophobicContact CD1-CE2 3.89Å; I590-F603 HydrophobicContact CD1-CZ 4.47Å; I590-F603 HydrophobicContact CG1-CE2 3.89Å; I590-F603 HydrophobicContact CG1-CZ 3.99Å; I590-I688 HydrophobicContact CG2-CB 4.4Å; I590-L689 WeakPolarHBondContact O-CA 3.26Å; I590-F690 HydrophobicContact CB-CB 3.93Å; I590-F690 HydrophobicContact CD1-CB 4.4Å; I590-F690 HydrophobicContact CD1-CD1 4.02Å; I590-F690 HydrophobicContact CG1-CB 4.25Å; I590-F690 HydrophobicContact CG1-CD1 4.08Å; I590-F690 PolarHBondContact N-O 3.28Å; I590-F690 PolarHBondContact O-N 3.38Å
591	R	87.3	Confident	83.1	Confident	85 Å²	85	52 Å²	52	32%	0.321	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	115.2	171.7	-177.2	177.5	173.8	-176.7	-5.7	111.1	A33 N588 Q593 V594 I688 L689	A33-R591 VanDerWaalsContact C-NH2 3.31Å; A33-R591 VanDerWaalsContact CB-NH1 3.33Å; A33-R591 PolarHBondContact O-NH1 3.49Å; A33-R591 PolarHBondContact O-NH2 2.65Å; N588-R591 HydrophobicContact CB-CB 4.47Å; R591-Q593 PolarHBondContact O-N 3.41Å; R591-V594 PolarHBondContact N-O 3.36Å; R591-V594 WeakPolarHBondContact O-CB 3.46Å; R591-V594 PolarHBondContact O-N 2.85Å; R591-I688 CarbonylContact C-O 3.54Å; R591-I688 VanDerWaalsContact CA-O 3.29Å; R591-I688 WeakPolarHBondContact CA-O 3.2Å; R591-L689 HydrophobicContact CG-CD1 4.39Å
592	G	85.9	Confident	84.3	Confident	22 Å²	22	43.3 Å²	43.3	23%	0.227	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.1	-115.9	-169.8	0	0	0	0	0	108.8	N687 I688	G592-N687 WeakPolarHBondContact CA-OD1 3.26Å; G592-I688 PolarHBondContact N-O 3.43Å; G592-I688 PolarHBondContact O-N 3.09Å
593	Q	82.8	Confident	85.4	Confident	40 Å²	40	44 Å²	44	19%	0.187	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-0.2	175.1	-57.6	179.3	-5.8	0	0	113	D250 R282 R591	D250-Q593 PolarHBondContact OD1-NE2 3.24Å; R282-Q593 HydrophobicContact CG-CB 4.42Å; R591-Q593 PolarHBondContact O-N 3.41Å
594	V	85.8	Confident	86.2	Confident	46 Å²	46	51.1 Å²	51.1	28%	0.279	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.7	-176.6	-176	0	0	0	0	109.8	H281 I590 R591	H281-V594 WeakPolarHBondContact O-CG1 3.35Å; H281-V594 WeakPolarHBondContact O-CG2 3.3Å; I590-V594 WeakPolarHBondContact CA-O 3.28Å; R591-V594 PolarHBondContact N-O 3.36Å; R591-V594 WeakPolarHBondContact O-CB 3.46Å; R591-V594 PolarHBondContact O-N 2.85Å
595	I	88.6	Confident	86.8	Confident	29 Å²	29	52.3 Å²	52.3	15%	0.149	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130.2	177.3	-55	168.5	0	0	0	109.5	R282 I590 M597 L600 F603	R282-I595 WeakPolarHBondContact O-CB 3.35Å; R282-I595 PolarHBondContact O-N 3.18Å; I590-I595 HydrophobicContact CG1-CG1 4.49Å; I595-M597 WeakPolarHBondContact O-CE 3.49Å; I595-M597 PolarHBondContact O-N 3.1Å; I595-M597 VanDerWaalsContact O-N 3.11Å; I595-L600 HydrophobicContact CG2-CD2 3.54Å; I595-L600 HydrophobicContact CG2-CG 4.27Å; I595-F603 HydrophobicContact CG2-CE2 3.83Å; I595-F603 HydrophobicContact CG2-CZ 3.82Å
596	N	89.4	Confident	87.4	Confident	36 Å²	36	50.9 Å²	50.9	19%	0.193	24%	0.243	C	C	.	.			trans	-80.4	94.2	174.7	-166	-24	0	0	0	110.7	N588 L589 R598 Y599	N588-N596 VanDerWaalsContact O-CB 3.23Å; N588-N596 WeakPolarHBondContact O-CB 3.3Å; N588-N596 PolarHBondContact O-ND2 3.29Å; L589-N596 WeakPolarHBondContact O-CB 3.34Å; L589-N596 PolarHBondContact O-N 3.17Å; N596-R598 PolarHBondContact O-N 3.05Å; N596-R598 WeakPolarHBondContact OD1-CB 3.39Å; N596-R598 PolarHBondContact OD1-N 2.73Å; N596-Y599 HydrophobicContact CB-CD2 4.17Å; N596-Y599 WeakPolarHBondContact ND2-CE2 3.25Å; N596-Y599 PolarHBondContact O-N 3.27Å; N596-Y599 VanDerWaalsContact O-N 3.15Å
597	M	86.3	Confident	87.8	Confident	34 Å²	34	46.8 Å²	46.8	17%	0.167	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-51.4	-27.9	-178.5	70	-106.8	59.5	0	0	114.9	L285 P505 I595 Y599 L600	L285-M597 HydrophobicContact CD1-CG 4.21Å; L285-M597 HydrophobicContact CD1-SD 3.95Å; L285-M597 HydrophobicContact CG-SD 4.49Å; P505-M597 HydrophobicContact CB-CB 4.31Å; P505-M597 HydrophobicContact CB-CG 3.85Å; I595-M597 WeakPolarHBondContact O-CE 3.49Å; I595-M597 PolarHBondContact O-N 3.1Å; I595-M597 VanDerWaalsContact O-N 3.11Å; M597-Y599 PolarHBondContact O-N 3.35Å; M597-L600 HydrophobicContact CB-CD1 4.02Å; M597-L600 PolarHBondContact O-N 2.97Å
598	R	88.5	Confident	87.7	Confident	93 Å²	93	50.9 Å²	50.9	35%	0.351	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-60.4	-28.6	-178.1	-68.8	175.8	-178.6	175.2	3.8	112.5	P505 G506 F507 N596	P505-R598 VanDerWaalsContact O-CG 3.24Å; P505-R598 WeakPolarHBondContact O-CG 3.38Å; G506-R598 PolarHBondContact O-NE 3.1Å; G506-R598 VanDerWaalsContact O-NE 3.16Å; G506-R598 PolarHBondContact O-NH2 2.66Å; F507-R598 HydrophobicContact CD2-CG 4.2Å; F507-R598 HydrophobicContact CE2-CB 3.97Å; F507-R598 HydrophobicContact CE2-CG 3.7Å; F507-R598 HydrophobicContact CZ-CG 4.44Å; N596-R598 PolarHBondContact O-N 3.05Å; N596-R598 WeakPolarHBondContact OD1-CB 3.39Å; N596-R598 PolarHBondContact OD1-N 2.73Å
599	Y	90	Very high	87.5	Confident	26 Å²	26	51.1 Å²	51.1	10%	0.102	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-114.5	5.3	-170.8	-55.3	-74.3	0	0	0	113.5	I587 L589 N596 M597 E601 Y602 F603 L783 F786	I587-Y599 HydrophobicContact CG2-CD2 3.97Å; I587-Y599 HydrophobicContact CG2-CE1 4.27Å; I587-Y599 HydrophobicContact CG2-CE2 3.39Å; L589-Y599 VanDerWaalsContact CD2-CB 3.44Å; L589-Y599 HydrophobicContact CD2-CD1 4.39Å; L589-Y599 HydrophobicContact CD2-CD2 3.66Å; L589-Y599 HydrophobicContact CD2-CG 3.57Å; N596-Y599 HydrophobicContact CB-CD2 4.17Å; N596-Y599 WeakPolarHBondContact ND2-CE2 3.25Å; N596-Y599 PolarHBondContact O-N 3.27Å; N596-Y599 VanDerWaalsContact O-N 3.15Å; M597-Y599 PolarHBondContact O-N 3.35Å; Y599-E601 VanDerWaalsContact C-N 3.26Å; Y599-E601 PolarHBondContact O-N 3.02Å; Y599-Y602 WeakPolarHBondContact O-CA 3.47Å; Y599-Y602 WeakPolarHBondContact O-CB 3.29Å; Y599-Y602 PolarHBondContact O-N 2.74Å; Y599-F603 WeakPolarHBondContact O-CD1 3.18Å; Y599-L783 HydrophobicContact CD1-CD1 3.49Å; Y599-L783 VanDerWaalsContact CD1-CD1 3.49Å; Y599-L783 HydrophobicContact CE1-CD1 3.45Å; Y599-L783 VanDerWaalsContact CE1-CD1 3.45Å; Y599-F786 HydrophobicContact CD1-CD1 4.22Å; Y599-F786 AromaticContact CD1-CD2 3.83Å; Y599-F786 HydrophobicContact CD1-CD2 3.83Å; Y599-F786 AromaticContact CD1-CE1 3.84Å; Y599-F786 HydrophobicContact CD1-CE1 3.84Å; Y599-F786 AromaticContact CD1-CE2 3.45Å; Y599-F786 HydrophobicContact CD1-CE2 3.45Å; Y599-F786 VanDerWaalsContact CD1-CE2 3.45Å; Y599-F786 HydrophobicContact CD1-CG 4.21Å; Y599-F786 AromaticContact CD1-CZ 3.44Å; Y599-F786 HydrophobicContact CD1-CZ 3.44Å; Y599-F786 VanDerWaalsContact CD1-CZ 3.44Å; Y599-F786 AromaticContact CE1-CD2 3.6Å; Y599-F786 HydrophobicContact CE1-CD2 3.6Å; Y599-F786 HydrophobicContact CE1-CE1 4.35Å; Y599-F786 AromaticContact CE1-CE2 3.09Å; Y599-F786 HydrophobicContact CE1-CE2 3.09Å; Y599-F786 HydrophobicContact CE1-CG 4.41Å; Y599-F786 AromaticContact CE1-CZ 3.54Å; Y599-F786 HydrophobicContact CE1-CZ 3.54Å; Y599-F786 HydrophobicContact CG-CZ 4.22Å
600	L	86.6	Confident	87.2	Confident	75 Å²	75	51.1 Å²	51.1	39%	0.393	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-51.7	-43.8	-177.3	-81.8	170	0	0	0	112.9	I595 M597 Y602 F603	I595-L600 HydrophobicContact CG2-CD2 3.54Å; I595-L600 HydrophobicContact CG2-CG 4.27Å; M597-L600 HydrophobicContact CB-CD1 4.02Å; M597-L600 PolarHBondContact O-N 2.97Å; L600-Y602 PolarHBondContact O-N 3.38Å; L600-F603 HydrophobicContact CD2-CD2 4.25Å; L600-F603 HydrophobicContact CD2-CE2 3.97Å; L600-F603 HydrophobicContact CD2-CZ 4.24Å; L600-F603 WeakPolarHBondContact O-CB 3.39Å; L600-F603 PolarHBondContact O-N 3.3Å
601	E	88	Confident	87.1	Confident	122 Å²	122	52.7 Å²	52.7	57%	0.57	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-62.1	-14.9	179	-61.9	-67.8	156.8	0	0	113.7	Y599	Y599-E601 VanDerWaalsContact C-N 3.26Å; Y599-E601 PolarHBondContact O-N 3.02Å
602	Y	89.9	Confident	87	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-100.2	-8.2	179.1	-69	-85.7	0	0	0	113.3	Y599 L600 E604 K605 I606 K782 L783 F786 E787	Y599-Y602 WeakPolarHBondContact O-CA 3.47Å; Y599-Y602 WeakPolarHBondContact O-CB 3.29Å; Y599-Y602 PolarHBondContact O-N 2.74Å; L600-Y602 PolarHBondContact O-N 3.38Å; Y602-E604 VanDerWaalsContact C-N 3.3Å; Y602-E604 PolarHBondContact O-N 3.41Å; Y602-K605 HydrophobicContact CD1-CD 4.12Å; Y602-K605 HydrophobicContact CE1-CD 4.4Å; Y602-K605 PolarHBondContact O-N 3.21Å; Y602-I606 VanDerWaalsContact O-CG1 3.26Å; Y602-I606 WeakPolarHBondContact O-CG1 3.24Å; Y602-I606 PolarHBondContact O-N 2.89Å; Y602-K782 VanDerWaalsContact OH-CA 3.32Å; Y602-K782 WeakPolarHBondContact OH-CA 3.49Å; Y602-L783 HydrophobicContact CE2-CB 3.96Å; Y602-L783 HydrophobicContact CE2-CD1 4.26Å; Y602-L783 HydrophobicContact CE2-CG 4.1Å; Y602-L783 PolarHBondContact OH-N 3.16Å; Y602-L783 PolarHBondContact OH-O 3.05Å; Y602-F786 HydrophobicContact CD1-CB 3.85Å; Y602-F786 HydrophobicContact CD1-CD1 4.11Å; Y602-F786 HydrophobicContact CD1-CG 4.43Å; Y602-F786 HydrophobicContact CD2-CB 4.32Å; Y602-F786 HydrophobicContact CD2-CD1 4.4Å; Y602-F786 HydrophobicContact CE1-CB 3.7Å; Y602-F786 HydrophobicContact CE2-CB 4.18Å; Y602-F786 HydrophobicContact CG-CB 4.18Å; Y602-F786 AromaticContact CG-CD1 3.92Å; Y602-F786 HydrophobicContact CG-CD1 3.92Å; Y602-F786 HydrophobicContact CG-CG 4.37Å; Y602-E787 HydrophobicContact CE1-CG 4.04Å; Y602-E787 WeakPolarHBondContact CE1-OE1 3.2Å; Y602-E787 VanDerWaalsContact OH-CG 3.23Å; Y602-E787 WeakPolarHBondContact OH-CG 3.41Å; Y602-E787 PolarHBondContact OH-OE1 3.17Å
603	F	89.1	Confident	86.8	Confident	30 Å²	30	54.3 Å²	54.3	13%	0.132	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-41.6	-175.9	-79.3	22.9	0	0	0	111.3	L589 I590 I595 Y599 L600 I606 L607 F690	L589-F603 HydrophobicContact CB-CE1 3.89Å; L589-F603 HydrophobicContact CB-CZ 4.06Å; L589-F603 HydrophobicContact CD2-CE1 4.28Å; L589-F603 HydrophobicContact CG-CE1 4.47Å; I590-F603 HydrophobicContact CD1-CE2 3.89Å; I590-F603 HydrophobicContact CD1-CZ 4.47Å; I590-F603 HydrophobicContact CG1-CE2 3.89Å; I590-F603 HydrophobicContact CG1-CZ 3.99Å; I595-F603 HydrophobicContact CG2-CE2 3.83Å; I595-F603 HydrophobicContact CG2-CZ 3.82Å; Y599-F603 WeakPolarHBondContact O-CD1 3.18Å; L600-F603 HydrophobicContact CD2-CD2 4.25Å; L600-F603 HydrophobicContact CD2-CE2 3.97Å; L600-F603 HydrophobicContact CD2-CZ 4.24Å; L600-F603 WeakPolarHBondContact O-CB 3.39Å; L600-F603 PolarHBondContact O-N 3.3Å; F603-I606 PolarHBondContact O-N 2.96Å; F603-L607 WeakPolarHBondContact O-CB 3.41Å; F603-L607 PolarHBondContact O-N 3.37Å; F603-F690 HydrophobicContact CD1-CE1 4.41Å; F603-F690 HydrophobicContact CE1-CE1 4.47Å
604	E	87.8	Confident	86.7	Confident	164 Å²	164	52.8 Å²	52.8	77%	0.766	25%	0.245	S	C	*	.	H	α-helix	trans	-64.2	-45.3	177.1	-67	-172.1	165.3	0	0	112.7	Y602 I606 L607 H608	Y602-E604 VanDerWaalsContact C-N 3.3Å; Y602-E604 PolarHBondContact O-N 3.41Å; E604-I606 VanDerWaalsContact C-N 3.34Å; E604-I606 PolarHBondContact O-N 3.43Å; E604-L607 PolarHBondContact O-N 3.05Å; E604-H608 PolarHBondContact O-N 3.47Å
605	K	85.8	Confident	86.6	Confident	77 Å²	77	51.9 Å²	51.9	34%	0.335	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-45.3	177.5	-73.7	-175.2	173.7	-174.3	0	111.1	Y602 H608 F609 E787	Y602-K605 HydrophobicContact CD1-CD 4.12Å; Y602-K605 HydrophobicContact CE1-CD 4.4Å; Y602-K605 PolarHBondContact O-N 3.21Å; K605-H608 PolarHBondContact O-N 3.46Å; K605-F609 WeakPolarHBondContact O-CB 3.46Å; K605-F609 PolarHBondContact O-N 2.86Å; K605-E787 IonicContact NZ-OE1 3.73Å; K605-E787 PolarHBondContact NZ-OE1 2.72Å; K605-E787 IonicContact NZ-OE2 2.72Å; K605-E787 PolarHBondContact NZ-OE2 3.47Å
606	I	87.9	Confident	86.4	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-67.8	-40.4	179.3	-61.8	165.7	0	0	0	110.2	L589 Y602 F603 E604 H608 F609 I610 I678 F690 F786	L589-I606 HydrophobicContact CD1-CD1 3.75Å; Y602-I606 VanDerWaalsContact O-CG1 3.26Å; Y602-I606 WeakPolarHBondContact O-CG1 3.24Å; Y602-I606 PolarHBondContact O-N 2.89Å; F603-I606 PolarHBondContact O-N 2.96Å; E604-I606 VanDerWaalsContact C-N 3.34Å; E604-I606 PolarHBondContact O-N 3.43Å; I606-H608 PolarHBondContact O-N 3.49Å; I606-F609 WeakPolarHBondContact O-CB 3.28Å; I606-F609 PolarHBondContact O-N 2.89Å; I606-I610 HydrophobicContact CG2-CD1 3.78Å; I606-I610 HydrophobicContact CG2-CG1 4.26Å; I606-I610 WeakPolarHBondContact O-CD1 3.17Å; I606-I610 WeakPolarHBondContact O-CG1 3.49Å; I606-I610 PolarHBondContact O-N 2.71Å; I606-I678 HydrophobicContact CG2-CD1 3.75Å; I606-I678 HydrophobicContact CG2-CG1 4.43Å; I606-F690 HydrophobicContact CB-CZ 4.28Å; I606-F690 HydrophobicContact CD1-CZ 4.48Å; I606-F690 HydrophobicContact CG2-CE2 4.01Å; I606-F690 HydrophobicContact CG2-CZ 3.59Å; I606-F786 HydrophobicContact CD1-CD1 4.48Å; I606-F786 HydrophobicContact CD1-CE1 4.02Å
607	L	87.6	Confident	85.9	Confident	13 Å²	13	59.3 Å²	59.3	7%	0.068	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-47.3	175.5	178.8	59.1	0	0	0	111.4	F603 E604 F609 I610 K611 V636 H637 V639 L642	F603-L607 WeakPolarHBondContact O-CB 3.41Å; F603-L607 PolarHBondContact O-N 3.37Å; E604-L607 PolarHBondContact O-N 3.05Å; L607-F609 VanDerWaalsContact C-N 3.35Å; L607-F609 PolarHBondContact O-N 3.45Å; L607-I610 PolarHBondContact O-N 3.02Å; L607-K611 WeakPolarHBondContact O-CG 3.34Å; L607-K611 PolarHBondContact O-N 2.91Å; L607-V636 HydrophobicContact CD1-CG1 3.86Å; L607-V636 HydrophobicContact CD2-CG1 4.44Å; L607-H637 WeakPolarHBondContact CD2-O 3.46Å; L607-V639 HydrophobicContact CD1-CG2 4.45Å; L607-L642 HydrophobicContact CD1-CD1 3.42Å; L607-L642 VanDerWaalsContact CD1-CD1 3.42Å; L607-L642 HydrophobicContact CD1-CD2 4.38Å; L607-L642 HydrophobicContact CD1-CG 3.89Å
608	H	86.8	Confident	85.4	Confident	117 Å²	117	58.6 Å²	58.6	54%	0.542	27%	0.269	S	S	.	.	H	α-helix	trans	-58.8	-47.7	175.8	-177	48.4	0	0	0	111.4	E604 K605 I606 I610 K611 D612	E604-H608 PolarHBondContact O-N 3.47Å; K605-H608 PolarHBondContact O-N 3.46Å; I606-H608 PolarHBondContact O-N 3.49Å; H608-I610 VanDerWaalsContact C-N 3.33Å; H608-I610 PolarHBondContact O-N 3.33Å; H608-K611 WeakPolarHBondContact O-CB 3.33Å; H608-K611 PolarHBondContact O-N 3.45Å; H608-D612 IonicContact CE1-OD1 3.18Å; H608-D612 IonicContact CE1-OD2 2.67Å; H608-D612 IonicContact NE2-OD2 3.4Å; H608-D612 PolarHBondContact O-N 3.13Å
609	F	83.4	Confident	85	Confident	58 Å²	58	55.6 Å²	55.6	25%	0.254	27%	0.268	S	S	.	.	H	α-helix	trans	-57.4	-44.4	176.3	177	-90.7	0	0	0	112.6	K605 I606 L607 K611 D612 R613 V659 T661 I678	K605-F609 WeakPolarHBondContact O-CB 3.46Å; K605-F609 PolarHBondContact O-N 2.86Å; I606-F609 WeakPolarHBondContact O-CB 3.28Å; I606-F609 PolarHBondContact O-N 2.89Å; L607-F609 VanDerWaalsContact C-N 3.35Å; L607-F609 PolarHBondContact O-N 3.45Å; F609-K611 PolarHBondContact O-N 3.28Å; F609-D612 PolarHBondContact O-N 2.78Å; F609-R613 HydrophobicContact CD1-CG 4.21Å; F609-R613 HydrophobicContact CE1-CG 3.64Å; F609-R613 HydrophobicContact CE2-CG 4.11Å; F609-R613 HydrophobicContact CZ-CG 3.57Å; F609-R613 WeakPolarHBondContact O-CG 3.49Å; F609-R613 PolarHBondContact O-N 3.25Å; F609-R613 VanDerWaalsContact O-N 3.09Å; F609-V659 HydrophobicContact CE1-CG1 4.12Å; F609-T661 HydrophobicContact CD1-CG2 4.26Å; F609-T661 HydrophobicContact CE1-CG2 3.32Å; F609-T661 HydrophobicContact CE2-CG2 4.11Å; F609-T661 HydrophobicContact CZ-CG2 3.23Å; F609-I678 HydrophobicContact CD1-CD1 3.61Å; F609-I678 HydrophobicContact CE1-CD1 3.86Å
610	I	84.4	Confident	84.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-47.7	177.5	-70.3	158.8	0	0	0	110.6	I606 L607 H608 D612 R613 I614 L642 F657 I678 I680 F690	I606-I610 HydrophobicContact CG2-CD1 3.78Å; I606-I610 HydrophobicContact CG2-CG1 4.26Å; I606-I610 WeakPolarHBondContact O-CD1 3.17Å; I606-I610 WeakPolarHBondContact O-CG1 3.49Å; I606-I610 PolarHBondContact O-N 2.71Å; L607-I610 PolarHBondContact O-N 3.02Å; H608-I610 VanDerWaalsContact C-N 3.33Å; H608-I610 PolarHBondContact O-N 3.33Å; I610-D612 VanDerWaalsContact C-N 3.31Å; I610-D612 PolarHBondContact O-N 2.82Å; I610-R613 PolarHBondContact O-N 2.91Å; I610-I614 HydrophobicContact CG2-CD1 3.61Å; I610-I614 HydrophobicContact CG2-CG1 4.25Å; I610-I614 VanDerWaalsContact O-CG1 3.31Å; I610-I614 WeakPolarHBondContact O-CG1 3.36Å; I610-I614 PolarHBondContact O-N 2.83Å; I610-L642 HydrophobicContact CB-CD1 4.38Å; I610-L642 HydrophobicContact CD1-CD1 4.26Å; I610-L642 HydrophobicContact CG2-CD1 3.7Å; I610-F657 HydrophobicContact CG2-CE2 3.73Å; I610-F657 HydrophobicContact CG2-CZ 3.69Å; I610-I678 HydrophobicContact CD1-CD1 4.46Å; I610-I678 HydrophobicContact CD1-CG2 4.05Å; I610-I678 HydrophobicContact CG1-CD1 3.87Å; I610-I678 HydrophobicContact CG1-CG2 4.24Å; I610-I680 HydrophobicContact CD1-CD1 3.65Å; I610-F690 HydrophobicContact CD1-CE2 4.27Å; I610-F690 HydrophobicContact CD1-CZ 4.46Å
611	K	86.9	Confident	84.1	Confident	39 Å²	39	59.7 Å²	59.7	17%	0.17	30%	0.303	C	S	.	.	H	α-helix	trans	-56.7	-46.4	179	-69.8	-179.1	-177.6	-164.1	0	111.3	L607 H608 F609 R613 I614 L615 L633 V636	L607-K611 WeakPolarHBondContact O-CG 3.34Å; L607-K611 PolarHBondContact O-N 2.91Å; H608-K611 WeakPolarHBondContact O-CB 3.33Å; H608-K611 PolarHBondContact O-N 3.45Å; F609-K611 PolarHBondContact O-N 3.28Å; K611-R613 VanDerWaalsContact C-N 3.33Å; K611-R613 PolarHBondContact O-N 3.44Å; K611-I614 PolarHBondContact O-N 3.26Å; K611-L615 WeakPolarHBondContact O-CG 3.42Å; K611-L615 PolarHBondContact O-N 2.85Å; K611-L633 HydrophobicContact CB-CD1 4.35Å; K611-L633 VanDerWaalsContact CE-O 3.31Å; K611-L633 WeakPolarHBondContact CE-O 3.37Å; K611-L633 HydrophobicContact CG-CB 4.44Å; K611-L633 HydrophobicContact CG-CD2 4.3Å; K611-L633 PolarHBondContact NZ-O 3.5Å; K611-V636 PolarHBondContact NZ-O 3.21Å
612	D	85.3	Confident	83.6	Confident	70 Å²	70	57.7 Å²	57.7	37%	0.374	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-42.9	178.9	-70.3	-13.3	0	0	0	111.8	H608 F609 I610 L615 V616	H608-D612 IonicContact CE1-OD1 3.18Å; H608-D612 IonicContact CE1-OD2 2.67Å; H608-D612 IonicContact NE2-OD2 3.4Å; H608-D612 PolarHBondContact O-N 3.13Å; F609-D612 PolarHBondContact O-N 2.78Å; I610-D612 VanDerWaalsContact C-N 3.31Å; I610-D612 PolarHBondContact O-N 2.82Å; D612-L615 WeakPolarHBondContact O-CB 3.4Å; D612-L615 PolarHBondContact O-N 2.82Å; D612-V616 WeakPolarHBondContact O-CG2 3.45Å; D612-V616 PolarHBondContact O-N 3.29Å
613	R	81.7	Confident	82.9	Confident	71 Å²	71	62 Å²	62	27%	0.268	32%	0.324	S	S	.	.	H	α-helix	trans	-69.8	-35.7	179.4	-63.3	-65.1	-87.5	176	-7.5	112.9	F609 I610 K611 L615 V616 Y617 V659 N660	F609-R613 HydrophobicContact CD1-CG 4.21Å; F609-R613 HydrophobicContact CE1-CG 3.64Å; F609-R613 HydrophobicContact CE2-CG 4.11Å; F609-R613 HydrophobicContact CZ-CG 3.57Å; F609-R613 WeakPolarHBondContact O-CG 3.49Å; F609-R613 PolarHBondContact O-N 3.25Å; F609-R613 VanDerWaalsContact O-N 3.09Å; I610-R613 PolarHBondContact O-N 2.91Å; K611-R613 VanDerWaalsContact C-N 3.33Å; K611-R613 PolarHBondContact O-N 3.44Å; R613-L615 VanDerWaalsContact C-N 3.31Å; R613-V616 PolarHBondContact O-N 2.93Å; R613-Y617 WeakPolarHBondContact O-CB 3.35Å; R613-Y617 PolarHBondContact O-N 2.66Å; R613-V659 HydrophobicContact CB-CG1 3.44Å; R613-V659 VanDerWaalsContact CB-CG1 3.44Å; R613-V659 HydrophobicContact CG-CG1 3.65Å; R613-N660 PolarHBondContact NE-O 3.39Å; R613-N660 PolarHBondContact NH2-O 3.38Å
614	I	81.1	Confident	82.2	Confident	7 Å²	7	70 Å²	70	4%	0.036	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-46.4	171.8	-68.3	165.4	0	0	0	109.4	I610 K611 V616 Y617 H618 V629 L633 L642 M646 F657	I610-I614 HydrophobicContact CG2-CD1 3.61Å; I610-I614 HydrophobicContact CG2-CG1 4.25Å; I610-I614 VanDerWaalsContact O-CG1 3.31Å; I610-I614 WeakPolarHBondContact O-CG1 3.36Å; I610-I614 PolarHBondContact O-N 2.83Å; K611-I614 PolarHBondContact O-N 3.26Å; I614-V616 PolarHBondContact O-N 2.79Å; I614-Y617 PolarHBondContact O-N 3.5Å; I614-H618 PolarHBondContact O-CD2 3.3Å; I614-H618 VanDerWaalsContact O-CD2 3.28Å; I614-H618 PolarHBondContact O-N 2.93Å; I614-V629 HydrophobicContact CG2-CG1 3.96Å; I614-L633 HydrophobicContact CB-CD1 4.13Å; I614-L633 HydrophobicContact CD1-CD2 4.12Å; I614-L633 HydrophobicContact CG2-CD1 3.86Å; I614-L642 HydrophobicContact CD1-CD2 4.14Å; I614-M646 HydrophobicContact CD1-CE 3.92Å; I614-M646 HydrophobicContact CD1-CG 4.44Å; I614-M646 HydrophobicContact CD1-SD 3.69Å; I614-M646 HydrophobicContact CG1-CE 4.37Å; I614-M646 HydrophobicContact CG1-SD 4.02Å; I614-M646 HydrophobicContact CG2-CE 3.67Å; I614-M646 HydrophobicContact CG2-SD 4.26Å; I614-F657 HydrophobicContact CD1-CE2 4.15Å; I614-F657 HydrophobicContact CD1-CZ 4.24Å; I614-F657 HydrophobicContact CG1-CE2 4.38Å
615	L	84.5	Confident	81.8	Confident	27 Å²	27	62.7 Å²	62.7	14%	0.141	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-42.1	177.7	-68.1	174.9	0	0	0	112.5	K611 D612 R613 G619 L626 V629 R630 L633	K611-L615 WeakPolarHBondContact O-CG 3.42Å; K611-L615 PolarHBondContact O-N 2.85Å; D612-L615 WeakPolarHBondContact O-CB 3.4Å; D612-L615 PolarHBondContact O-N 2.82Å; R613-L615 VanDerWaalsContact C-N 3.31Å; L615-G619 PolarHBondContact O-N 3.37Å; L615-L626 HydrophobicContact CD2-CD1 4Å; L615-L626 WeakPolarHBondContact O-CD1 3.26Å; L615-V629 HydrophobicContact CD2-CG1 4.39Å; L615-R630 HydrophobicContact CD2-CB 4.05Å; L615-L633 HydrophobicContact CD2-CD1 3.93Å; L615-L633 HydrophobicContact CG-CD1 3.93Å
616	V	82.9	Confident	81.6	Confident	88 Å²	88	61.1 Å²	61.1	53%	0.533	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-45.9	175.7	171.5	0	0	0	0	111.1	D612 R613 I614 G619 A620	D612-V616 WeakPolarHBondContact O-CG2 3.45Å; D612-V616 PolarHBondContact O-N 3.29Å; R613-V616 PolarHBondContact O-N 2.93Å; I614-V616 PolarHBondContact O-N 2.79Å; V616-G619 PolarHBondContact O-N 3.27Å; V616-A620 PolarHBondContact O-N 3.03Å; V616-A620 VanDerWaalsContact O-N 3.1Å
617	Y	79	Confident	81.4	Confident	134 Å²	134	66.5 Å²	66.5	53%	0.525	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-46.5	179.5	178.2	-93	0	0	0	112.3	R613 I614 A620 N621	R613-Y617 WeakPolarHBondContact O-CB 3.35Å; R613-Y617 PolarHBondContact O-N 2.66Å; I614-Y617 PolarHBondContact O-N 3.5Å; Y617-A620 PolarHBondContact O-N 3.19Å; Y617-N621 WeakPolarHBondContact CD2-ND2 3.45Å; Y617-N621 WeakPolarHBondContact CE2-ND2 3.42Å; Y617-N621 VanDerWaalsContact CZ-ND2 3.3Å; Y617-N621 WeakPolarHBondContact O-CB 3.32Å; Y617-N621 PolarHBondContact O-N 2.87Å; Y617-N621 VanDerWaalsContact O-N 3.08Å; Y617-N621 PolarHBondContact O-ND2 2.97Å
618	H	77.1	Confident	81.2	Confident	18 Å²	18	72.1 Å²	72.1	8%	0.083	38%	0.376	C	S	.	.	H	α-helix	trans	-70.1	-33.5	177.6	-80.6	-88.7	0	0	0	112.3	I614 A620 N621 N622 L626	I614-H618 PolarHBondContact O-CD2 3.3Å; I614-H618 VanDerWaalsContact O-CD2 3.28Å; I614-H618 PolarHBondContact O-N 2.93Å; H618-A620 VanDerWaalsContact C-N 3.31Å; H618-A620 PolarHBondContact O-N 3.35Å; H618-N621 PolarHBondContact O-N 2.95Å; H618-N622 CarbonylContact O-C 3.59Å; H618-N622 WeakPolarHBondContact O-CA 3.22Å; H618-N622 PolarHBondContact O-N 3.2Å; H618-N622 VanDerWaalsContact O-O 3.12Å; H618-L626 HydrophobicContact CB-CD1 4.15Å
619	G	79.3	Confident	81.1	Confident	31 Å²	31	66.6 Å²	66.6	32%	0.32	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-39.7	173.7	0	0	0	0	0	112.5	L615 V616	L615-G619 PolarHBondContact O-N 3.37Å; V616-G619 PolarHBondContact O-N 3.27Å
620	A	80.9	Confident	81.3	Confident	82 Å²	82	69.1 Å²	69.1	68%	0.678	36%	0.358	S	S	*	.	H	α-helix	trans	-74.9	-38.1	178.1	0	0	0	0	0	113.4	V616 Y617 H618	V616-A620 PolarHBondContact O-N 3.03Å; V616-A620 VanDerWaalsContact O-N 3.1Å; Y617-A620 PolarHBondContact O-N 3.19Å; H618-A620 VanDerWaalsContact C-N 3.31Å; H618-A620 PolarHBondContact O-N 3.35Å
621	N	77.3	Confident	81.5	Confident	104 Å²	104	74.2 Å²	74.2	56%	0.556	38%	0.382	S	S	*	.	H	α-helix	trans	-105	-25.4	-169	-65.4	-42.5	0	0	0	114.9	Y617 H618	Y617-N621 WeakPolarHBondContact CD2-ND2 3.45Å; Y617-N621 WeakPolarHBondContact CE2-ND2 3.42Å; Y617-N621 VanDerWaalsContact CZ-ND2 3.3Å; Y617-N621 WeakPolarHBondContact O-CB 3.32Å; Y617-N621 PolarHBondContact O-N 2.87Å; Y617-N621 VanDerWaalsContact O-N 3.08Å; Y617-N621 PolarHBondContact O-ND2 2.97Å; H618-N621 PolarHBondContact O-N 2.95Å
622	N	76.5	Confident	81.4	Confident	80 Å²	80	73.2 Å²	73.2	43%	0.428	38%	0.382	S	S	.	.			trans	-149.4	73.2	-179.5	-173.6	9	0	0	0	112	H618 K624 G625	H618-N622 CarbonylContact O-C 3.59Å; H618-N622 WeakPolarHBondContact O-CA 3.22Å; H618-N622 PolarHBondContact O-N 3.2Å; H618-N622 VanDerWaalsContact O-O 3.12Å; N622-K624 PolarHBondContact O-N 3.39Å; N622-G625 PolarHBondContact O-N 3.4Å
623	P	75.4	Confident	81.5	Confident	92 Å²	92	70.2 Å²	70.2	60%	0.597	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-65	-23.8	-174.4	23.8	-33.6	0	0	0	114.1	L626	P623-L626 WeakPolarHBondContact O-CB 3.18Å
624	K	75.5	Confident	81.8	Confident	198 Å²	198	73 Å²	73	86%	0.861	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-73.2	-31.6	179.7	-67.9	-176	179.5	-179.2	0	113.1	N622	N622-K624 PolarHBondContact O-N 3.39Å
625	G	78.1	Confident	82	Confident	9 Å²	9	80.4 Å²	80.4	9%	0.093	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-89.8	2.3	177.6	0	0	0	0	0	114.4	N622 L627 E628 V629	N622-G625 PolarHBondContact O-N 3.4Å; G625-L627 VanDerWaalsContact C-N 3.32Å; G625-L627 PolarHBondContact O-N 3.24Å; G625-E628 PolarHBondContact O-N 3.47Å; G625-V629 WeakPolarHBondContact O-CG2 3.38Å; G625-V629 PolarHBondContact O-N 3.35Å; G625-V629 VanDerWaalsContact O-N 3.12Å
626	L	81.4	Confident	82.1	Confident	44 Å²	44	79.2 Å²	79.2	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-64.1	-35	-173.1	-175.8	65	0	0	0	113.1	L615 H618 P623 R630	L615-L626 HydrophobicContact CD2-CD1 4Å; L615-L626 WeakPolarHBondContact O-CD1 3.26Å; H618-L626 HydrophobicContact CB-CD1 4.15Å; P623-L626 WeakPolarHBondContact O-CB 3.18Å; L626-R630 WeakPolarHBondContact O-CB 3.46Å; L626-R630 PolarHBondContact O-N 3.4Å
627	L	83.8	Confident	82.2	Confident	115 Å²	115	82 Å²	82	60%	0.602	41%	0.414	S	S	*	.	H	α-helix	trans	-68.1	-45.5	179.7	-170.1	68.5	0	0	0	111.2	G625 V629 R630 E631	G625-L627 VanDerWaalsContact C-N 3.32Å; G625-L627 PolarHBondContact O-N 3.24Å; L627-V629 VanDerWaalsContact C-N 3.34Å; L627-V629 PolarHBondContact O-N 3.08Å; L627-R630 WeakPolarHBondContact O-CB 3.33Å; L627-R630 PolarHBondContact O-N 3.22Å; L627-E631 WeakPolarHBondContact O-CG 3.48Å; L627-E631 PolarHBondContact O-N 3.28Å
628	E	84.7	Confident	82.4	Confident	130 Å²	130	82.1 Å²	82.1	61%	0.607	42%	0.417	S	S	*	.	H	α-helix	trans	-60.9	-42.5	176.3	-63.6	176.8	-178.7	0	0	111.7	G625 R630 E631 A632	G625-E628 PolarHBondContact O-N 3.47Å; E628-R630 VanDerWaalsContact C-N 3.35Å; E628-E631 PolarHBondContact O-N 3.1Å; E628-A632 WeakPolarHBondContact O-CB 3.45Å; E628-A632 PolarHBondContact O-N 3.38Å
629	V	84.1	Confident	82.4	Confident	1 Å²	1	81.4 Å²	81.4	1%	0.006	41%	0.414	C	S	.	.	H	α-helix	trans	-64.7	-40.6	176.4	174.3	0	0	0	0	110.8	I614 L615 G625 L627 A632 L633 F649	I614-V629 HydrophobicContact CG2-CG1 3.96Å; L615-V629 HydrophobicContact CD2-CG1 4.39Å; G625-V629 WeakPolarHBondContact O-CG2 3.38Å; G625-V629 PolarHBondContact O-N 3.35Å; G625-V629 VanDerWaalsContact O-N 3.12Å; L627-V629 VanDerWaalsContact C-N 3.34Å; L627-V629 PolarHBondContact O-N 3.08Å; V629-A632 PolarHBondContact O-N 3.28Å; V629-L633 HydrophobicContact CG1-CD1 4Å; V629-L633 HydrophobicContact CG1-CG 4.3Å; V629-L633 VanDerWaalsContact O-CG 3.27Å; V629-L633 WeakPolarHBondContact O-CG 3.31Å; V629-L633 PolarHBondContact O-N 3.18Å; V629-F649 HydrophobicContact CG2-CD1 3.85Å; V629-F649 HydrophobicContact CG2-CD2 4.22Å; V629-F649 HydrophobicContact CG2-CE1 3.85Å; V629-F649 HydrophobicContact CG2-CE2 4.23Å; V629-F649 HydrophobicContact CG2-CG 4.05Å; V629-F649 HydrophobicContact CG2-CZ 4.05Å
630	R	87.2	Confident	82.3	Confident	111 Å²	111	83.1 Å²	83.1	42%	0.419	41%	0.414	S	S	.	.	H	α-helix	trans	-60.7	-49.9	176.6	-179.4	-178.5	-64.1	-81.6	-1.8	111.5	L615 L626 L627 E628 A632 L633 E634	L615-R630 HydrophobicContact CD2-CB 4.05Å; L626-R630 WeakPolarHBondContact O-CB 3.46Å; L626-R630 PolarHBondContact O-N 3.4Å; L627-R630 WeakPolarHBondContact O-CB 3.33Å; L627-R630 PolarHBondContact O-N 3.22Å; E628-R630 VanDerWaalsContact C-N 3.35Å; R630-A632 VanDerWaalsContact C-N 3.28Å; R630-A632 PolarHBondContact O-N 2.94Å; R630-L633 PolarHBondContact O-N 3.35Å; R630-E634 WeakPolarHBondContact O-CG 3.45Å; R630-E634 PolarHBondContact O-N 3Å
631	E	87.9	Confident	82.3	Confident	107 Å²	107	82.3 Å²	82.3	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-36.5	178	-70.3	177.3	-174.6	0	0	112.3	L627 E628	L627-E631 WeakPolarHBondContact O-CG 3.48Å; L627-E631 PolarHBondContact O-N 3.28Å; E628-E631 PolarHBondContact O-N 3.1Å
632	A	85.7	Confident	82.4	Confident	19 Å²	19	77.3 Å²	77.3	16%	0.157	37%	0.372	C	S	.	.	H	α-helix	trans	-65.9	-43.8	174.4	0	0	0	0	0	111.9	E628 V629 R630 E634 K635 I645 F649	E628-A632 WeakPolarHBondContact O-CB 3.45Å; E628-A632 PolarHBondContact O-N 3.38Å; V629-A632 PolarHBondContact O-N 3.28Å; R630-A632 VanDerWaalsContact C-N 3.28Å; R630-A632 PolarHBondContact O-N 2.94Å; A632-E634 VanDerWaalsContact C-N 3.3Å; A632-E634 PolarHBondContact O-N 3.45Å; A632-K635 PolarHBondContact O-N 2.95Å; A632-I645 HydrophobicContact CB-CD1 4.37Å; A632-I645 HydrophobicContact CB-CG2 4.17Å; A632-I645 WeakPolarHBondContact O-CD1 3.31Å; A632-F649 HydrophobicContact CB-CE2 4.02Å; A632-F649 HydrophobicContact CB-CZ 4.38Å
633	L	86.9	Confident	82.5	Confident	6 Å²	6	74 Å²	74	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-69.2	-23.4	179.7	-69	176.7	0	0	0	113.6	K611 I614 L615 V629 R630 K635 V636 L642 I645	K611-L633 HydrophobicContact CB-CD1 4.35Å; K611-L633 VanDerWaalsContact CE-O 3.31Å; K611-L633 WeakPolarHBondContact CE-O 3.37Å; K611-L633 HydrophobicContact CG-CB 4.44Å; K611-L633 HydrophobicContact CG-CD2 4.3Å; K611-L633 PolarHBondContact NZ-O 3.5Å; I614-L633 HydrophobicContact CB-CD1 4.13Å; I614-L633 HydrophobicContact CD1-CD2 4.12Å; I614-L633 HydrophobicContact CG2-CD1 3.86Å; L615-L633 HydrophobicContact CD2-CD1 3.93Å; L615-L633 HydrophobicContact CG-CD1 3.93Å; V629-L633 HydrophobicContact CG1-CD1 4Å; V629-L633 HydrophobicContact CG1-CG 4.3Å; V629-L633 VanDerWaalsContact O-CG 3.27Å; V629-L633 WeakPolarHBondContact O-CG 3.31Å; V629-L633 PolarHBondContact O-N 3.18Å; R630-L633 PolarHBondContact O-N 3.35Å; L633-K635 VanDerWaalsContact C-N 3.27Å; L633-K635 PolarHBondContact O-N 3.38Å; L633-V636 HydrophobicContact CD2-CG2 4.47Å; L633-V636 WeakPolarHBondContact O-CB 3.27Å; L633-V636 PolarHBondContact O-N 3.44Å; L633-L642 HydrophobicContact CD2-CD2 3.72Å; L633-I645 HydrophobicContact CD2-CG2 4.43Å
634	E	87.7	Confident	82.6	Confident	129 Å²	129	73.7 Å²	73.7	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-66.3	-29.5	173.7	-77	176.5	-173.5	0	0	112.4	R630 A632 V636	R630-E634 WeakPolarHBondContact O-CG 3.45Å; R630-E634 PolarHBondContact O-N 3Å; A632-E634 VanDerWaalsContact C-N 3.3Å; A632-E634 PolarHBondContact O-N 3.45Å; E634-V636 VanDerWaalsContact C-N 3.3Å; E634-V636 PolarHBondContact O-N 3.44Å
635	K	86.8	Confident	82.6	Confident	164 Å²	164	65.3 Å²	65.3	71%	0.713	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.2	178.1	-61.1	176.8	-174.8	173.7	0	114.1	A632 L633 H637	A632-K635 PolarHBondContact O-N 2.95Å; L633-K635 VanDerWaalsContact C-N 3.27Å; L633-K635 PolarHBondContact O-N 3.38Å; K635-H637 PolarHBondContact O-CD2 3.29Å
636	V	85.6	Confident	82.3	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.006	32%	0.315	C	S	.	.			trans	-83.5	119.2	-179.3	172.1	0	0	0	0	109.3	L607 K611 L633 E634 K638 D641 L642 I645	L607-V636 HydrophobicContact CD1-CG1 3.86Å; L607-V636 HydrophobicContact CD2-CG1 4.44Å; K611-V636 PolarHBondContact NZ-O 3.21Å; L633-V636 HydrophobicContact CD2-CG2 4.47Å; L633-V636 WeakPolarHBondContact O-CB 3.27Å; L633-V636 PolarHBondContact O-N 3.44Å; E634-V636 VanDerWaalsContact C-N 3.3Å; E634-V636 PolarHBondContact O-N 3.44Å; V636-K638 WeakPolarHBondContact CG1-O 3.45Å; V636-D641 HydrophobicContact CB-CB 4.31Å; V636-D641 HydrophobicContact CG1-CB 4.02Å; V636-D641 HydrophobicContact CG2-CB 4.26Å; V636-L642 HydrophobicContact CB-CD2 4.48Å; V636-L642 HydrophobicContact CG1-CD2 3.72Å; V636-L642 HydrophobicContact CG1-CG 3.69Å; V636-L642 HydrophobicContact CG2-CD2 4.16Å; V636-I645 HydrophobicContact CG2-CD1 3.13Å
637	H	85.6	Confident	82	Confident	146 Å²	146	67.8 Å²	67.8	68%	0.676	32%	0.323	S	S	*	.			trans	-111.4	-23.7	177	-61.4	-60	0	0	0	112.4	L607 K635 D641	L607-H637 WeakPolarHBondContact CD2-O 3.46Å; K635-H637 PolarHBondContact O-CD2 3.29Å; H637-D641 PolarHBondContact N-OD2 3.43Å
638	K	83.3	Confident	81.3	Confident	138 Å²	138	69.1 Å²	69.1	60%	0.6	33%	0.326	S	S	*	.	S	Bend	trans	-129.9	167.8	176.8	-51.4	-177.7	179.5	176	0	111.4	V636 E640 D641	V636-K638 WeakPolarHBondContact CG1-O 3.45Å; K638-E640 WeakPolarHBondContact CB-OE2 3.36Å; K638-E640 PolarHBondContact O-N 3.36Å; K638-D641 PolarHBondContact N-OD2 2.78Å; K638-D641 WeakPolarHBondContact O-CB 3.43Å; K638-D641 PolarHBondContact O-N 3.4Å
639	V	76.7	Confident	80.5	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.018	31%	0.308	C	S	.	.	S	Bend	trans	-67.3	-32	-176	178.8	0	0	0	0	110.8	L607 D641 L642 I680 F690	L607-V639 HydrophobicContact CD1-CG2 4.45Å; V639-D641 PolarHBondContact O-N 3.12Å; V639-L642 WeakPolarHBondContact O-CB 3.39Å; V639-L642 PolarHBondContact O-N 3.48Å; V639-L642 VanDerWaalsContact O-N 3.14Å; V639-I680 HydrophobicContact CG1-CD1 3.6Å; V639-I680 HydrophobicContact CG1-CG1 4.26Å; V639-I680 HydrophobicContact CG1-CG2 4.48Å; V639-F690 HydrophobicContact CB-CD1 4.32Å; V639-F690 HydrophobicContact CB-CE1 4.35Å; V639-F690 HydrophobicContact CG1-CB 4.45Å; V639-F690 HydrophobicContact CG1-CD1 3.81Å; V639-F690 HydrophobicContact CG1-CD2 4.33Å; V639-F690 HydrophobicContact CG1-CE1 4.04Å; V639-F690 HydrophobicContact CG1-CG 3.96Å; V639-F690 HydrophobicContact CG1-CZ 4.37Å; V639-F690 HydrophobicContact CG2-CD1 4.16Å; V639-F690 HydrophobicContact CG2-CE1 3.7Å; V639-F690 HydrophobicContact CG2-CZ 4.17Å
640	E	76.6	Confident	79.4	Confident	67 Å²	67	67.5 Å²	67.5	31%	0.313	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-34.2	177.1	-58	90.1	159.5	0	0	111.8	K638 L642 L643 P644 I688	K638-E640 WeakPolarHBondContact CB-OE2 3.36Å; K638-E640 PolarHBondContact O-N 3.36Å; E640-L642 PolarHBondContact O-N 3.25Å; E640-L643 PolarHBondContact O-N 3.21Å; E640-P644 VanDerWaalsContact O-CD 3.28Å; E640-P644 WeakPolarHBondContact O-CD 3.35Å; E640-I688 HydrophobicContact CB-CD1 3.69Å; E640-I688 HydrophobicContact CG-CD1 3.32Å
641	D	82.1	Confident	77.8	Confident	64 Å²	64	68.3 Å²	68.3	34%	0.342	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-20.3	178.8	-50.9	-31	0	0	0	112.4	V636 H637 K638 V639	V636-D641 HydrophobicContact CB-CB 4.31Å; V636-D641 HydrophobicContact CG1-CB 4.02Å; V636-D641 HydrophobicContact CG2-CB 4.26Å; H637-D641 PolarHBondContact N-OD2 3.43Å; K638-D641 PolarHBondContact N-OD2 2.78Å; K638-D641 WeakPolarHBondContact O-CB 3.43Å; K638-D641 PolarHBondContact O-N 3.4Å; V639-D641 PolarHBondContact O-N 3.12Å
642	L	79.5	Confident	76	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-71.3	-32.9	178.6	-73.9	170	0	0	0	112.7	L607 I610 I614 L633 V636 V639 E640 I645 M646 F657 I680	L607-L642 HydrophobicContact CD1-CD1 3.42Å; L607-L642 VanDerWaalsContact CD1-CD1 3.42Å; L607-L642 HydrophobicContact CD1-CD2 4.38Å; L607-L642 HydrophobicContact CD1-CG 3.89Å; I610-L642 HydrophobicContact CB-CD1 4.38Å; I610-L642 HydrophobicContact CD1-CD1 4.26Å; I610-L642 HydrophobicContact CG2-CD1 3.7Å; I614-L642 HydrophobicContact CD1-CD2 4.14Å; L633-L642 HydrophobicContact CD2-CD2 3.72Å; V636-L642 HydrophobicContact CB-CD2 4.48Å; V636-L642 HydrophobicContact CG1-CD2 3.72Å; V636-L642 HydrophobicContact CG1-CG 3.69Å; V636-L642 HydrophobicContact CG2-CD2 4.16Å; V639-L642 WeakPolarHBondContact O-CB 3.39Å; V639-L642 PolarHBondContact O-N 3.48Å; V639-L642 VanDerWaalsContact O-N 3.14Å; E640-L642 PolarHBondContact O-N 3.25Å; L642-I645 PolarHBondContact O-N 3.41Å; L642-M646 WeakPolarHBondContact O-CB 3.4Å; L642-M646 VanDerWaalsContact O-CG 3.28Å; L642-M646 WeakPolarHBondContact O-CG 3.32Å; L642-M646 PolarHBondContact O-N 2.71Å; L642-F657 HydrophobicContact CB-CE1 4.5Å; L642-F657 HydrophobicContact CD1-CZ 4.38Å; L642-I680 HydrophobicContact CD1-CD1 4.18Å
643	L	77.8	Confident	74.5	Confident	11 Å²	11	74.2 Å²	74.2	6%	0.058	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-49.1	-173.1	-87.1	170.3	0	0	0	112.9	E640 I645 M646 K647 I680 I688	E640-L643 PolarHBondContact O-N 3.21Å; L643-I645 VanDerWaalsContact C-N 3.31Å; L643-I645 PolarHBondContact O-N 2.97Å; L643-M646 PolarHBondContact O-N 3.41Å; L643-K647 WeakPolarHBondContact O-CG 3.31Å; L643-K647 PolarHBondContact O-N 2.89Å; L643-I680 HydrophobicContact CD1-CG2 4.09Å; L643-I680 HydrophobicContact CD2-CG2 3.79Å; L643-I680 HydrophobicContact CG-CG2 3.72Å; L643-I688 HydrophobicContact CD1-CB 4.33Å; L643-I688 HydrophobicContact CD1-CD1 3.81Å; L643-I688 HydrophobicContact CD1-CG1 3.59Å; L643-I688 HydrophobicContact CD1-CG2 3.97Å
644	P	76.8	Confident	72.9	Confident	85 Å²	85	82 Å²	82	55%	0.552	40%	0.396	S	S	*	.	H	α-helix	trans	-57.8	-42.5	175.3	-25.3	33.9	0	0	0	113.1	E640 K647 Q648	E640-P644 VanDerWaalsContact O-CD 3.28Å; E640-P644 WeakPolarHBondContact O-CD 3.35Å; P644-K647 PolarHBondContact O-N 2.92Å; P644-Q648 PolarHBondContact O-N 3.32Å; P644-Q648 VanDerWaalsContact O-N 3.16Å
645	I	75.4	Confident	71.7	Confident	21 Å²	21	81.5 Å²	81.5	11%	0.108	40%	0.397	C	S	.	.	H	α-helix	trans	-64.6	-46.1	-180	-69.3	171.7	0	0	0	110.3	A632 L633 V636 L642 L643 K647 Q648 F649	A632-I645 HydrophobicContact CB-CD1 4.37Å; A632-I645 HydrophobicContact CB-CG2 4.17Å; A632-I645 WeakPolarHBondContact O-CD1 3.31Å; L633-I645 HydrophobicContact CD2-CG2 4.43Å; V636-I645 HydrophobicContact CG2-CD1 3.13Å; L642-I645 PolarHBondContact O-N 3.41Å; L643-I645 VanDerWaalsContact C-N 3.31Å; L643-I645 PolarHBondContact O-N 2.97Å; I645-K647 VanDerWaalsContact C-N 3.32Å; I645-K647 PolarHBondContact O-N 3.25Å; I645-Q648 WeakPolarHBondContact O-CB 3.21Å; I645-Q648 PolarHBondContact O-N 3.34Å; I645-Q648 VanDerWaalsContact O-N 3.1Å; I645-F649 HydrophobicContact CG2-CD2 3.77Å; I645-F649 HydrophobicContact CG2-CE2 3.77Å; I645-F649 WeakPolarHBondContact O-CD2 3.31Å; I645-F649 PolarHBondContact O-N 3.47Å
646	M	73.4	Confident	71.1	Confident	13 Å²	13	74.2 Å²	74.2	6%	0.064	37%	0.368	C	S	.	.	H	α-helix	trans	-66.5	-33.5	179.2	-69.4	-69.4	98.8	0	0	112.9	I614 L642 L643 Q648 F649 N650 F657	I614-M646 HydrophobicContact CD1-CE 3.92Å; I614-M646 HydrophobicContact CD1-CG 4.44Å; I614-M646 HydrophobicContact CD1-SD 3.69Å; I614-M646 HydrophobicContact CG1-CE 4.37Å; I614-M646 HydrophobicContact CG1-SD 4.02Å; I614-M646 HydrophobicContact CG2-CE 3.67Å; I614-M646 HydrophobicContact CG2-SD 4.26Å; L642-M646 WeakPolarHBondContact O-CB 3.4Å; L642-M646 VanDerWaalsContact O-CG 3.28Å; L642-M646 WeakPolarHBondContact O-CG 3.32Å; L642-M646 PolarHBondContact O-N 2.71Å; L643-M646 PolarHBondContact O-N 3.41Å; M646-Q648 VanDerWaalsContact C-N 3.29Å; M646-Q648 PolarHBondContact O-N 3.09Å; M646-F649 HydrophobicContact CE-CD2 4.47Å; M646-F649 PolarHBondContact O-N 3.39Å; M646-N650 WeakPolarHBondContact O-CB 3.39Å; M646-N650 PolarHBondContact O-N 2.82Å; M646-F657 HydrophobicContact CB-CD1 3.84Å; M646-F657 HydrophobicContact CB-CE1 4.2Å; M646-F657 HydrophobicContact CG-CD1 3.58Å; M646-F657 HydrophobicContact CG-CE1 3.56Å; M646-F657 HydrophobicContact CG-CG 4.18Å; M646-F657 HydrophobicContact CG-CZ 4.12Å; M646-F657 HydrophobicContact SD-CD1 4.34Å; M646-F657 HydrophobicContact SD-CE1 4.48Å; M646-F657 HydrophobicContact SD-CG 4.36Å
647	K	73.6	Confident	70.7	Confident	93 Å²	93	75 Å²	75	40%	0.404	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-32.9	171.5	-75.1	177.8	177.8	178.5	0	112.7	L643 P644 I645	L643-K647 WeakPolarHBondContact O-CG 3.31Å; L643-K647 PolarHBondContact O-N 2.89Å; P644-K647 PolarHBondContact O-N 2.92Å; I645-K647 VanDerWaalsContact C-N 3.32Å; I645-K647 PolarHBondContact O-N 3.25Å
648	Q	70.6	Confident	70.5	Confident	143 Å²	143	72.1 Å²	72.1	67%	0.668	37%	0.365	S	S	*	.	H	α-helix	trans	-70.6	-39.3	176.7	-175	179.7	-3.1	0	0	112.2	P644 I645 M646	P644-Q648 PolarHBondContact O-N 3.32Å; P644-Q648 VanDerWaalsContact O-N 3.16Å; I645-Q648 WeakPolarHBondContact O-CB 3.21Å; I645-Q648 PolarHBondContact O-N 3.34Å; I645-Q648 VanDerWaalsContact O-N 3.1Å; M646-Q648 VanDerWaalsContact C-N 3.29Å; M646-Q648 PolarHBondContact O-N 3.09Å
649	F	66.6	Low	70.6	Confident	53 Å²	53	66.3 Å²	66.3	23%	0.232	34%	0.341	C	S	.	.	H	α-helix	trans	-96.9	-13.7	-171.4	-66.2	-65.8	0	0	0	115.2	V629 A632 I645 M646	V629-F649 HydrophobicContact CG2-CD1 3.85Å; V629-F649 HydrophobicContact CG2-CD2 4.22Å; V629-F649 HydrophobicContact CG2-CE1 3.85Å; V629-F649 HydrophobicContact CG2-CE2 4.23Å; V629-F649 HydrophobicContact CG2-CG 4.05Å; V629-F649 HydrophobicContact CG2-CZ 4.05Å; A632-F649 HydrophobicContact CB-CE2 4.02Å; A632-F649 HydrophobicContact CB-CZ 4.38Å; I645-F649 HydrophobicContact CG2-CD2 3.77Å; I645-F649 HydrophobicContact CG2-CE2 3.77Å; I645-F649 WeakPolarHBondContact O-CD2 3.31Å; I645-F649 PolarHBondContact O-N 3.47Å; M646-F649 HydrophobicContact CE-CD2 4.47Å; M646-F649 PolarHBondContact O-N 3.39Å
650	N	62.6	Low	71	Confident	44 Å²	44	69.5 Å²	69.5	24%	0.235	36%	0.358	C	S	.	.			trans	-125.3	99.9	-178.3	-164	-8.1	0	0	0	112.6	M646 K652 T653	M646-N650 WeakPolarHBondContact O-CB 3.39Å; M646-N650 PolarHBondContact O-N 2.82Å; N650-K652 VanDerWaalsContact C-N 3.29Å; N650-K652 PolarHBondContact O-N 2.51Å; N650-K652 PolarHBondContact OD1-N 2.82Å; N650-T653 PolarHBondContact ND2-OG1 3.42Å
651	T	51.9	Low	71.5	Confident	127 Å²	127	66.5 Å²	66.5	78%	0.779	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-13.3	-179	53	0	0	0	0	114.2
652	K	51.6	Low	71.9	Confident	192 Å²	192	67.5 Å²	67.5	84%	0.835	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-20.5	-176.2	-73.2	-173	178.4	-179.9	0	114.3	N650	N650-K652 VanDerWaalsContact C-N 3.29Å; N650-K652 PolarHBondContact O-N 2.51Å; N650-K652 PolarHBondContact OD1-N 2.82Å
653	T	53.2	Low	72.5	Confident	58 Å²	58	67.5 Å²	67.5	36%	0.356	35%	0.345	S	S	.	.			trans	-122.3	79.6	179.6	53.4	0	0	0	0	110.1	N650 D655 G656	N650-T653 PolarHBondContact ND2-OG1 3.42Å; T653-D655 PolarHBondContact O-N 2.88Å; T653-G656 WeakPolarHBondContact CB-O 3.46Å; T653-G656 PolarHBondContact O-N 3.5Å; T653-G656 PolarHBondContact OG1-O 3.32Å
654	K	53.9	Low	73.3	Confident	171 Å²	171	69.3 Å²	69.3	74%	0.743	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.5	-177.5	-79.6	-177.4	173.7	179.2	0	114.1
655	D	62.7	Low	74.2	Confident	117 Å²	117	65.8 Å²	65.8	63%	0.626	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-1.9	-168.4	-55.1	-38.8	0	0	0	114.8	T653 T681 G682	T653-D655 PolarHBondContact O-N 2.88Å; D655-T681 CarbonylContact O-C 3.59Å; D655-T681 WeakPolarHBondContact O-CA 3.24Å; D655-T681 WeakPolarHBondContact O-CB 3.47Å; D655-G682 PolarHBondContact O-N 2.9Å
656	G	74.1	Confident	75	Confident	11 Å²	11	68.5 Å²	68.5	11%	0.113	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.6	-166.5	178.8	0	0	0	0	0	115.8	T653 I680	T653-G656 WeakPolarHBondContact CB-O 3.46Å; T653-G656 PolarHBondContact O-N 3.5Å; T653-G656 PolarHBondContact OG1-O 3.32Å; G656-I680 CarbonylContact C-O 3.55Å; G656-I680 WeakPolarHBondContact CA-O 3.48Å
657	F	76.8	Confident	75.9	Confident	17 Å²	17	72.9 Å²	72.9	8%	0.075	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	160	174.3	72.7	-77	0	0	0	112.2	I610 I614 L642 M646 V659 I680	I610-F657 HydrophobicContact CG2-CE2 3.73Å; I610-F657 HydrophobicContact CG2-CZ 3.69Å; I614-F657 HydrophobicContact CD1-CE2 4.15Å; I614-F657 HydrophobicContact CD1-CZ 4.24Å; I614-F657 HydrophobicContact CG1-CE2 4.38Å; L642-F657 HydrophobicContact CB-CE1 4.5Å; L642-F657 HydrophobicContact CD1-CZ 4.38Å; M646-F657 HydrophobicContact CB-CD1 3.84Å; M646-F657 HydrophobicContact CB-CE1 4.2Å; M646-F657 HydrophobicContact CG-CD1 3.58Å; M646-F657 HydrophobicContact CG-CE1 3.56Å; M646-F657 HydrophobicContact CG-CG 4.18Å; M646-F657 HydrophobicContact CG-CZ 4.12Å; M646-F657 HydrophobicContact SD-CD1 4.34Å; M646-F657 HydrophobicContact SD-CE1 4.48Å; M646-F657 HydrophobicContact SD-CG 4.36Å; F657-V659 HydrophobicContact CD2-CG2 3.69Å; F657-V659 HydrophobicContact CE2-CG2 3.64Å; F657-I680 HydrophobicContact CD1-CB 4.32Å; F657-I680 HydrophobicContact CE1-CB 3.84Å; F657-I680 HydrophobicContact CE1-CD1 4.02Å; F657-I680 HydrophobicContact CE1-CG1 4.45Å; F657-I680 HydrophobicContact CE1-CG2 4.29Å; F657-I680 HydrophobicContact CZ-CB 4.3Å; F657-I680 HydrophobicContact CZ-CD1 3.72Å; F657-I680 HydrophobicContact CZ-CG1 4.44Å; F657-I680 PolarHBondContact N-O 3.02Å; F657-I680 PolarHBondContact O-N 3.3Å
658	T	82.1	Confident	76.7	Confident	87 Å²	87	71 Å²	71	53%	0.534	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.8	-177.5	-58.3	0	0	0	0	110.3	T677 I678	T658-T677 HydrophobicContact CG2-CG2 3.16Å; T658-I678 CarbonylContact C-O 3.42Å; T658-I678 VanDerWaalsContact CA-O 3.26Å; T658-I678 WeakPolarHBondContact CA-O 3.44Å
659	V	83.7	Confident	77.5	Confident	16 Å²	16	73.2 Å²	73.2	10%	0.097	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.2	-178.8	179.5	0	0	0	0	110	F609 R613 F657 T677 I678	F609-V659 HydrophobicContact CE1-CG1 4.12Å; R613-V659 HydrophobicContact CB-CG1 3.44Å; R613-V659 VanDerWaalsContact CB-CG1 3.44Å; R613-V659 HydrophobicContact CG-CG1 3.65Å; F657-V659 HydrophobicContact CD2-CG2 3.69Å; F657-V659 HydrophobicContact CE2-CG2 3.64Å; V659-T677 CarbonylContact O-C 3.6Å; V659-T677 WeakPolarHBondContact O-CA 3.12Å; V659-I678 PolarHBondContact N-O 3.48Å; V659-I678 PolarHBondContact O-N 2.77Å
660	N	85.6	Confident	78.5	Confident	70 Å²	70	74.9 Å²	74.9	37%	0.374	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	139.7	174.8	-65.2	-19	0	0	0	111.1	R613 T677	R613-N660 PolarHBondContact NE-O 3.39Å; R613-N660 PolarHBondContact NH2-O 3.38Å; N660-T677 WeakPolarHBondContact OD1-CB 3.31Å; N660-T677 VanDerWaalsContact OD1-CG2 3.23Å; N660-T677 WeakPolarHBondContact OD1-CG2 3.42Å; N660-T677 PolarHBondContact OD1-OG1 2.8Å
661	T	88.1	Confident	80	Confident	4 Å²	4	77 Å²	77	3%	0.025	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	158.2	170.1	79.3	0	0	0	0	111.1	F609 G675 F676	F609-T661 HydrophobicContact CD1-CG2 4.26Å; F609-T661 HydrophobicContact CE1-CG2 3.32Å; F609-T661 HydrophobicContact CE2-CG2 4.11Å; F609-T661 HydrophobicContact CZ-CG2 3.23Å; T661-G675 PolarHBondContact O-N 3.46Å; T661-G675 WeakPolarHBondContact OG1-CA 3.46Å; T661-F676 HydrophobicContact CG2-CD1 3.63Å; T661-F676 HydrophobicContact CG2-CD2 3.81Å; T661-F676 HydrophobicContact CG2-CE1 3.33Å; T661-F676 HydrophobicContact CG2-CE2 3.6Å; T661-F676 HydrophobicContact CG2-CG 3.85Å; T661-F676 HydrophobicContact CG2-CZ 3.35Å; T661-F676 WeakPolarHBondContact CG2-O 3.31Å; T661-F676 PolarHBondContact N-O 3.34Å; T661-F676 VanDerWaalsContact OG1-CD1 3.26Å; T661-F676 WeakPolarHBondContact OG1-CD1 3.4Å; T661-F676 PolarHBondContact OG1-N 3.24Å; T661-F676 PolarHBondContact OG1-O 2.9Å
662	K	89.1	Confident	81.9	Confident	84 Å²	84	76.3 Å²	76.3	37%	0.365	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140	-179.5	-67.2	-66.4	-175.2	-178	0	109.4	E672 Y673 D674	K662-E672 HydrophobicContact CB-CB 4.27Å; K662-E672 WeakPolarHBondContact CB-OE2 3.25Å; K662-E672 HydrophobicContact CD-CB 4.33Å; K662-E672 WeakPolarHBondContact CG-OE2 3.31Å; K662-Y673 CarbonylContact C-O 3.54Å; K662-Y673 WeakPolarHBondContact CA-O 3.37Å; K662-D674 IonicContact NZ-OD1 3.75Å; K662-D674 PolarHBondContact NZ-OD1 3.29Å
663	V	93.1	Very high	83.8	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	111.2	-177.5	179.4	0	0	0	0	107.5	E672 Y673 Y704 Y743 Y744 N747	V663-E672 CarbonylContact O-C 3.59Å; V663-E672 WeakPolarHBondContact O-CA 3.39Å; V663-Y673 PolarHBondContact N-O 3.48Å; V663-Y673 PolarHBondContact O-N 3.29Å; V663-Y704 WeakPolarHBondContact CG2-OH 3.39Å; V663-Y743 HydrophobicContact CG1-CE1 3.62Å; V663-Y744 HydrophobicContact CG1-CD1 4.09Å; V663-Y744 HydrophobicContact CG1-CE1 3.71Å; V663-N747 HydrophobicContact CG2-CB 4.17Å; V663-N747 WeakPolarHBondContact CG2-OD1 3.36Å
664	P	94.4	Very high	85.5	Confident	48 Å²	48	68.2 Å²	68.2	31%	0.312	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	141.3	178.4	-23.1	33.7	0	0	0	111.8	Y744	P664-Y744 PolarHBondContact O-OH 3.34Å
665	S	95.4	Very high	87.3	Confident	11 Å²	11	60.3 Å²	60.3	8%	0.077	33%	0.33	C	S	.	.			trans	-85.2	135.8	173.1	176.1	0	0	0	0	110.5	K667 D668 K671 Y673 E707	S665-K667 PolarHBondContact OG-N 3.45Å; S665-D668 PolarHBondContact OG-N 3.26Å; S665-K671 WeakPolarHBondContact CB-O 3.44Å; S665-K671 PolarHBondContact N-O 2.86Å; S665-Y673 PolarHBondContact OG-OH 2.87Å; S665-Y673 VanDerWaalsContact OG-OH 3.12Å; S665-E707 WeakPolarHBondContact CB-OE2 3.5Å; S665-E707 PolarHBondContact OG-OE2 3.35Å
666	L	93.1	Very high	88.5	Confident	78 Å²	78	55 Å²	55	41%	0.408	30%	0.301	S	S	.	.	S	Bend	trans	-86.4	-30.2	170.4	-70.6	-179.4	0	0	0	111.2	E707 L711 Y744 S794	L666-E707 WeakPolarHBondContact CA-OE1 3.37Å; L666-E707 WeakPolarHBondContact CB-OE1 3.31Å; L666-E707 PolarHBondContact N-OE1 3.04Å; L666-L711 HydrophobicContact CB-CD2 4.44Å; L666-L711 HydrophobicContact CD1-CD2 3.88Å; L666-Y744 HydrophobicContact CD1-CE2 4.18Å; L666-Y744 HydrophobicContact CG-CE2 4.28Å; L666-Y744 WeakPolarHBondContact CG-OH 3.11Å; L666-Y744 PolarHBondContact N-OH 2.87Å; L666-Y744 VanDerWaalsContact N-OH 3.13Å; L666-S794 WeakPolarHBondContact CD1-OG 3.47Å
667	K	91.6	Very high	89.3	Confident	105 Å²	105	55.2 Å²	55.2	46%	0.457	30%	0.3	S	S	.	.	S	Bend	trans	-71.5	-50.3	177.6	-179.7	-170.4	169.8	-175.1	0	112.7	S665 E707 A710	S665-K667 PolarHBondContact OG-N 3.45Å; K667-E707 WeakPolarHBondContact CB-OE1 3.42Å; K667-E707 WeakPolarHBondContact CB-OE2 3.38Å; K667-E707 PolarHBondContact N-OE1 3.04Å; K667-A710 HydrophobicContact CB-CB 4.45Å; K667-A710 HydrophobicContact CD-CB 4.04Å; K667-A710 HydrophobicContact CG-CB 4.18Å
668	D	90.4	Very high	89.8	Confident	54 Å²	54	54.4 Å²	54.4	29%	0.289	30%	0.296	S	S	.	.	S	Bend	trans	-107.2	94	-175.5	-62.9	-26.2	0	0	0	109	S665 G670 K671	S665-D668 PolarHBondContact OG-N 3.26Å; D668-G670 PolarHBondContact O-N 2.89Å; D668-K671 HydrophobicContact CB-CB 3.76Å; D668-K671 HydrophobicContact CB-CD 3.7Å; D668-K671 HydrophobicContact CB-CG 4.43Å; D668-K671 VanDerWaalsContact O-CB 3.3Å; D668-K671 WeakPolarHBondContact O-CB 3.37Å; D668-K671 PolarHBondContact O-N 3.27Å; D668-K671 VanDerWaalsContact OD2-CD 3.28Å; D668-K671 WeakPolarHBondContact OD2-CD 3.4Å; D668-K671 IonicContact OD2-NZ 3.6Å; D668-K671 PolarHBondContact OD2-NZ 2.83Å
669	Q	87.9	Confident	90.1	Very high	190 Å²	190	51.1 Å²	51.1	89%	0.888	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	129.5	-177.8	-72.3	-173.7	-4.9	0	0	112.4	K671	Q669-K671 VanDerWaalsContact C-N 3.28Å; Q669-K671 PolarHBondContact O-N 3.43Å
670	G	87	Confident	90.2	Very high	87 Å²	87	50.3 Å²	50.3	90%	0.897	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	-0.7	-179.8	0	0	0	0	0	114.9	D668	D668-G670 PolarHBondContact O-N 2.89Å
671	K	93.3	Very high	90.2	Very high	88 Å²	88	49.2 Å²	49.2	38%	0.383	27%	0.267	S	S	.	.			trans	-93.1	142.7	174.1	-164.4	176.8	178	-173.5	0	110.6	S665 D668 Q669 Y673	S665-K671 WeakPolarHBondContact CB-O 3.44Å; S665-K671 PolarHBondContact N-O 2.86Å; D668-K671 HydrophobicContact CB-CB 3.76Å; D668-K671 HydrophobicContact CB-CD 3.7Å; D668-K671 HydrophobicContact CB-CG 4.43Å; D668-K671 VanDerWaalsContact O-CB 3.3Å; D668-K671 WeakPolarHBondContact O-CB 3.37Å; D668-K671 PolarHBondContact O-N 3.27Å; D668-K671 VanDerWaalsContact OD2-CD 3.28Å; D668-K671 WeakPolarHBondContact OD2-CD 3.4Å; D668-K671 IonicContact OD2-NZ 3.6Å; D668-K671 PolarHBondContact OD2-NZ 2.83Å; Q669-K671 VanDerWaalsContact C-N 3.28Å; Q669-K671 PolarHBondContact O-N 3.43Å; K671-Y673 HydrophobicContact CD-CE1 3.83Å; K671-Y673 HydrophobicContact CG-CE1 4.02Å
672	E	91.9	Very high	89.8	Confident	113 Å²	113	49.4 Å²	49.4	53%	0.528	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.8	175.2	-62.5	-176	157.4	0	0	110.3	K662 V663	K662-E672 HydrophobicContact CB-CB 4.27Å; K662-E672 WeakPolarHBondContact CB-OE2 3.25Å; K662-E672 HydrophobicContact CD-CB 4.33Å; K662-E672 WeakPolarHBondContact CG-OE2 3.31Å; V663-E672 CarbonylContact O-C 3.59Å; V663-E672 WeakPolarHBondContact O-CA 3.39Å
673	Y	92.3	Very high	89.1	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.027	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	158.6	174.1	-53.4	-30.6	0	0	0	110.7	K662 V663 S665 K671 G675 L703 Y704 E707	K662-Y673 CarbonylContact C-O 3.54Å; K662-Y673 WeakPolarHBondContact CA-O 3.37Å; V663-Y673 PolarHBondContact N-O 3.48Å; V663-Y673 PolarHBondContact O-N 3.29Å; S665-Y673 PolarHBondContact OG-OH 2.87Å; S665-Y673 VanDerWaalsContact OG-OH 3.12Å; K671-Y673 HydrophobicContact CD-CE1 3.83Å; K671-Y673 HydrophobicContact CG-CE1 4.02Å; Y673-G675 PolarHBondContact O-N 2.99Å; Y673-L703 HydrophobicContact CD1-CB 4.39Å; Y673-L703 HydrophobicContact CD1-CD1 4.24Å; Y673-L703 HydrophobicContact CE1-CB 4.35Å; Y673-L703 HydrophobicContact CE1-CD2 4.32Å; Y673-Y704 HydrophobicContact CD2-CD2 4.44Å; Y673-Y704 HydrophobicContact CD2-CE2 4.35Å; Y673-Y704 HydrophobicContact CG-CE2 4.45Å; Y673-E707 HydrophobicContact CE2-CB 4.04Å; Y673-E707 HydrophobicContact CE2-CG 4.21Å; Y673-E707 WeakPolarHBondContact CE2-OE2 3.39Å; Y673-E707 PolarHBondContact OH-OE2 3.29Å; Y673-E707 VanDerWaalsContact OH-OE2 3.09Å
674	D	89.8	Confident	87.7	Confident	74 Å²	74	59 Å²	59	40%	0.396	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.2	172.2	-70	-36.6	0	0	0	110.4	K662 R700 Y704	K662-D674 IonicContact NZ-OD1 3.75Å; K662-D674 PolarHBondContact NZ-OD1 3.29Å; D674-R700 PolarHBondContact O-NE 3.43Å; D674-R700 PolarHBondContact O-NH2 3.42Å; D674-Y704 WeakPolarHBondContact O-CE2 3.44Å; D674-Y704 PolarHBondContact O-OH 2.78Å
675	G	89.9	Confident	86.2	Confident	5 Å²	5	62 Å²	62	5%	0.052	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-118.7	175.4	0	0	0	0	0	111.2	T661 Y673 R700	T661-G675 PolarHBondContact O-N 3.46Å; T661-G675 WeakPolarHBondContact OG1-CA 3.46Å; Y673-G675 PolarHBondContact O-N 2.99Å; G675-R700 PolarHBondContact O-NH2 3.43Å
676	F	89.6	Confident	84.8	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	158.6	175.4	67.7	-87.6	0	0	0	111.4	T661 I678 V692 E693 T694 M789 T790	T661-F676 HydrophobicContact CG2-CD1 3.63Å; T661-F676 HydrophobicContact CG2-CD2 3.81Å; T661-F676 HydrophobicContact CG2-CE1 3.33Å; T661-F676 HydrophobicContact CG2-CE2 3.6Å; T661-F676 HydrophobicContact CG2-CG 3.85Å; T661-F676 HydrophobicContact CG2-CZ 3.35Å; T661-F676 WeakPolarHBondContact CG2-O 3.31Å; T661-F676 PolarHBondContact N-O 3.34Å; T661-F676 VanDerWaalsContact OG1-CD1 3.26Å; T661-F676 WeakPolarHBondContact OG1-CD1 3.4Å; T661-F676 PolarHBondContact OG1-N 3.24Å; T661-F676 PolarHBondContact OG1-O 2.9Å; F676-I678 HydrophobicContact CD2-CD1 4.48Å; F676-I678 HydrophobicContact CD2-CG1 3.83Å; F676-I678 HydrophobicContact CE2-CD1 3.67Å; F676-I678 HydrophobicContact CE2-CG1 3.44Å; F676-I678 VanDerWaalsContact CE2-CG1 3.44Å; F676-I678 HydrophobicContact CZ-CD1 4.38Å; F676-V692 HydrophobicContact CB-CG1 4.12Å; F676-V692 HydrophobicContact CD2-CB 4.38Å; F676-V692 HydrophobicContact CD2-CG1 3.5Å; F676-V692 VanDerWaalsContact CD2-CG1 3.5Å; F676-V692 HydrophobicContact CD2-CG2 4.18Å; F676-V692 HydrophobicContact CE2-CG1 4.1Å; F676-V692 HydrophobicContact CE2-CG2 4.09Å; F676-V692 HydrophobicContact CG-CG1 4.01Å; F676-E693 CarbonylContact C-O 3.21Å; F676-E693 WeakPolarHBondContact CA-O 3.49Å; F676-E693 WeakPolarHBondContact CB-O 3.44Å; F676-T694 HydrophobicContact CB-CG2 3.8Å; F676-M789 HydrophobicContact CB-CE 3.57Å; F676-M789 HydrophobicContact CD1-CB 3.95Å; F676-M789 HydrophobicContact CD1-CE 3.67Å; F676-M789 HydrophobicContact CD2-CE 4.42Å; F676-M789 HydrophobicContact CE1-CB 3.91Å; F676-M789 HydrophobicContact CE1-CE 4.46Å; F676-M789 VanDerWaalsContact CE1-O 3.32Å; F676-M789 WeakPolarHBondContact CE1-O 3.35Å; F676-M789 HydrophobicContact CG-CE 3.65Å; F676-T790 HydrophobicContact CZ-CG2 4.47Å
677	T	89.1	Confident	84	Confident	14 Å²	14	62.8 Å²	62.8	9%	0.086	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.7	178.8	-63.2	0	0	0	0	108.9	T658 V659 N660 V692 E693	T658-T677 HydrophobicContact CG2-CG2 3.16Å; V659-T677 CarbonylContact O-C 3.6Å; V659-T677 WeakPolarHBondContact O-CA 3.12Å; N660-T677 WeakPolarHBondContact OD1-CB 3.31Å; N660-T677 VanDerWaalsContact OD1-CG2 3.23Å; N660-T677 WeakPolarHBondContact OD1-CG2 3.42Å; N660-T677 PolarHBondContact OD1-OG1 2.8Å; T677-V692 CarbonylContact O-C 3.03Å; T677-V692 WeakPolarHBondContact O-CA 3.11Å; T677-E693 PolarHBondContact N-O 3.39Å; T677-E693 PolarHBondContact O-N 3.48Å
678	I	88.9	Confident	83.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.2	172.5	-61.3	164.1	0	0	0	107.8	I606 F609 I610 T658 V659 F676 I680 F690 S691 V692	I606-I678 HydrophobicContact CG2-CD1 3.75Å; I606-I678 HydrophobicContact CG2-CG1 4.43Å; F609-I678 HydrophobicContact CD1-CD1 3.61Å; F609-I678 HydrophobicContact CE1-CD1 3.86Å; I610-I678 HydrophobicContact CD1-CD1 4.46Å; I610-I678 HydrophobicContact CD1-CG2 4.05Å; I610-I678 HydrophobicContact CG1-CD1 3.87Å; I610-I678 HydrophobicContact CG1-CG2 4.24Å; T658-I678 CarbonylContact C-O 3.42Å; T658-I678 VanDerWaalsContact CA-O 3.26Å; T658-I678 WeakPolarHBondContact CA-O 3.44Å; V659-I678 PolarHBondContact N-O 3.48Å; V659-I678 PolarHBondContact O-N 2.77Å; F676-I678 HydrophobicContact CD2-CD1 4.48Å; F676-I678 HydrophobicContact CD2-CG1 3.83Å; F676-I678 HydrophobicContact CE2-CD1 3.67Å; F676-I678 HydrophobicContact CE2-CG1 3.44Å; F676-I678 VanDerWaalsContact CE2-CG1 3.44Å; F676-I678 HydrophobicContact CZ-CD1 4.38Å; I678-I680 HydrophobicContact CG2-CD1 4.38Å; I678-I680 HydrophobicContact CG2-CG1 4.23Å; I678-F690 HydrophobicContact CG2-CD2 4.18Å; I678-F690 HydrophobicContact CG2-CE2 3.67Å; I678-S691 WeakPolarHBondContact CA-O 3.34Å; I678-V692 HydrophobicContact CG1-CG2 4.26Å
679	T	87.4	Confident	83.6	Confident	18 Å²	18	58.9 Å²	58.9	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126	175.8	-62.2	0	0	0	0	109.2	T681 F690 S691	T679-T681 HydrophobicContact CG2-CG2 3.99Å; T679-F690 WeakPolarHBondContact O-CA 3.41Å; T679-S691 PolarHBondContact N-O 3.39Å; T679-S691 PolarHBondContact O-N 2.97Å
680	I	86.6	Confident	83.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.4	173.1	-59.2	169.4	0	0	0	108.3	I610 V639 L642 L643 G656 F657 I678 I688 L689 F690	I610-I680 HydrophobicContact CD1-CD1 3.65Å; V639-I680 HydrophobicContact CG1-CD1 3.6Å; V639-I680 HydrophobicContact CG1-CG1 4.26Å; V639-I680 HydrophobicContact CG1-CG2 4.48Å; L642-I680 HydrophobicContact CD1-CD1 4.18Å; L643-I680 HydrophobicContact CD1-CG2 4.09Å; L643-I680 HydrophobicContact CD2-CG2 3.79Å; L643-I680 HydrophobicContact CG-CG2 3.72Å; G656-I680 CarbonylContact C-O 3.55Å; G656-I680 WeakPolarHBondContact CA-O 3.48Å; F657-I680 HydrophobicContact CD1-CB 4.32Å; F657-I680 HydrophobicContact CE1-CB 3.84Å; F657-I680 HydrophobicContact CE1-CD1 4.02Å; F657-I680 HydrophobicContact CE1-CG1 4.45Å; F657-I680 HydrophobicContact CE1-CG2 4.29Å; F657-I680 HydrophobicContact CZ-CB 4.3Å; F657-I680 HydrophobicContact CZ-CD1 3.72Å; F657-I680 HydrophobicContact CZ-CG1 4.44Å; F657-I680 PolarHBondContact N-O 3.02Å; F657-I680 PolarHBondContact O-N 3.3Å; I678-I680 HydrophobicContact CG2-CD1 4.38Å; I678-I680 HydrophobicContact CG2-CG1 4.23Å; I680-I688 HydrophobicContact CG2-CG2 4.45Å; I680-L689 CarbonylContact C-O 3.55Å; I680-L689 VanDerWaalsContact CA-O 3.28Å; I680-L689 WeakPolarHBondContact CA-O 3.27Å; I680-F690 HydrophobicContact CD1-CD2 4.02Å; I680-F690 HydrophobicContact CD1-CE2 4.15Å; I680-F690 HydrophobicContact CG1-CB 4.46Å; I680-F690 HydrophobicContact CG1-CD2 3.54Å; I680-F690 HydrophobicContact CG1-CE2 4.1Å; I680-F690 HydrophobicContact CG1-CG 4.24Å
681	T	85.3	Confident	83.8	Confident	46 Å²	46	45.7 Å²	45.7	28%	0.282	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.9	174.4	64.2	0	0	0	0	110.3	D655 T679 I688 L689	D655-T681 CarbonylContact O-C 3.59Å; D655-T681 WeakPolarHBondContact O-CA 3.24Å; D655-T681 WeakPolarHBondContact O-CB 3.47Å; T679-T681 HydrophobicContact CG2-CG2 3.99Å; T681-I688 WeakPolarHBondContact O-CA 3.46Å; T681-L689 PolarHBondContact N-O 3.4Å; T681-L689 PolarHBondContact O-N 3.01Å; T681-L689 WeakPolarHBondContact OG1-CB 3.23Å
682	G	80.3	Confident	83.6	Confident	8 Å²	8	41.5 Å²	41.5	8%	0.082	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	136	178.9	0	0	0	0	0	112.3	D655 N687	D655-G682 PolarHBondContact O-N 2.9Å; G682-N687 VanDerWaalsContact CA-O 3.27Å; G682-N687 WeakPolarHBondContact CA-O 3.47Å
683	D	73.7	Confident	83.5	Confident	72 Å²	72	37.2 Å²	37.2	39%	0.385	21%	0.21	S	C	.	.			trans	-86.6	-174.9	177.5	76.8	7.5	0	0	0	112.5	V685 G686 N687	D683-V685 VanDerWaalsContact C-N 3.31Å; D683-V685 WeakPolarHBondContact OD1-CA 3.45Å; D683-V685 PolarHBondContact OD1-N 2.9Å; D683-G686 PolarHBondContact OD1-N 3.48Å; D683-N687 PolarHBondContact N-O 3.37Å; D683-N687 WeakPolarHBondContact OD1-CB 3.5Å; D683-N687 PolarHBondContact OD1-N 3.08Å; D683-N687 WeakPolarHBondContact OD2-CB 3.37Å; D683-N687 PolarHBondContact OD2-ND2 3.3Å
684	K	63.4	Low	83.2	Confident	216 Å²	216	37 Å²	37	94%	0.939	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-15.9	178.5	-65.1	-177.4	-179.5	178.7	0	113.6	G686	K684-G686 VanDerWaalsContact C-N 3.33Å
685	V	63.1	Low	82.8	Confident	110 Å²	110	37.1 Å²	37.1	67%	0.667	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.1	-176.9	-165.3	0	0	0	0	110.5	D683	D683-V685 VanDerWaalsContact C-N 3.31Å; D683-V685 WeakPolarHBondContact OD1-CA 3.45Å; D683-V685 PolarHBondContact OD1-N 2.9Å
686	G	66.5	Low	82.5	Confident	55 Å²	55	37 Å²	37	57%	0.567	21%	0.205	S	C	*	.	S	Bend	trans	87.5	7.6	-179.3	0	0	0	0	0	113.5	D683 K684	D683-G686 PolarHBondContact OD1-N 3.48Å; K684-G686 VanDerWaalsContact C-N 3.33Å
687	N	76.7	Confident	82.4	Confident	51 Å²	51	38.7 Å²	38.7	27%	0.273	22%	0.216	S	C	.	.			trans	-71.8	135.1	172.3	-69	-52.1	0	0	0	110.1	G592 G682 D683	G592-N687 WeakPolarHBondContact CA-OD1 3.26Å; G682-N687 VanDerWaalsContact CA-O 3.27Å; G682-N687 WeakPolarHBondContact CA-O 3.47Å; D683-N687 PolarHBondContact N-O 3.37Å; D683-N687 WeakPolarHBondContact OD1-CB 3.5Å; D683-N687 PolarHBondContact OD1-N 3.08Å; D683-N687 WeakPolarHBondContact OD2-CB 3.37Å; D683-N687 PolarHBondContact OD2-ND2 3.3Å
688	I	83.9	Confident	82.3	Confident	20 Å²	20	43.4 Å²	43.4	10%	0.103	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.4	-178.7	-61.9	173.8	0	0	0	108.8	I590 R591 G592 E640 L643 I680 T681 F690	I590-I688 HydrophobicContact CG2-CB 4.4Å; R591-I688 CarbonylContact C-O 3.54Å; R591-I688 VanDerWaalsContact CA-O 3.29Å; R591-I688 WeakPolarHBondContact CA-O 3.2Å; G592-I688 PolarHBondContact N-O 3.43Å; G592-I688 PolarHBondContact O-N 3.09Å; E640-I688 HydrophobicContact CB-CD1 3.69Å; E640-I688 HydrophobicContact CG-CD1 3.32Å; L643-I688 HydrophobicContact CD1-CB 4.33Å; L643-I688 HydrophobicContact CD1-CD1 3.81Å; L643-I688 HydrophobicContact CD1-CG1 3.59Å; L643-I688 HydrophobicContact CD1-CG2 3.97Å; I680-I688 HydrophobicContact CG2-CG2 4.45Å; T681-I688 WeakPolarHBondContact O-CA 3.46Å; I688-F690 HydrophobicContact CG2-CB 4.33Å
689	L	87.8	Confident	82.3	Confident	56 Å²	56	50.7 Å²	50.7	29%	0.293	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	107.2	163.2	173.7	69.1	0	0	0	106.9	I590 R591 I680 T681	I590-L689 WeakPolarHBondContact O-CA 3.26Å; R591-L689 HydrophobicContact CG-CD1 4.39Å; I680-L689 CarbonylContact C-O 3.55Å; I680-L689 VanDerWaalsContact CA-O 3.28Å; I680-L689 WeakPolarHBondContact CA-O 3.27Å; T681-L689 PolarHBondContact N-O 3.4Å; T681-L689 PolarHBondContact O-N 3.01Å; T681-L689 WeakPolarHBondContact OG1-CB 3.23Å
690	F	89.8	Confident	82.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	115.1	169.7	174.6	-152.2	0	0	0	107.6	L589 I590 F603 I606 I610 V639 I678 T679 I680 I688	L589-F690 WeakPolarHBondContact CA-O 3.26Å; L589-F690 HydrophobicContact CB-CD1 3.6Å; L589-F690 HydrophobicContact CB-CE1 3.9Å; L589-F690 HydrophobicContact CB-CG 4Å; L589-F690 WeakPolarHBondContact CB-O 3.45Å; L589-F690 HydrophobicContact CD1-CD1 3.92Å; L589-F690 HydrophobicContact CD1-CD2 4.11Å; L589-F690 HydrophobicContact CD1-CE1 3.43Å; L589-F690 VanDerWaalsContact CD1-CE1 3.43Å; L589-F690 HydrophobicContact CD1-CE2 3.67Å; L589-F690 HydrophobicContact CD1-CG 4.24Å; L589-F690 HydrophobicContact CD1-CZ 3.31Å; L589-F690 HydrophobicContact CG-CD1 4.4Å; L589-F690 HydrophobicContact CG-CE1 4.32Å; L589-F690 PolarHBondContact N-O 3.33Å; I590-F690 HydrophobicContact CB-CB 3.93Å; I590-F690 HydrophobicContact CD1-CB 4.4Å; I590-F690 HydrophobicContact CD1-CD1 4.02Å; I590-F690 HydrophobicContact CG1-CB 4.25Å; I590-F690 HydrophobicContact CG1-CD1 4.08Å; I590-F690 PolarHBondContact N-O 3.28Å; I590-F690 PolarHBondContact O-N 3.38Å; F603-F690 HydrophobicContact CD1-CE1 4.41Å; F603-F690 HydrophobicContact CE1-CE1 4.47Å; I606-F690 HydrophobicContact CB-CZ 4.28Å; I606-F690 HydrophobicContact CD1-CZ 4.48Å; I606-F690 HydrophobicContact CG2-CE2 4.01Å; I606-F690 HydrophobicContact CG2-CZ 3.59Å; I610-F690 HydrophobicContact CD1-CE2 4.27Å; I610-F690 HydrophobicContact CD1-CZ 4.46Å; V639-F690 HydrophobicContact CB-CD1 4.32Å; V639-F690 HydrophobicContact CB-CE1 4.35Å; V639-F690 HydrophobicContact CG1-CB 4.45Å; V639-F690 HydrophobicContact CG1-CD1 3.81Å; V639-F690 HydrophobicContact CG1-CD2 4.33Å; V639-F690 HydrophobicContact CG1-CE1 4.04Å; V639-F690 HydrophobicContact CG1-CG 3.96Å; V639-F690 HydrophobicContact CG1-CZ 4.37Å; V639-F690 HydrophobicContact CG2-CD1 4.16Å; V639-F690 HydrophobicContact CG2-CE1 3.7Å; V639-F690 HydrophobicContact CG2-CZ 4.17Å; I678-F690 HydrophobicContact CG2-CD2 4.18Å; I678-F690 HydrophobicContact CG2-CE2 3.67Å; T679-F690 WeakPolarHBondContact O-CA 3.41Å; I680-F690 HydrophobicContact CD1-CD2 4.02Å; I680-F690 HydrophobicContact CD1-CE2 4.15Å; I680-F690 HydrophobicContact CG1-CB 4.46Å; I680-F690 HydrophobicContact CG1-CD2 3.54Å; I680-F690 HydrophobicContact CG1-CE2 4.1Å; I680-F690 HydrophobicContact CG1-CG 4.24Å; I688-F690 HydrophobicContact CG2-CB 4.33Å
691	S	90.4	Very high	82.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	149.7	-176.1	61.2	0	0	0	0	112.3	I587 I678 T679	I587-S691 CarbonylContact O-C 3.52Å; I587-S691 VanDerWaalsContact O-CA 3.27Å; I587-S691 WeakPolarHBondContact O-CA 3.47Å; I678-S691 WeakPolarHBondContact CA-O 3.34Å; T679-S691 PolarHBondContact N-O 3.39Å; T679-S691 PolarHBondContact O-N 2.97Å
692	V	89.7	Confident	83	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.5	169.1	165.7	0	0	0	0	107.6	I587 L589 F676 T677 I678 M789	I587-V692 HydrophobicContact CB-CB 4.36Å; I587-V692 WeakPolarHBondContact CB-O 3.37Å; I587-V692 PolarHBondContact N-O 2.86Å; I587-V692 PolarHBondContact O-N 3.4Å; L589-V692 HydrophobicContact CD1-CG2 3.7Å; L589-V692 HydrophobicContact CG-CG2 4.4Å; F676-V692 HydrophobicContact CB-CG1 4.12Å; F676-V692 HydrophobicContact CD2-CB 4.38Å; F676-V692 HydrophobicContact CD2-CG1 3.5Å; F676-V692 VanDerWaalsContact CD2-CG1 3.5Å; F676-V692 HydrophobicContact CD2-CG2 4.18Å; F676-V692 HydrophobicContact CE2-CG1 4.1Å; F676-V692 HydrophobicContact CE2-CG2 4.09Å; F676-V692 HydrophobicContact CG-CG1 4.01Å; T677-V692 CarbonylContact O-C 3.03Å; T677-V692 WeakPolarHBondContact O-CA 3.11Å; I678-V692 HydrophobicContact CG1-CG2 4.26Å; V692-M789 HydrophobicContact CG1-CE 3.89Å
693	E	88.8	Confident	83.6	Confident	23 Å²	23	57 Å²	57	11%	0.107	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.1	-174.4	-50.9	-175.3	170.2	0	0	109.7	N585 H586 F676 T677	N585-E693 WeakPolarHBondContact O-CA 3.43Å; H586-E693 IonicContact CE1-OE1 3.06Å; H586-E693 PolarHBondContact CE1-OE1 3.47Å; H586-E693 IonicContact CE1-OE2 3.37Å; H586-E693 WeakPolarHBondContact ND1-CG 3.48Å; H586-E693 IonicContact ND1-OE1 3.92Å; H586-E693 PolarHBondContact ND1-OE1 3.28Å; H586-E693 IonicContact ND1-OE2 2.74Å; F676-E693 CarbonylContact C-O 3.21Å; F676-E693 WeakPolarHBondContact CA-O 3.49Å; F676-E693 WeakPolarHBondContact CB-O 3.44Å; T677-E693 PolarHBondContact N-O 3.39Å; T677-E693 PolarHBondContact O-N 3.48Å
694	T	85.7	Confident	84.6	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.3	166.5	44.2	0	0	0	0	108.2	N585 F676 M749 M789	N585-T694 VanDerWaalsContact CB-OG1 3.29Å; N585-T694 WeakPolarHBondContact CB-OG1 3.39Å; N585-T694 PolarHBondContact N-O 2.95Å; N585-T694 PolarHBondContact O-N 2.97Å; N585-T694 VanDerWaalsContact O-N 3.12Å; F676-T694 HydrophobicContact CB-CG2 3.8Å; T694-M749 HydrophobicContact CG2-CG 4.17Å; T694-M789 HydrophobicContact CG2-CE 3.79Å
695	Q	82.8	Confident	86.2	Confident	76 Å²	76	45 Å²	45	36%	0.355	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.3	179.5	-58.3	-166.3	-16.3	0	0	109.3	N584 R700	N584-Q695 WeakPolarHBondContact OD1-CG 3.38Å; Q695-R700 VanDerWaalsContact O-CD 3.28Å; Q695-R700 WeakPolarHBondContact O-CD 3.43Å; Q695-R700 PolarHBondContact O-NH1 3.16Å
696	T	83.3	Confident	87.7	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	82.5	174	-49.1	0	0	0	0	108.7	L571 F583 T701	L571-T696 HydrophobicContact CB-CG2 4.02Å; L571-T696 HydrophobicContact CD1-CG2 4.38Å; F583-T696 PolarHBondContact N-O 3.38Å; F583-T696 PolarHBondContact O-N 2.98Å; T696-T701 VanDerWaalsContact CG2-OG1 3.28Å; T696-T701 WeakPolarHBondContact CG2-OG1 3.46Å
697	T	86.9	Confident	89.1	Confident	42 Å²	42	38.7 Å²	38.7	26%	0.258	20%	0.195	S	C	.	.			trans	-89.5	158.9	170.7	64.2	0	0	0	0	110.1	E699 R700 T701	T697-E699 PolarHBondContact O-N 3.33Å; T697-R700 PolarHBondContact O-N 2.84Å; T697-R700 VanDerWaalsContact OG1-CB 3.26Å; T697-R700 WeakPolarHBondContact OG1-CB 3.35Å; T697-R700 PolarHBondContact OG1-N 2.94Å; T697-T701 VanDerWaalsContact O-CB 3.3Å; T697-T701 WeakPolarHBondContact O-CB 3.42Å; T697-T701 PolarHBondContact O-N 3.14Å; T697-T701 PolarHBondContact O-OG1 3.19Å
698	E	86.8	Confident	90.1	Very high	114 Å²	114	36.3 Å²	36.3	53%	0.533	18%	0.182	S	C	.	.	H	α-helix	trans	-58.7	-49.6	179.5	-176	173	-176.3	0	0	112	R700 T701 Q702	E698-R700 PolarHBondContact O-N 3.38Å; E698-T701 PolarHBondContact O-N 3.3Å; E698-Q702 WeakPolarHBondContact O-CG 3.35Å; E698-Q702 PolarHBondContact O-N 2.84Å; E698-Q702 PolarHBondContact OE1-NE2 2.99Å
699	E	88.8	Confident	90.7	Very high	152 Å²	152	38 Å²	38	71%	0.71	19%	0.191	S	C	*	.	H	α-helix	trans	-59.3	-48.4	179.9	-64.3	178.7	-179	0	0	112.2	T697 T701 Q702 L703	T697-E699 PolarHBondContact O-N 3.33Å; E699-T701 VanDerWaalsContact C-N 3.34Å; E699-T701 PolarHBondContact O-N 3.36Å; E699-Q702 PolarHBondContact O-N 3.41Å; E699-L703 WeakPolarHBondContact O-CG 3.26Å; E699-L703 PolarHBondContact O-N 3.4Å; E699-L703 VanDerWaalsContact O-N 3.11Å
700	R	90.4	Very high	91.1	Very high	18 Å²	18	36.5 Å²	36.5	7%	0.068	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-44.4	178.4	-176.9	175.9	175.7	-88.4	-7	111	D674 G675 Q695 T697 E698 Q702 L703 Y704 N747 L748	D674-R700 PolarHBondContact O-NE 3.43Å; D674-R700 PolarHBondContact O-NH2 3.42Å; G675-R700 PolarHBondContact O-NH2 3.43Å; Q695-R700 VanDerWaalsContact O-CD 3.28Å; Q695-R700 WeakPolarHBondContact O-CD 3.43Å; Q695-R700 PolarHBondContact O-NH1 3.16Å; T697-R700 PolarHBondContact O-N 2.84Å; T697-R700 VanDerWaalsContact OG1-CB 3.26Å; T697-R700 WeakPolarHBondContact OG1-CB 3.35Å; T697-R700 PolarHBondContact OG1-N 2.94Å; E698-R700 PolarHBondContact O-N 3.38Å; R700-Q702 VanDerWaalsContact C-N 3.32Å; R700-Q702 PolarHBondContact O-N 3Å; R700-L703 PolarHBondContact O-N 3.16Å; R700-Y704 HydrophobicContact CG-CD2 3.91Å; R700-Y704 HydrophobicContact CG-CE2 3.84Å; R700-Y704 PolarHBondContact NH2-OH 3.45Å; R700-Y704 WeakPolarHBondContact O-CD2 3.34Å; R700-Y704 PolarHBondContact O-N 2.87Å; R700-Y704 VanDerWaalsContact O-N 3.09Å; R700-N747 PolarHBondContact NH2-O 2.97Å; R700-L748 PolarHBondContact NH1-O 2.88Å
701	T	91.4	Very high	91.3	Very high	9 Å²	9	37 Å²	37	6%	0.055	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-42.5	179.9	-56.1	0	0	0	0	111.3	D572 T696 T697 E698 E699 L703 Y704 H705	D572-T701 HydrophobicContact CB-CG2 4.06Å; T696-T701 VanDerWaalsContact CG2-OG1 3.28Å; T696-T701 WeakPolarHBondContact CG2-OG1 3.46Å; T697-T701 VanDerWaalsContact O-CB 3.3Å; T697-T701 WeakPolarHBondContact O-CB 3.42Å; T697-T701 PolarHBondContact O-N 3.14Å; T697-T701 PolarHBondContact O-OG1 3.19Å; E698-T701 PolarHBondContact O-N 3.3Å; E699-T701 VanDerWaalsContact C-N 3.34Å; E699-T701 PolarHBondContact O-N 3.36Å; T701-L703 PolarHBondContact O-N 3.01Å; T701-Y704 PolarHBondContact O-N 3.31Å; T701-H705 WeakPolarHBondContact O-CB 3.33Å; T701-H705 VanDerWaalsContact O-CG 3.25Å; T701-H705 PolarHBondContact O-N 3.14Å
702	Q	92.7	Very high	91.6	Very high	112 Å²	112	37.5 Å²	37.5	52%	0.523	19%	0.191	S	C	.	.	H	α-helix	trans	-63.1	-40.7	176.8	-71.1	176.6	8.6	0	0	112.5	E698 E699 R700 H705 A706	E698-Q702 WeakPolarHBondContact O-CG 3.35Å; E698-Q702 PolarHBondContact O-N 2.84Å; E698-Q702 PolarHBondContact OE1-NE2 2.99Å; E699-Q702 PolarHBondContact O-N 3.41Å; R700-Q702 VanDerWaalsContact C-N 3.32Å; R700-Q702 PolarHBondContact O-N 3Å; Q702-H705 PolarHBondContact O-N 3.38Å; Q702-A706 WeakPolarHBondContact O-CB 3.49Å; Q702-A706 PolarHBondContact O-N 2.82Å
703	L	93.9	Very high	91.8	Very high	66 Å²	66	44 Å²	44	35%	0.346	22%	0.22	S	C	.	.	H	α-helix	trans	-61.3	-49.6	176.2	-69.6	173	0	0	0	111.6	Y673 E699 R700 T701 A706 E707	Y673-L703 HydrophobicContact CD1-CB 4.39Å; Y673-L703 HydrophobicContact CD1-CD1 4.24Å; Y673-L703 HydrophobicContact CE1-CB 4.35Å; Y673-L703 HydrophobicContact CE1-CD2 4.32Å; E699-L703 WeakPolarHBondContact O-CG 3.26Å; E699-L703 PolarHBondContact O-N 3.4Å; E699-L703 VanDerWaalsContact O-N 3.11Å; R700-L703 PolarHBondContact O-N 3.16Å; T701-L703 PolarHBondContact O-N 3.01Å; L703-A706 PolarHBondContact O-N 3.41Å; L703-E707 PolarHBondContact O-N 3.38Å; L703-E707 VanDerWaalsContact O-N 3.13Å
704	Y	95.2	Very high	92.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-38.4	178.4	-83.3	-101.8	0	0	0	112.4	V663 Y673 D674 R700 T701 A706 E707 I708 Y744 N747 L748	V663-Y704 WeakPolarHBondContact CG2-OH 3.39Å; Y673-Y704 HydrophobicContact CD2-CD2 4.44Å; Y673-Y704 HydrophobicContact CD2-CE2 4.35Å; Y673-Y704 HydrophobicContact CG-CE2 4.45Å; D674-Y704 WeakPolarHBondContact O-CE2 3.44Å; D674-Y704 PolarHBondContact O-OH 2.78Å; R700-Y704 HydrophobicContact CG-CD2 3.91Å; R700-Y704 HydrophobicContact CG-CE2 3.84Å; R700-Y704 PolarHBondContact NH2-OH 3.45Å; R700-Y704 WeakPolarHBondContact O-CD2 3.34Å; R700-Y704 PolarHBondContact O-N 2.87Å; R700-Y704 VanDerWaalsContact O-N 3.09Å; T701-Y704 PolarHBondContact O-N 3.31Å; Y704-A706 VanDerWaalsContact C-N 3.33Å; Y704-A706 PolarHBondContact O-N 3.33Å; Y704-E707 WeakPolarHBondContact O-CB 3.28Å; Y704-E707 PolarHBondContact O-N 2.86Å; Y704-I708 WeakPolarHBondContact O-CB 3.5Å; Y704-I708 VanDerWaalsContact O-CG1 3.26Å; Y704-I708 WeakPolarHBondContact O-CG1 3.48Å; Y704-I708 PolarHBondContact O-N 3.24Å; Y704-Y744 HydrophobicContact CD1-CD1 4.06Å; Y704-Y744 WeakPolarHBondContact CD1-O 3.37Å; Y704-Y744 AromaticContact CE1-CD1 4Å; Y704-Y744 HydrophobicContact CE1-CD1 4Å; Y704-N747 HydrophobicContact CE1-CB 3.73Å; Y704-L748 HydrophobicContact CD1-CB 3.82Å; Y704-L748 HydrophobicContact CD2-CD1 4.34Å; Y704-L748 HydrophobicContact CE1-CB 4.38Å; Y704-L748 HydrophobicContact CG-CB 4.11Å; Y704-L748 HydrophobicContact CG-CD1 4.07Å; Y704-L748 HydrophobicContact CG-CG 4.48Å
705	H	95.3	Very high	92.5	Very high	36 Å²	36	47.3 Å²	47.3	17%	0.167	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-45.1	173.4	-78	-179.3	0	0	0	111.3	W548 R549 D572 T701 Q702 E707 I708 D709	W548-H705 AromaticContact CH2-CD2 3.91Å; W548-H705 AromaticContact CH2-NE2 3.79Å; W548-H705 AromaticContact CZ2-CD2 3.56Å; W548-H705 AromaticContact CZ2-NE2 3.74Å; R549-H705 PolarHBondContact NH2-CE1 2.78Å; R549-H705 PolarHBondContact NH2-NE2 2.71Å; D572-H705 IonicContact OD2-CE1 3.66Å; T701-H705 WeakPolarHBondContact O-CB 3.33Å; T701-H705 VanDerWaalsContact O-CG 3.25Å; T701-H705 PolarHBondContact O-N 3.14Å; Q702-H705 PolarHBondContact O-N 3.38Å; H705-E707 VanDerWaalsContact C-N 3.27Å; H705-E707 PolarHBondContact O-N 3.38Å; H705-I708 PolarHBondContact O-N 2.91Å; H705-D709 VanDerWaalsContact O-CB 3.27Å; H705-D709 WeakPolarHBondContact O-CB 3.39Å; H705-D709 PolarHBondContact O-N 3.36Å
706	A	95.3	Very high	93	Very high	32 Å²	32	44.4 Å²	44.4	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-65	-31.2	179.8	0	0	0	0	0	113.2	Q702 L703 Y704 A710	Q702-A706 WeakPolarHBondContact O-CB 3.49Å; Q702-A706 PolarHBondContact O-N 2.82Å; L703-A706 PolarHBondContact O-N 3.41Å; Y704-A706 VanDerWaalsContact C-N 3.33Å; Y704-A706 PolarHBondContact O-N 3.33Å; A706-A710 PolarHBondContact O-N 2.66Å
707	E	96.4	Very high	93.4	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-70.6	-52.1	172.9	-172.5	73.3	-139.5	0	0	111.3	S665 L666 K667 Y673 L703 Y704 H705 D709 A710 L711 Y744	S665-E707 WeakPolarHBondContact CB-OE2 3.5Å; S665-E707 PolarHBondContact OG-OE2 3.35Å; L666-E707 WeakPolarHBondContact CA-OE1 3.37Å; L666-E707 WeakPolarHBondContact CB-OE1 3.31Å; L666-E707 PolarHBondContact N-OE1 3.04Å; K667-E707 WeakPolarHBondContact CB-OE1 3.42Å; K667-E707 WeakPolarHBondContact CB-OE2 3.38Å; K667-E707 PolarHBondContact N-OE1 3.04Å; Y673-E707 HydrophobicContact CE2-CB 4.04Å; Y673-E707 HydrophobicContact CE2-CG 4.21Å; Y673-E707 WeakPolarHBondContact CE2-OE2 3.39Å; Y673-E707 PolarHBondContact OH-OE2 3.29Å; Y673-E707 VanDerWaalsContact OH-OE2 3.09Å; L703-E707 PolarHBondContact O-N 3.38Å; L703-E707 VanDerWaalsContact O-N 3.13Å; Y704-E707 WeakPolarHBondContact O-CB 3.28Å; Y704-E707 PolarHBondContact O-N 2.86Å; H705-E707 VanDerWaalsContact C-N 3.27Å; H705-E707 PolarHBondContact O-N 3.38Å; E707-D709 VanDerWaalsContact C-N 3.3Å; E707-D709 PolarHBondContact O-N 3.45Å; E707-A710 PolarHBondContact O-N 2.9Å; E707-A710 VanDerWaalsContact O-N 3.14Å; E707-L711 HydrophobicContact CG-CD1 4.38Å; E707-L711 PolarHBondContact O-N 2.91Å; E707-Y744 HydrophobicContact CG-CD1 3.85Å; E707-Y744 HydrophobicContact CG-CD2 3.9Å; E707-Y744 HydrophobicContact CG-CE1 3.7Å; E707-Y744 HydrophobicContact CG-CE2 3.77Å; E707-Y744 HydrophobicContact CG-CG 3.96Å
708	I	96.6	Very high	93.7	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-40.4	179.4	-68	168	0	0	0	110.7	W548 Y704 H705 A710 L711 Y712 L741 L748	W548-I708 HydrophobicContact CB-CG2 4.11Å; W548-I708 HydrophobicContact CD2-CG2 3.52Å; W548-I708 HydrophobicContact CE3-CG2 4.03Å; W548-I708 HydrophobicContact CG-CG2 3.54Å; Y704-I708 WeakPolarHBondContact O-CB 3.5Å; Y704-I708 VanDerWaalsContact O-CG1 3.26Å; Y704-I708 WeakPolarHBondContact O-CG1 3.48Å; Y704-I708 PolarHBondContact O-N 3.24Å; H705-I708 PolarHBondContact O-N 2.91Å; I708-A710 VanDerWaalsContact C-N 3.33Å; I708-A710 PolarHBondContact O-N 3.05Å; I708-L711 PolarHBondContact O-N 3.46Å; I708-Y712 VanDerWaalsContact O-CB 3.23Å; I708-Y712 WeakPolarHBondContact O-CB 3.47Å; I708-Y712 PolarHBondContact O-N 3.05Å; I708-L741 HydrophobicContact CG2-CD1 4.49Å; I708-L741 HydrophobicContact CG2-CD2 4.43Å; I708-L741 HydrophobicContact CG2-CG 4.17Å; I708-L748 HydrophobicContact CD1-CD2 4.48Å
709	D	96.1	Very high	93.9	Very high	55 Å²	55	44.6 Å²	44.6	29%	0.294	23%	0.231	S	C	.	.	H	α-helix	trans	-60.5	-41.2	175.9	-80.1	-19.7	0	0	0	112.2	W548 H705 E707 K713	W548-D709 PolarHBondContact NE1-OD1 3.46Å; H705-D709 VanDerWaalsContact O-CB 3.27Å; H705-D709 WeakPolarHBondContact O-CB 3.39Å; H705-D709 PolarHBondContact O-N 3.36Å; E707-D709 VanDerWaalsContact C-N 3.3Å; E707-D709 PolarHBondContact O-N 3.45Å; D709-K713 VanDerWaalsContact O-CG 3.26Å; D709-K713 WeakPolarHBondContact O-CG 3.28Å; D709-K713 PolarHBondContact O-N 3.03Å; D709-K713 VanDerWaalsContact O-N 3.11Å
710	A	96.2	Very high	93.9	Very high	26 Å²	26	39.8 Å²	39.8	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-49.9	177.8	0	0	0	0	0	110.8	K667 A706 E707 I708 Y712 K713 D714	K667-A710 HydrophobicContact CB-CB 4.45Å; K667-A710 HydrophobicContact CD-CB 4.04Å; K667-A710 HydrophobicContact CG-CB 4.18Å; A706-A710 PolarHBondContact O-N 2.66Å; E707-A710 PolarHBondContact O-N 2.9Å; E707-A710 VanDerWaalsContact O-N 3.14Å; I708-A710 VanDerWaalsContact C-N 3.33Å; I708-A710 PolarHBondContact O-N 3.05Å; A710-Y712 VanDerWaalsContact C-N 3.3Å; A710-Y712 PolarHBondContact O-N 3.09Å; A710-K713 WeakPolarHBondContact O-CB 3.45Å; A710-K713 PolarHBondContact O-N 3.45Å; A710-D714 PolarHBondContact O-N 3.23Å; A710-D714 VanDerWaalsContact O-N 3.11Å
711	L	96	Very high	93.9	Very high	9 Å²	9	42.1 Å²	42.1	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-39.2	178	-69.2	171.2	0	0	0	112.5	L666 E707 I708 D714 L715 L737 Y744	L666-L711 HydrophobicContact CB-CD2 4.44Å; L666-L711 HydrophobicContact CD1-CD2 3.88Å; E707-L711 HydrophobicContact CG-CD1 4.38Å; E707-L711 PolarHBondContact O-N 2.91Å; I708-L711 PolarHBondContact O-N 3.46Å; L711-D714 PolarHBondContact O-N 3.33Å; L711-L715 VanDerWaalsContact O-CB 3.28Å; L711-L715 WeakPolarHBondContact O-CB 3.44Å; L711-L715 PolarHBondContact O-N 2.95Å; L711-L737 HydrophobicContact CD2-CD2 4.12Å; L711-Y744 HydrophobicContact CD1-CD2 3.44Å; L711-Y744 VanDerWaalsContact CD1-CD2 3.44Å; L711-Y744 HydrophobicContact CD1-CE2 3.59Å
712	Y	96.1	Very high	93.8	Very high	11 Å²	11	42.9 Å²	42.9	4%	0.043	23%	0.228	C	C	.	.	H	α-helix	trans	-69.3	-35.4	179.1	-178.4	-97.8	0	0	0	112.6	M546 W548 M551 I708 A710 L715 T716 L741	M546-Y712 WeakPolarHBondContact CE-OH 3.4Å; M546-Y712 WeakPolarHBondContact O-CE1 3.42Å; M546-Y712 PolarHBondContact O-OH 2.97Å; W548-Y712 HydrophobicContact CB-CD1 4.21Å; W548-Y712 HydrophobicContact CB-CD2 3.64Å; W548-Y712 HydrophobicContact CB-CE2 4.18Å; W548-Y712 HydrophobicContact CB-CG 3.64Å; M551-Y712 HydrophobicContact CE-CD2 4.31Å; M551-Y712 HydrophobicContact CE-CE2 4.18Å; M551-Y712 HydrophobicContact SD-CE2 4.38Å; I708-Y712 VanDerWaalsContact O-CB 3.23Å; I708-Y712 WeakPolarHBondContact O-CB 3.47Å; I708-Y712 PolarHBondContact O-N 3.05Å; A710-Y712 VanDerWaalsContact C-N 3.3Å; A710-Y712 PolarHBondContact O-N 3.09Å; Y712-L715 HydrophobicContact CD2-CD2 4.39Å; Y712-L715 PolarHBondContact O-N 2.55Å; Y712-T716 WeakPolarHBondContact O-CB 3.49Å; Y712-T716 PolarHBondContact O-N 3.46Å; Y712-T716 PolarHBondContact O-OG1 2.81Å; Y712-L741 HydrophobicContact CD2-CD1 3.91Å; Y712-L741 HydrophobicContact CG-CD1 4.37Å
713	K	94.4	Very high	93.4	Very high	138 Å²	138	40.4 Å²	40.4	60%	0.6	22%	0.218	S	C	*	.	H	α-helix	trans	-62.2	-46.1	172.2	-75.4	168.6	-174.7	172.6	0	110.8	D709 A710 T716 A717	D709-K713 VanDerWaalsContact O-CG 3.26Å; D709-K713 WeakPolarHBondContact O-CG 3.28Å; D709-K713 PolarHBondContact O-N 3.03Å; D709-K713 VanDerWaalsContact O-N 3.11Å; A710-K713 WeakPolarHBondContact O-CB 3.45Å; A710-K713 PolarHBondContact O-N 3.45Å; K713-T716 PolarHBondContact O-N 3.12Å; K713-A717 PolarHBondContact O-N 3.09Å
714	D	94.4	Very high	92.8	Very high	91 Å²	91	44.7 Å²	44.7	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-64.4	-42.3	177.5	-70.9	-8.3	0	0	0	111.8	A710 L711 T716 A717 K718 L737	A710-D714 PolarHBondContact O-N 3.23Å; A710-D714 VanDerWaalsContact O-N 3.11Å; L711-D714 PolarHBondContact O-N 3.33Å; D714-T716 VanDerWaalsContact C-N 3.33Å; D714-T716 PolarHBondContact O-N 2.9Å; D714-A717 PolarHBondContact O-N 3.37Å; D714-K718 PolarHBondContact O-N 2.89Å; D714-L737 HydrophobicContact CB-CD1 4.23Å
715	L	94.6	Very high	91.7	Very high	4 Å²	4	46 Å²	46	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-45.5	174.5	174.9	60.9	0	0	0	111.1	W532 L711 Y712 G719 V734 L737 I738 L741	W532-L715 HydrophobicContact CZ2-CD1 3.98Å; W532-L715 HydrophobicContact CZ2-CG 4.24Å; L711-L715 VanDerWaalsContact O-CB 3.28Å; L711-L715 WeakPolarHBondContact O-CB 3.44Å; L711-L715 PolarHBondContact O-N 2.95Å; Y712-L715 HydrophobicContact CD2-CD2 4.39Å; Y712-L715 PolarHBondContact O-N 2.55Å; L715-G719 WeakPolarHBondContact O-CA 3.47Å; L715-G719 PolarHBondContact O-N 3.06Å; L715-V734 HydrophobicContact CD1-CG1 3.84Å; L715-L737 HydrophobicContact CB-CB 4.32Å; L715-L737 HydrophobicContact CB-CD1 4.45Å; L715-L737 HydrophobicContact CD1-CB 4.09Å; L715-I738 HydrophobicContact CD1-CD1 4.33Å; L715-I738 HydrophobicContact CD1-CG1 3.68Å; L715-I738 HydrophobicContact CD2-CG1 4.01Å; L715-L741 HydrophobicContact CD2-CD1 4.28Å
716	T	92.7	Very high	90	Very high	15 Å²	15	50.2 Å²	50.2	9%	0.092	28%	0.283	C	S	.	.	H	α-helix	trans	-66.7	-39.8	179.3	-58.7	0	0	0	0	111.5	Y712 K713 D714 K720	Y712-T716 WeakPolarHBondContact O-CB 3.49Å; Y712-T716 PolarHBondContact O-N 3.46Å; Y712-T716 PolarHBondContact O-OG1 2.81Å; K713-T716 PolarHBondContact O-N 3.12Å; D714-T716 VanDerWaalsContact C-N 3.33Å; D714-T716 PolarHBondContact O-N 2.9Å; T716-K720 VanDerWaalsContact O-CG 3.29Å; T716-K720 WeakPolarHBondContact O-CG 3.33Å; T716-K720 PolarHBondContact O-N 2.89Å; T716-K720 VanDerWaalsContact O-N 3.16Å
717	A	91.8	Very high	88.5	Confident	55 Å²	55	55.2 Å²	55.2	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-51.8	176.8	0	0	0	0	0	111.3	K713 D714 G719 K720 V721	K713-A717 PolarHBondContact O-N 3.09Å; D714-A717 PolarHBondContact O-N 3.37Å; A717-G719 PolarHBondContact O-N 2.69Å; A717-K720 PolarHBondContact O-N 3.45Å; A717-V721 WeakPolarHBondContact O-CG2 3.39Å; A717-V721 PolarHBondContact O-N 3.27Å
718	K	92.2	Very high	86.7	Confident	107 Å²	107	64.2 Å²	64.2	47%	0.465	34%	0.34	S	S	.	.	H	α-helix	trans	-66.7	-36.3	178.5	-71.7	-171.2	-174.2	-85.5	0	112.8	D714 K720 V721 L722 A733 V734 L737	D714-K718 PolarHBondContact O-N 2.89Å; K718-K720 VanDerWaalsContact C-N 3.31Å; K718-K720 PolarHBondContact O-N 3.41Å; K718-V721 PolarHBondContact O-N 3.04Å; K718-L722 WeakPolarHBondContact O-CB 3.45Å; K718-L722 PolarHBondContact O-N 3.48Å; K718-A733 HydrophobicContact CD-CB 4.33Å; K718-V734 HydrophobicContact CB-CG2 3.9Å; K718-L737 HydrophobicContact CD-CD1 3.7Å; K718-L737 HydrophobicContact CG-CD1 4.45Å
719	G	91.3	Very high	85.2	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.5	-37.5	175.5	0	0	0	0	0	112.9	L715 A717 L722 I723	L715-G719 WeakPolarHBondContact O-CA 3.47Å; L715-G719 PolarHBondContact O-N 3.06Å; A717-G719 PolarHBondContact O-N 2.69Å; G719-L722 PolarHBondContact O-N 2.81Å; G719-I723 PolarHBondContact O-N 3.47Å; G719-I723 VanDerWaalsContact O-N 3.16Å
720	K	89.6	Confident	84.4	Confident	50 Å²	50	66.8 Å²	66.8	22%	0.217	37%	0.366	C	S	.	.	H	α-helix	trans	-63.6	-43.5	172.2	-73.2	175.9	-178.2	-170.6	0	112.2	W532 S535 T716 A717 K718 L722 I723 L724	W532-K720 WeakPolarHBondContact O-CG 3.3Å; S535-K720 PolarHBondContact OG-NZ 2.98Å; T716-K720 VanDerWaalsContact O-CG 3.29Å; T716-K720 WeakPolarHBondContact O-CG 3.33Å; T716-K720 PolarHBondContact O-N 2.89Å; T716-K720 VanDerWaalsContact O-N 3.16Å; A717-K720 PolarHBondContact O-N 3.45Å; K718-K720 VanDerWaalsContact C-N 3.31Å; K718-K720 PolarHBondContact O-N 3.41Å; K720-L722 VanDerWaalsContact C-N 3.34Å; K720-I723 PolarHBondContact O-N 2.83Å; K720-L724 WeakPolarHBondContact O-CG 3.06Å; K720-L724 PolarHBondContact O-N 3.18Å
721	V	89.8	Confident	83.8	Confident	68 Å²	68	66.1 Å²	66.1	41%	0.412	36%	0.36	S	S	.	.	H	α-helix	trans	-63.9	-43.1	177.1	-174.1	0	0	0	0	110.3	A717 K718 I723 L724 S725 E730	A717-V721 WeakPolarHBondContact O-CG2 3.39Å; A717-V721 PolarHBondContact O-N 3.27Å; K718-V721 PolarHBondContact O-N 3.04Å; V721-I723 VanDerWaalsContact C-N 3.26Å; V721-I723 PolarHBondContact O-N 2.98Å; V721-L724 CarbonylContact O-C 3.52Å; V721-L724 WeakPolarHBondContact O-CA 3.34Å; V721-L724 PolarHBondContact O-N 2.99Å; V721-S725 WeakPolarHBondContact O-CB 3.08Å; V721-S725 PolarHBondContact O-N 3.46Å; V721-E730 VanDerWaalsContact CG1-OE1 3.3Å; V721-E730 WeakPolarHBondContact CG1-OE1 3.38Å; V721-E730 WeakPolarHBondContact CG1-OE2 3.47Å
722	L	88.7	Confident	83.3	Confident	25 Å²	25	69.7 Å²	69.7	13%	0.131	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-30	177.7	-179.4	65.8	0	0	0	113.6	K718 G719 K720 L724 E730 A731 V734	K718-L722 WeakPolarHBondContact O-CB 3.45Å; K718-L722 PolarHBondContact O-N 3.48Å; G719-L722 PolarHBondContact O-N 2.81Å; K720-L722 VanDerWaalsContact C-N 3.34Å; L722-L724 VanDerWaalsContact C-N 3.34Å; L722-E730 HydrophobicContact CD1-CB 3.92Å; L722-E730 PolarHBondContact N-OE2 3.06Å; L722-A731 HydrophobicContact CD1-CB 4.07Å; L722-V734 HydrophobicContact CB-CG2 4.46Å; L722-V734 HydrophobicContact CD2-CB 4.21Å; L722-V734 HydrophobicContact CD2-CG1 4.29Å; L722-V734 HydrophobicContact CD2-CG2 4Å
723	I	85.1	Confident	83.1	Confident	60 Å²	60	70.6 Å²	70.6	31%	0.308	39%	0.389	S	S	.	.	H	α-helix	trans	-73.7	-30.4	174.1	-70.9	-170.5	0	0	0	111.6	W532 T533 G719 K720 V721	W532-I723 HydrophobicContact CB-CD1 3.3Å; W532-I723 HydrophobicContact CB-CG1 4.13Å; W532-I723 HydrophobicContact CE3-CD1 4.32Å; W532-I723 HydrophobicContact CE3-CG1 4.48Å; W532-I723 HydrophobicContact CG-CD1 4.43Å; T533-I723 WeakPolarHBondContact OG1-CD1 3.27Å; G719-I723 PolarHBondContact O-N 3.47Å; G719-I723 VanDerWaalsContact O-N 3.16Å; K720-I723 PolarHBondContact O-N 2.83Å; V721-I723 VanDerWaalsContact C-N 3.26Å; V721-I723 PolarHBondContact O-N 2.98Å
724	L	81.6	Confident	83.1	Confident	155 Å²	155	64 Å²	64	81%	0.812	36%	0.361	S	S	*	.	H	α-helix	trans	-88.7	-26.3	-178	-62.8	172	0	0	0	112.9	K720 V721 L722	K720-L724 WeakPolarHBondContact O-CG 3.06Å; K720-L724 PolarHBondContact O-N 3.18Å; V721-L724 CarbonylContact O-C 3.52Å; V721-L724 WeakPolarHBondContact O-CA 3.34Å; V721-L724 PolarHBondContact O-N 2.99Å; L722-L724 VanDerWaalsContact C-N 3.34Å
725	S	72	Confident	83	Confident	28 Å²	28	59.8 Å²	59.8	20%	0.196	34%	0.338	C	S	.	.			trans	-107.1	156.7	-179.7	99.3	0	0	0	0	110.5	V721 E730	V721-S725 WeakPolarHBondContact O-CB 3.08Å; V721-S725 PolarHBondContact O-N 3.46Å; S725-E730 PolarHBondContact OG-OE2 2.81Å
726	S	60.3	Low	83	Confident	125 Å²	125	62.2 Å²	62.2	87%	0.874	35%	0.351	S	S	*	.			trans	-113.9	22.3	173.5	-59.8	0	0	0	0	112.2
727	E	63.7	Low	83.2	Confident	137 Å²	137	62.7 Å²	62.7	64%	0.64	35%	0.353	S	S	*	.			trans	-79.7	132	-174.8	-66.3	-168.7	-178.3	0	0	112.4	G729 E730	E727-G729 VanDerWaalsContact C-N 3.28Å; E727-G729 PolarHBondContact O-N 2.93Å; E727-E730 HydrophobicContact CB-CG 4.46Å; E727-E730 PolarHBondContact O-N 3.48Å
728	F	57.9	Low	83.4	Confident	189 Å²	189	60.3 Å²	60.3	83%	0.829	33%	0.333	S	S	*	.	H	α-helix	trans	-62.3	-29.1	-176.3	-79.8	-88.7	0	0	0	114.3
729	G	65.1	Low	83.6	Confident	58 Å²	58	55.2 Å²	55.2	60%	0.598	31%	0.31	S	S	*	.	H	α-helix	trans	-72.2	-28	-177.3	0	0	0	0	0	114.1	E727 A733	E727-G729 VanDerWaalsContact C-N 3.28Å; E727-G729 PolarHBondContact O-N 2.93Å; G729-A733 PolarHBondContact O-N 3.07Å
730	E	79.8	Confident	83.9	Confident	52 Å²	52	55.6 Å²	55.6	24%	0.243	31%	0.313	C	S	.	.	H	α-helix	trans	-73	-33.4	-178.2	-63.8	-167.4	166.5	0	0	112.2	V721 L722 S725 E727 D732 A733 V734	V721-E730 VanDerWaalsContact CG1-OE1 3.3Å; V721-E730 WeakPolarHBondContact CG1-OE1 3.38Å; V721-E730 WeakPolarHBondContact CG1-OE2 3.47Å; L722-E730 HydrophobicContact CD1-CB 3.92Å; L722-E730 PolarHBondContact N-OE2 3.06Å; S725-E730 PolarHBondContact OG-OE2 2.81Å; E727-E730 HydrophobicContact CB-CG 4.46Å; E727-E730 PolarHBondContact O-N 3.48Å; E730-D732 PolarHBondContact O-N 2.96Å; E730-A733 PolarHBondContact O-N 3.35Å; E730-V734 WeakPolarHBondContact O-CG2 3.42Å; E730-V734 PolarHBondContact O-N 2.9Å
731	A	82.2	Confident	84.2	Confident	12 Å²	12	53.3 Å²	53.3	10%	0.099	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-40.9	178.3	0	0	0	0	0	112.2	L722 V734 C735	L722-A731 HydrophobicContact CD1-CB 4.07Å; A731-V734 PolarHBondContact O-N 3.01Å; A731-C735 PolarHBondContact O-N 3.49Å; A731-C735 PolarHBondContact O-SG 3.14Å
732	D	87.1	Confident	84.5	Confident	83 Å²	83	50.1 Å²	50.1	44%	0.444	28%	0.284	S	S	.	.	H	α-helix	trans	-69.2	-38.2	178.9	-168.5	68.2	0	0	0	112.1	E730 C735 N736 K802	E730-D732 PolarHBondContact O-N 2.96Å; D732-C735 WeakPolarHBondContact O-CB 3.49Å; D732-C735 PolarHBondContact O-N 2.04Å; D732-N736 PolarHBondContact O-N 3.46Å; D732-N736 PolarHBondContact O-ND2 2.97Å; D732-N736 VanDerWaalsContact O-ND2 3.13Å; D732-N736 PolarHBondContact OD2-ND2 3.38Å; D732-K802 VanDerWaalsContact CG-NZ 3.35Å; D732-K802 IonicContact OD1-NZ 3.36Å; D732-K802 PolarHBondContact OD1-NZ 2.94Å; D732-K802 IonicContact OD2-NZ 3.77Å; D732-K802 PolarHBondContact OD2-NZ 3.29Å
733	A	90.8	Very high	84.9	Confident	31 Å²	31	49 Å²	49	26%	0.256	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-43.8	174.7	0	0	0	0	0	111.9	K718 G729 E730 N736 L737	K718-A733 HydrophobicContact CD-CB 4.33Å; G729-A733 PolarHBondContact O-N 3.07Å; E730-A733 PolarHBondContact O-N 3.35Å; A733-N736 PolarHBondContact O-N 3.33Å; A733-L737 WeakPolarHBondContact O-CG 3.27Å; A733-L737 PolarHBondContact O-N 3.05Å
734	V	93.8	Very high	85.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-43.2	174	168.7	0	0	0	0	110.9	W532 L715 K718 L722 E730 A731 N736 L737 I738	W532-V734 HydrophobicContact CH2-CG1 3.77Å; W532-V734 HydrophobicContact CZ2-CG1 4.34Å; W532-V734 HydrophobicContact CZ3-CG1 4.48Å; L715-V734 HydrophobicContact CD1-CG1 3.84Å; K718-V734 HydrophobicContact CB-CG2 3.9Å; L722-V734 HydrophobicContact CB-CG2 4.46Å; L722-V734 HydrophobicContact CD2-CB 4.21Å; L722-V734 HydrophobicContact CD2-CG1 4.29Å; L722-V734 HydrophobicContact CD2-CG2 4Å; E730-V734 WeakPolarHBondContact O-CG2 3.42Å; E730-V734 PolarHBondContact O-N 2.9Å; A731-V734 PolarHBondContact O-N 3.01Å; V734-N736 PolarHBondContact O-N 3.27Å; V734-L737 PolarHBondContact O-N 3.14Å; V734-I738 HydrophobicContact CG1-CD1 3.92Å; V734-I738 WeakPolarHBondContact O-CG1 3.36Å; V734-I738 PolarHBondContact O-N 3.19Å
735	C	93.5	Very high	86.1	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.014	23%	0.225	C	C	.	.	H	α-helix	trans	-59.3	-44.5	175.7	-67.7	0	0	0	0	112.3	A731 D732 I738 L739 L767	A731-C735 PolarHBondContact O-N 3.49Å; A731-C735 PolarHBondContact O-SG 3.14Å; D732-C735 WeakPolarHBondContact O-CB 3.49Å; D732-C735 PolarHBondContact O-N 2.04Å; C735-I738 PolarHBondContact O-N 2.69Å; C735-L739 WeakPolarHBondContact O-CG 3.15Å; C735-L739 PolarHBondContact O-N 3.33Å; C735-L739 VanDerWaalsContact O-N 3.12Å; C735-L767 HydrophobicContact CB-CD2 3.86Å; C735-L767 VanDerWaalsContact SG-CD2 3.53Å
736	N	94.7	Very high	87.2	Confident	55 Å²	55	37.6 Å²	37.6	29%	0.294	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-40.9	177.4	-69.8	-39.4	0	0	0	111.6	D732 A733 V734 I738 L739 S740 K802	D732-N736 PolarHBondContact O-N 3.46Å; D732-N736 PolarHBondContact O-ND2 2.97Å; D732-N736 VanDerWaalsContact O-ND2 3.13Å; D732-N736 PolarHBondContact OD2-ND2 3.38Å; A733-N736 PolarHBondContact O-N 3.33Å; V734-N736 PolarHBondContact O-N 3.27Å; N736-I738 PolarHBondContact O-N 3.46Å; N736-L739 PolarHBondContact O-N 2.84Å; N736-S740 WeakPolarHBondContact O-CB 3.37Å; N736-S740 PolarHBondContact O-N 3.35Å; N736-S740 PolarHBondContact O-OG 3.47Å; N736-S740 VanDerWaalsContact O-OG 3.08Å; N736-K802 VanDerWaalsContact CG-NZ 3.32Å; N736-K802 VanDerWaalsContact OD1-CE 3.24Å; N736-K802 WeakPolarHBondContact OD1-CE 3.38Å; N736-K802 PolarHBondContact OD1-NZ 3.28Å
737	L	96.2	Very high	88.8	Confident	25 Å²	25	31.7 Å²	31.7	13%	0.131	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-40	176.7	-74.2	175.5	0	0	0	112.8	L711 D714 L715 K718 A733 V734 S740 L741	L711-L737 HydrophobicContact CD2-CD2 4.12Å; D714-L737 HydrophobicContact CB-CD1 4.23Å; L715-L737 HydrophobicContact CB-CB 4.32Å; L715-L737 HydrophobicContact CB-CD1 4.45Å; L715-L737 HydrophobicContact CD1-CB 4.09Å; K718-L737 HydrophobicContact CD-CD1 3.7Å; K718-L737 HydrophobicContact CG-CD1 4.45Å; A733-L737 WeakPolarHBondContact O-CG 3.27Å; A733-L737 PolarHBondContact O-N 3.05Å; V734-L737 PolarHBondContact O-N 3.14Å; L737-S740 PolarHBondContact O-N 2.89Å; L737-L741 WeakPolarHBondContact O-CB 3.32Å; L737-L741 PolarHBondContact O-N 3.39Å
738	I	96.6	Very high	90.2	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-59.9	-47.3	175	-68	162.8	0	0	0	110.4	L715 V734 C735 N736 L741 V742 I763 A766 L767	L715-I738 HydrophobicContact CD1-CD1 4.33Å; L715-I738 HydrophobicContact CD1-CG1 3.68Å; L715-I738 HydrophobicContact CD2-CG1 4.01Å; V734-I738 HydrophobicContact CG1-CD1 3.92Å; V734-I738 WeakPolarHBondContact O-CG1 3.36Å; V734-I738 PolarHBondContact O-N 3.19Å; C735-I738 PolarHBondContact O-N 2.69Å; N736-I738 PolarHBondContact O-N 3.46Å; I738-L741 PolarHBondContact O-N 3.43Å; I738-V742 WeakPolarHBondContact O-CG2 3.26Å; I738-V742 PolarHBondContact O-N 3.49Å; I738-V742 VanDerWaalsContact O-N 3.14Å; I738-I763 HydrophobicContact CG2-CG2 4.38Å; I738-A766 HydrophobicContact CD1-CB 3.8Å; I738-A766 HydrophobicContact CG1-CB 4Å; I738-A766 HydrophobicContact CG2-CB 3.89Å; I738-L767 HydrophobicContact CD1-CD2 3.93Å; I738-L767 HydrophobicContact CD1-CG 4.38Å; I738-L767 HydrophobicContact CG2-CD2 4.5Å; I738-L767 HydrophobicContact CG2-CG 4.39Å
739	L	96.8	Very high	91.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.5	-38.6	-179.4	-66.2	171.5	0	0	0	112.1	C735 N736 V742 Y743 I763 F797 S798 A801 K802 M805	C735-L739 WeakPolarHBondContact O-CG 3.15Å; C735-L739 PolarHBondContact O-N 3.33Å; C735-L739 VanDerWaalsContact O-N 3.12Å; N736-L739 PolarHBondContact O-N 2.84Å; L739-V742 PolarHBondContact O-N 3.15Å; L739-Y743 WeakPolarHBondContact O-CB 3.49Å; L739-Y743 PolarHBondContact O-N 2.84Å; L739-I763 HydrophobicContact CD2-CD1 4.22Å; L739-I763 HydrophobicContact CD2-CG1 4.48Å; L739-I763 HydrophobicContact CD2-CG2 3.93Å; L739-F797 HydrophobicContact CB-CE1 4.44Å; L739-F797 HydrophobicContact CD2-CE1 4.45Å; L739-S798 VanDerWaalsContact CB-OG 3.31Å; L739-S798 WeakPolarHBondContact CB-OG 3.46Å; L739-A801 HydrophobicContact CD1-CB 4.41Å; L739-A801 HydrophobicContact CD2-CB 3.98Å; L739-K802 HydrophobicContact CD1-CD 4.31Å; L739-K802 HydrophobicContact CD1-CG 3.74Å; L739-M805 HydrophobicContact CD2-CE 3.9Å; L739-M805 HydrophobicContact CD2-SD 4.25Å
740	S	97	Very high	93.1	Very high	9 Å²	9	14.2 Å²	14.2	6%	0.063	8%	0.081	C	C	.	.	H	α-helix	trans	-62.9	-43.7	173.3	-67.7	0	0	0	0	112.2	N736 L737 V742 Y743 Y744	N736-S740 WeakPolarHBondContact O-CB 3.37Å; N736-S740 PolarHBondContact O-N 3.35Å; N736-S740 PolarHBondContact O-OG 3.47Å; N736-S740 VanDerWaalsContact O-OG 3.08Å; L737-S740 PolarHBondContact O-N 2.89Å; S740-V742 VanDerWaalsContact C-N 3.26Å; S740-V742 PolarHBondContact O-N 2.9Å; S740-Y743 WeakPolarHBondContact O-CB 3.42Å; S740-Y743 PolarHBondContact O-N 3.29Å; S740-Y744 WeakPolarHBondContact O-CD2 3.35Å; S740-Y744 PolarHBondContact O-N 3.37Å
741	L	96.7	Very high	93.8	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.01	7%	0.069	C	C	.	.	H	α-helix	trans	-56.9	-45.3	176.4	-173.2	153.4	0	0	0	110.7	M551 F552 I708 Y712 L715 L737 I738 Y744 F745	M551-L741 HydrophobicContact CE-CD1 4.48Å; M551-L741 HydrophobicContact CE-CD2 4.36Å; F552-L741 HydrophobicContact CE2-CD2 3.45Å; F552-L741 VanDerWaalsContact CE2-CD2 3.45Å; F552-L741 HydrophobicContact CZ-CD2 3.59Å; I708-L741 HydrophobicContact CG2-CD1 4.49Å; I708-L741 HydrophobicContact CG2-CD2 4.43Å; I708-L741 HydrophobicContact CG2-CG 4.17Å; Y712-L741 HydrophobicContact CD2-CD1 3.91Å; Y712-L741 HydrophobicContact CG-CD1 4.37Å; L715-L741 HydrophobicContact CD2-CD1 4.28Å; L737-L741 WeakPolarHBondContact O-CB 3.32Å; L737-L741 PolarHBondContact O-N 3.39Å; I738-L741 PolarHBondContact O-N 3.43Å; L741-Y744 PolarHBondContact O-N 2.9Å; L741-F745 PolarHBondContact O-N 3.06Å; L741-F745 VanDerWaalsContact O-N 3.16Å
742	V	96.2	Very high	94.2	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-75.6	-29.6	-177.8	172.6	0	0	0	0	112.3	F552 I738 L739 S740 Y744 F745 Y746 A759 I763	F552-V742 HydrophobicContact CZ-CG2 4.08Å; I738-V742 WeakPolarHBondContact O-CG2 3.26Å; I738-V742 PolarHBondContact O-N 3.49Å; I738-V742 VanDerWaalsContact O-N 3.14Å; L739-V742 PolarHBondContact O-N 3.15Å; S740-V742 VanDerWaalsContact C-N 3.26Å; S740-V742 PolarHBondContact O-N 2.9Å; V742-Y744 VanDerWaalsContact C-N 3.32Å; V742-Y744 PolarHBondContact O-N 3.23Å; V742-F745 WeakPolarHBondContact O-CB 3.46Å; V742-F745 PolarHBondContact O-N 2.67Å; V742-F745 VanDerWaalsContact O-N 3.16Å; V742-Y746 HydrophobicContact CG1-CD2 3.67Å; V742-Y746 HydrophobicContact CG1-CE2 3.36Å; V742-Y746 WeakPolarHBondContact O-CD2 3.3Å; V742-Y746 PolarHBondContact O-N 3.29Å; V742-A759 HydrophobicContact CG1-CB 3.83Å; V742-I763 HydrophobicContact CB-CD1 3.92Å; V742-I763 HydrophobicContact CB-CG1 3.78Å; V742-I763 HydrophobicContact CG1-CD1 3.39Å; V742-I763 HydrophobicContact CG1-CG1 3.68Å; V742-I763 HydrophobicContact CG2-CD1 4.25Å; V742-I763 HydrophobicContact CG2-CG1 3.55Å
743	Y	97	Very high	94.3	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.008	7%	0.072	C	C	.	.	H	α-helix	trans	-55.5	-45.6	169.3	169.2	-96.7	0	0	0	112	V663 L739 S740 Y746 N747 A788 A791 F797	V663-Y743 HydrophobicContact CG1-CE1 3.62Å; L739-Y743 WeakPolarHBondContact O-CB 3.49Å; L739-Y743 PolarHBondContact O-N 2.84Å; S740-Y743 WeakPolarHBondContact O-CB 3.42Å; S740-Y743 PolarHBondContact O-N 3.29Å; Y743-Y746 PolarHBondContact O-N 2.98Å; Y743-N747 WeakPolarHBondContact CE2-ND2 3.43Å; Y743-N747 PolarHBondContact O-N 3.27Å; Y743-N747 PolarHBondContact O-ND2 2.91Å; Y743-A788 HydrophobicContact CD2-CB 4.16Å; Y743-A788 WeakPolarHBondContact CE2-O 3.39Å; Y743-A791 HydrophobicContact CE2-CB 4.25Å; Y743-F797 HydrophobicContact CD2-CB 3.75Å; Y743-F797 HydrophobicContact CD2-CD1 4.22Å; Y743-F797 HydrophobicContact CD2-CG 4.05Å; Y743-F797 HydrophobicContact CE2-CB 4.36Å; Y743-F797 HydrophobicContact CG-CD1 4.47Å
744	Y	96.5	Very high	94.3	Very high	1 Å²	1	14 Å²	14	0%	0.004	7%	0.07	C	C	.	.	H	α-helix	trans	-69.7	-35	175.8	-72	-74	0	0	0	112.4	V663 P664 L666 Y704 E707 L711 S740 L741 V742 N747 L748	V663-Y744 HydrophobicContact CG1-CD1 4.09Å; V663-Y744 HydrophobicContact CG1-CE1 3.71Å; P664-Y744 PolarHBondContact O-OH 3.34Å; L666-Y744 HydrophobicContact CD1-CE2 4.18Å; L666-Y744 HydrophobicContact CG-CE2 4.28Å; L666-Y744 WeakPolarHBondContact CG-OH 3.11Å; L666-Y744 PolarHBondContact N-OH 2.87Å; L666-Y744 VanDerWaalsContact N-OH 3.13Å; Y704-Y744 HydrophobicContact CD1-CD1 4.06Å; Y704-Y744 WeakPolarHBondContact CD1-O 3.37Å; Y704-Y744 AromaticContact CE1-CD1 4Å; Y704-Y744 HydrophobicContact CE1-CD1 4Å; E707-Y744 HydrophobicContact CG-CD1 3.85Å; E707-Y744 HydrophobicContact CG-CD2 3.9Å; E707-Y744 HydrophobicContact CG-CE1 3.7Å; E707-Y744 HydrophobicContact CG-CE2 3.77Å; E707-Y744 HydrophobicContact CG-CG 3.96Å; L711-Y744 HydrophobicContact CD1-CD2 3.44Å; L711-Y744 VanDerWaalsContact CD1-CD2 3.44Å; L711-Y744 HydrophobicContact CD1-CE2 3.59Å; S740-Y744 WeakPolarHBondContact O-CD2 3.35Å; S740-Y744 PolarHBondContact O-N 3.37Å; L741-Y744 PolarHBondContact O-N 2.9Å; V742-Y744 VanDerWaalsContact C-N 3.32Å; V742-Y744 PolarHBondContact O-N 3.23Å; Y744-N747 PolarHBondContact O-N 3.42Å; Y744-L748 WeakPolarHBondContact O-CB 3.41Å; Y744-L748 PolarHBondContact O-N 3.38Å
745	F	95.4	Very high	94.2	Very high	1 Å²	1	14.4 Å²	14.4	0%	0.004	7%	0.072	C	C	.	.	H	α-helix	trans	-61.7	-43.4	173.8	-170	-84	0	0	0	112	W548 F552 W570 L741 V742 L748 M749 P750 L751 A759	W548-F745 HydrophobicContact CZ3-CD2 4.38Å; W548-F745 HydrophobicContact CZ3-CE2 4.31Å; F552-F745 HydrophobicContact CB-CE2 4.5Å; F552-F745 HydrophobicContact CD1-CD1 4.44Å; F552-F745 AromaticContact CD1-CD2 3.68Å; F552-F745 HydrophobicContact CD1-CD2 3.68Å; F552-F745 HydrophobicContact CD1-CE1 4.11Å; F552-F745 AromaticContact CD1-CE2 3.27Å; F552-F745 HydrophobicContact CD1-CE2 3.27Å; F552-F745 HydrophobicContact CD1-CG 4.24Å; F552-F745 AromaticContact CD1-CZ 3.51Å; F552-F745 HydrophobicContact CD1-CZ 3.51Å; F552-F745 HydrophobicContact CE1-CB 4.25Å; F552-F745 AromaticContact CE1-CD1 3.86Å; F552-F745 HydrophobicContact CE1-CD1 3.86Å; F552-F745 AromaticContact CE1-CD2 3.34Å; F552-F745 HydrophobicContact CE1-CD2 3.34Å; F552-F745 AromaticContact CE1-CE1 3.97Å; F552-F745 HydrophobicContact CE1-CE1 3.97Å; F552-F745 AromaticContact CE1-CE2 3.47Å; F552-F745 HydrophobicContact CE1-CE2 3.47Å; F552-F745 VanDerWaalsContact CE1-CE2 3.47Å; F552-F745 AromaticContact CE1-CG 3.54Å; F552-F745 HydrophobicContact CE1-CG 3.54Å; F552-F745 AromaticContact CE1-CZ 3.78Å; F552-F745 HydrophobicContact CE1-CZ 3.78Å; F552-F745 HydrophobicContact CE2-CD2 4.35Å; F552-F745 HydrophobicContact CG-CD2 4.3Å; F552-F745 AromaticContact CG-CE2 3.87Å; F552-F745 HydrophobicContact CG-CE2 3.87Å; F552-F745 HydrophobicContact CG-CZ 4.42Å; F552-F745 HydrophobicContact CZ-CB 4.24Å; F552-F745 AromaticContact CZ-CD2 3.72Å; F552-F745 HydrophobicContact CZ-CD2 3.72Å; F552-F745 HydrophobicContact CZ-CE2 4.21Å; F552-F745 AromaticContact CZ-CG 3.97Å; F552-F745 HydrophobicContact CZ-CG 3.97Å; W570-F745 AromaticContact CH2-CE2 3.94Å; W570-F745 HydrophobicContact CH2-CE2 3.94Å; W570-F745 HydrophobicContact CH2-CZ 4.37Å; W570-F745 HydrophobicContact CZ3-CE2 4.04Å; W570-F745 HydrophobicContact CZ3-CZ 4.47Å; L741-F745 PolarHBondContact O-N 3.06Å; L741-F745 VanDerWaalsContact O-N 3.16Å; V742-F745 WeakPolarHBondContact O-CB 3.46Å; V742-F745 PolarHBondContact O-N 2.67Å; V742-F745 VanDerWaalsContact O-N 3.16Å; F745-L748 PolarHBondContact O-N 3.01Å; F745-M749 PolarHBondContact O-N 2.83Å; F745-P750 HydrophobicContact CD1-CG 4.38Å; F745-P750 HydrophobicContact CD2-CG 3.79Å; F745-P750 HydrophobicContact CE1-CG 3.96Å; F745-P750 HydrophobicContact CE2-CG 3.3Å; F745-P750 HydrophobicContact CG-CG 4.31Å; F745-P750 HydrophobicContact CZ-CG 3.4Å; F745-P750 VanDerWaalsContact CZ-CG 3.4Å; F745-P750 WeakPolarHBondContact O-CD 3.16Å; F745-L751 HydrophobicContact CZ-CD1 4.33Å; F745-L751 HydrophobicContact CZ-CG 4.47Å; F745-A759 HydrophobicContact CD1-CB 3.62Å; F745-A759 HydrophobicContact CE1-CB 3.92Å
746	Y	94.8	Very high	94.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-66.5	-37.8	176.1	-76.6	-46	0	0	0	113.1	V742 Y743 M749 S756 A759 Y760 I763 V784 D785 A788 F797	V742-Y746 HydrophobicContact CG1-CD2 3.67Å; V742-Y746 HydrophobicContact CG1-CE2 3.36Å; V742-Y746 WeakPolarHBondContact O-CD2 3.3Å; V742-Y746 PolarHBondContact O-N 3.29Å; Y743-Y746 PolarHBondContact O-N 2.98Å; Y746-M749 WeakPolarHBondContact O-CE 3.43Å; Y746-M749 VanDerWaalsContact O-CG 3.28Å; Y746-M749 WeakPolarHBondContact O-CG 3.46Å; Y746-S756 WeakPolarHBondContact CE1-O 3.41Å; Y746-S756 PolarHBondContact OH-O 2.78Å; Y746-A759 HydrophobicContact CD1-CB 4.12Å; Y746-A759 HydrophobicContact CE1-CB 3.43Å; Y746-A759 VanDerWaalsContact CE1-CB 3.43Å; Y746-A759 HydrophobicContact CE2-CB 4.33Å; Y746-Y760 PolarHBondContact OH-N 3.43Å; Y746-I763 HydrophobicContact CE2-CD1 4.49Å; Y746-V784 HydrophobicContact CE2-CG1 3.66Å; Y746-D785 HydrophobicContact CD1-CB 3.65Å; Y746-D785 HydrophobicContact CE1-CB 3.91Å; Y746-D785 HydrophobicContact CG-CB 4.23Å; Y746-A788 HydrophobicContact CD2-CB 3.53Å; Y746-A788 HydrophobicContact CE2-CB 4.5Å; Y746-A788 HydrophobicContact CG-CB 3.95Å; Y746-F797 HydrophobicContact CD2-CZ 4.21Å; Y746-F797 HydrophobicContact CE2-CZ 4.07Å
747	N	93.9	Very high	94.2	Very high	1 Å²	1	14 Å²	14	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-71	-34.9	175.8	-81.7	-78.7	0	0	0	111.7	V663 R700 Y704 Y743 Y744	V663-N747 HydrophobicContact CG2-CB 4.17Å; V663-N747 WeakPolarHBondContact CG2-OD1 3.36Å; R700-N747 PolarHBondContact NH2-O 2.97Å; Y704-N747 HydrophobicContact CE1-CB 3.73Å; Y743-N747 WeakPolarHBondContact CE2-ND2 3.43Å; Y743-N747 PolarHBondContact O-N 3.27Å; Y743-N747 PolarHBondContact O-ND2 2.91Å; Y744-N747 PolarHBondContact O-N 3.42Å
748	L	92.7	Very high	94.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-69.2	-42.8	176.6	179.8	58.7	0	0	0	112.5	R700 Y704 I708 Y744 F745 P750	R700-L748 PolarHBondContact NH1-O 2.88Å; Y704-L748 HydrophobicContact CD1-CB 3.82Å; Y704-L748 HydrophobicContact CD2-CD1 4.34Å; Y704-L748 HydrophobicContact CE1-CB 4.38Å; Y704-L748 HydrophobicContact CG-CB 4.11Å; Y704-L748 HydrophobicContact CG-CD1 4.07Å; Y704-L748 HydrophobicContact CG-CG 4.48Å; I708-L748 HydrophobicContact CD1-CD2 4.48Å; Y744-L748 WeakPolarHBondContact O-CB 3.41Å; Y744-L748 PolarHBondContact O-N 3.38Å; F745-L748 PolarHBondContact O-N 3.01Å; L748-P750 HydrophobicContact CD2-CB 3.84Å; L748-P750 HydrophobicContact CD2-CG 4.26Å; L748-P750 HydrophobicContact CG-CB 4.02Å; L748-P750 HydrophobicContact CG-CG 4.44Å
749	M	92	Very high	94.2	Very high	14 Å²	14	12.6 Å²	12.6	7%	0.069	7%	0.065	C	C	.	.			trans	51.5	61.1	-169.4	-70.7	-64.2	-176.2	0	0	113.3	T694 F745 Y746 L751 S755 D785 M789	T694-M749 HydrophobicContact CG2-CG 4.17Å; F745-M749 PolarHBondContact O-N 2.83Å; Y746-M749 WeakPolarHBondContact O-CE 3.43Å; Y746-M749 VanDerWaalsContact O-CG 3.28Å; Y746-M749 WeakPolarHBondContact O-CG 3.46Å; M749-L751 PolarHBondContact O-N 3Å; M749-L751 VanDerWaalsContact O-N 3.11Å; M749-S755 VanDerWaalsContact SD-CB 3.56Å; M749-D785 HydrophobicContact CE-CB 3.69Å; M749-M789 HydrophobicContact CE-SD 3.77Å
750	P	92.6	Very high	94.2	Very high	3 Å²	3	13 Å²	13	2%	0.019	7%	0.066	C	C	.	.			trans	-75.7	-2.3	-167	31	-35.9	0	0	0	115.4	W570 L571 F745 L748	W570-P750 HydrophobicContact CE3-CB 4.09Å; W570-P750 HydrophobicContact CE3-CG 4.45Å; W570-P750 HydrophobicContact CZ3-CB 3.9Å; W570-P750 HydrophobicContact CZ3-CG 3.83Å; L571-P750 WeakPolarHBondContact CB-O 3.48Å; L571-P750 WeakPolarHBondContact CG-O 3.22Å; L571-P750 PolarHBondContact N-O 2.99Å; F745-P750 HydrophobicContact CD1-CG 4.38Å; F745-P750 HydrophobicContact CD2-CG 3.79Å; F745-P750 HydrophobicContact CE1-CG 3.96Å; F745-P750 HydrophobicContact CE2-CG 3.3Å; F745-P750 HydrophobicContact CG-CG 4.31Å; F745-P750 HydrophobicContact CZ-CG 3.4Å; F745-P750 VanDerWaalsContact CZ-CG 3.4Å; F745-P750 WeakPolarHBondContact O-CD 3.16Å; L748-P750 HydrophobicContact CD2-CB 3.84Å; L748-P750 HydrophobicContact CD2-CG 4.26Å; L748-P750 HydrophobicContact CG-CB 4.02Å; L748-P750 HydrophobicContact CG-CG 4.44Å
751	L	92.6	Very high	94.2	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.063	C	C	.	.	B	Isolated β-bridge	trans	-112.2	149.9	-179.6	-52.8	172.8	0	0	0	111.5	V556 V568 L569 W570 N585 F745 M749 R753 S755 I758	V556-L751 HydrophobicContact CG2-CD1 3.96Å; V556-L751 HydrophobicContact CG2-CD2 4.39Å; V568-L751 HydrophobicContact CG1-CD1 4.19Å; L569-L751 VanDerWaalsContact O-CA 3.28Å; L569-L751 WeakPolarHBondContact O-CA 3.47Å; W570-L751 HydrophobicContact CB-CD2 4.46Å; W570-L751 HydrophobicContact CD2-CD2 3.38Å; W570-L751 HydrophobicContact CE3-CD2 3.43Å; W570-L751 VanDerWaalsContact CE3-CD2 3.43Å; W570-L751 HydrophobicContact CE3-CG 4.41Å; W570-L751 HydrophobicContact CG-CD2 3.86Å; W570-L751 HydrophobicContact CH2-CD2 4.25Å; W570-L751 HydrophobicContact CZ2-CD2 4.22Å; W570-L751 HydrophobicContact CZ3-CD2 3.88Å; N585-L751 PolarHBondContact ND2-O 3.39Å; F745-L751 HydrophobicContact CZ-CD1 4.33Å; F745-L751 HydrophobicContact CZ-CG 4.47Å; M749-L751 PolarHBondContact O-N 3Å; M749-L751 VanDerWaalsContact O-N 3.11Å; L751-R753 VanDerWaalsContact C-N 3.3Å; L751-R753 PolarHBondContact O-N 3.41Å; L751-S755 WeakPolarHBondContact CB-OG 3.34Å; L751-I758 HydrophobicContact CD1-CD1 3.37Å; L751-I758 HydrophobicContact CD1-CG2 4.4Å
752	S	90.8	Very high	94.3	Very high	5 Å²	5	12.5 Å²	12.5	4%	0.035	6%	0.063	C	C	.	.	S	Bend	trans	-62.6	-34.2	174.3	50.7	0	0	0	0	113.3	P567 L569	P567-S752 PolarHBondContact O-OG 3.48Å; L569-S752 PolarHBondContact N-OG 3.43Å; L569-S752 PolarHBondContact O-N 3.21Å; L569-S752 PolarHBondContact O-OG 3.33Å
753	R	90.8	Very high	94.3	Very high	148 Å²	148	12.4 Å²	12.4	56%	0.558	6%	0.063	S	C	*	.	S	Bend	trans	-150.3	155.9	175.7	-64.6	-64.4	178.9	163	0.2	109.6	V568 L751 S755	V568-R753 WeakPolarHBondContact CG1-O 3.42Å; V568-R753 HydrophobicContact CG2-CB 4.32Å; L751-R753 VanDerWaalsContact C-N 3.3Å; L751-R753 PolarHBondContact O-N 3.41Å; R753-S755 PolarHBondContact O-N 3.36Å
754	G	89.7	Confident	94.2	Very high	21 Å²	21	12.5 Å²	12.5	22%	0.216	6%	0.063	C	C	.	.			trans	83	-0.8	167.6	0	0	0	0	0	116.9	S756 V757 I758	G754-S756 PolarHBondContact O-N 2.81Å; G754-S756 VanDerWaalsContact O-N 3.1Å; G754-V757 WeakPolarHBondContact O-CG1 3.44Å; G754-V757 PolarHBondContact O-N 2.91Å; G754-I758 WeakPolarHBondContact O-CD1 3.37Å; G754-I758 WeakPolarHBondContact O-CG1 3.01Å; G754-I758 PolarHBondContact O-N 3.44Å; G754-I758 VanDerWaalsContact O-N 3.17Å
755	S	92.7	Very high	94.2	Very high	7 Å²	7	12.4 Å²	12.4	5%	0.049	6%	0.063	C	C	.	.	H	α-helix	trans	-47.6	-42.1	177.5	-53.9	0	0	0	0	113	M749 L751 R753 A759	M749-S755 VanDerWaalsContact SD-CB 3.56Å; L751-S755 WeakPolarHBondContact CB-OG 3.34Å; R753-S755 PolarHBondContact O-N 3.36Å; S755-A759 VanDerWaalsContact O-CB 3.25Å; S755-A759 WeakPolarHBondContact O-CB 3.23Å; S755-A759 PolarHBondContact O-N 3.14Å
756	S	92.4	Very high	94.3	Very high	19 Å²	19	12.4 Å²	12.4	13%	0.133	6%	0.063	C	C	.	.	H	α-helix	trans	-52.8	-58.5	-178.3	-160.9	0	0	0	0	113.1	Y502 Y746 G754 Y760 D785	Y502-S756 PolarHBondContact OH-OG 2.96Å; Y746-S756 WeakPolarHBondContact CE1-O 3.41Å; Y746-S756 PolarHBondContact OH-O 2.78Å; G754-S756 PolarHBondContact O-N 2.81Å; G754-S756 VanDerWaalsContact O-N 3.1Å; S756-Y760 PolarHBondContact O-N 3.33Å; S756-D785 WeakPolarHBondContact CB-OD2 3.26Å; S756-D785 PolarHBondContact OG-OD2 2.85Å
757	V	94.6	Very high	94.3	Very high	30 Å²	30	12.4 Å²	12.4	18%	0.182	6%	0.063	C	C	.	.	H	α-helix	trans	-76.9	-34.4	-174.8	69.4	0	0	0	0	112.4	M517 R559 G754 Y760 S761	M517-V757 HydrophobicContact CB-CG2 4.44Å; M517-V757 HydrophobicContact CG-CG2 3.67Å; M517-V757 HydrophobicContact SD-CG1 4.13Å; M517-V757 HydrophobicContact SD-CG2 3.98Å; R559-V757 HydrophobicContact CG-CG1 4.38Å; G754-V757 WeakPolarHBondContact O-CG1 3.44Å; G754-V757 PolarHBondContact O-N 2.91Å; V757-Y760 PolarHBondContact O-N 3.36Å; V757-S761 WeakPolarHBondContact O-CB 3.28Å; V757-S761 PolarHBondContact O-N 3.16Å
758	I	96.9	Very high	94.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-62.2	-50	178	-74.1	166	0	0	0	110	F552 A555 V556 R559 V568 L751 G754 Y760 S761 V762	F552-I758 HydrophobicContact CD1-CG2 4.11Å; A555-I758 HydrophobicContact CB-CG2 3.94Å; V556-I758 HydrophobicContact CB-CD1 4.48Å; V556-I758 HydrophobicContact CG2-CD1 3.92Å; V556-I758 HydrophobicContact CG2-CG2 4.1Å; R559-I758 HydrophobicContact CB-CD1 3.97Å; R559-I758 HydrophobicContact CB-CG1 3.92Å; R559-I758 HydrophobicContact CG-CD1 4.01Å; R559-I758 HydrophobicContact CG-CG1 4.11Å; V568-I758 HydrophobicContact CG1-CD1 3.71Å; L751-I758 HydrophobicContact CD1-CD1 3.37Å; L751-I758 HydrophobicContact CD1-CG2 4.4Å; G754-I758 WeakPolarHBondContact O-CD1 3.37Å; G754-I758 WeakPolarHBondContact O-CG1 3.01Å; G754-I758 PolarHBondContact O-N 3.44Å; G754-I758 VanDerWaalsContact O-N 3.17Å; I758-Y760 VanDerWaalsContact C-N 3.31Å; I758-Y760 PolarHBondContact O-N 3.48Å; I758-S761 PolarHBondContact O-N 2.83Å; I758-V762 WeakPolarHBondContact O-CG2 3.46Å; I758-V762 PolarHBondContact O-N 3.08Å
759	A	96.7	Very high	94.3	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.2	-39.5	-179.8	0	0	0	0	0	112.1	F552 V742 F745 Y746 S755 V762 I763	F552-A759 HydrophobicContact CE1-CB 4.23Å; V742-A759 HydrophobicContact CG1-CB 3.83Å; F745-A759 HydrophobicContact CD1-CB 3.62Å; F745-A759 HydrophobicContact CE1-CB 3.92Å; Y746-A759 HydrophobicContact CD1-CB 4.12Å; Y746-A759 HydrophobicContact CE1-CB 3.43Å; Y746-A759 VanDerWaalsContact CE1-CB 3.43Å; Y746-A759 HydrophobicContact CE2-CB 4.33Å; S755-A759 VanDerWaalsContact O-CB 3.25Å; S755-A759 WeakPolarHBondContact O-CB 3.23Å; S755-A759 PolarHBondContact O-N 3.14Å; A759-V762 PolarHBondContact O-N 3.38Å; A759-I763 WeakPolarHBondContact O-CG1 3.32Å; A759-I763 PolarHBondContact O-N 2.97Å
760	Y	96.4	Very high	94.3	Very high	7 Å²	7	12.9 Å²	12.9	3%	0.027	7%	0.068	C	C	.	.	H	α-helix	trans	-68	-40.7	177.3	-162.5	-103.6	0	0	0	112.6	M500 Y746 S756 V757 I758 V762 I763 V764 I778 V784 M805	M500-Y760 HydrophobicContact CB-CD1 3.8Å; M500-Y760 HydrophobicContact CB-CE1 4.14Å; M500-Y760 HydrophobicContact CG-CD1 3.62Å; M500-Y760 HydrophobicContact CG-CE1 3.88Å; M500-Y760 HydrophobicContact SD-CD1 4.25Å; Y746-Y760 PolarHBondContact OH-N 3.43Å; S756-Y760 PolarHBondContact O-N 3.33Å; V757-Y760 PolarHBondContact O-N 3.36Å; I758-Y760 VanDerWaalsContact C-N 3.31Å; I758-Y760 PolarHBondContact O-N 3.48Å; Y760-V762 VanDerWaalsContact C-N 3.28Å; Y760-V762 PolarHBondContact O-N 3.41Å; Y760-I763 HydrophobicContact CD2-CD1 4.07Å; Y760-I763 WeakPolarHBondContact O-CB 3.39Å; Y760-I763 PolarHBondContact O-N 3Å; Y760-I763 VanDerWaalsContact O-N 3.16Å; Y760-V764 HydrophobicContact CD1-CG2 4.2Å; Y760-V764 HydrophobicContact CE1-CG2 3.99Å; Y760-V764 WeakPolarHBondContact O-CG2 3.23Å; Y760-V764 PolarHBondContact O-N 3.47Å; Y760-I778 HydrophobicContact CD1-CD1 4.39Å; Y760-I778 HydrophobicContact CE1-CD1 4.06Å; Y760-I778 HydrophobicContact CE1-CG1 4.29Å; Y760-V784 HydrophobicContact CD2-CB 4.29Å; Y760-V784 HydrophobicContact CD2-CG1 3.94Å; Y760-V784 HydrophobicContact CD2-CG2 3.89Å; Y760-V784 HydrophobicContact CE2-CG1 4.29Å; Y760-V784 HydrophobicContact CE2-CG2 3.85Å; Y760-M805 HydrophobicContact CD2-CE 4.44Å; Y760-M805 HydrophobicContact CE2-CE 3.63Å
761	S	97.4	Very high	94.1	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.2	-40.8	173.3	177.7	0	0	0	0	111.7	M517 A520 A521 V757 I758 V764 G765	M517-S761 PolarHBondContact O-OG 3.04Å; A520-S761 WeakPolarHBondContact CB-OG 3.5Å; A521-S761 PolarHBondContact N-OG 2.89Å; V757-S761 WeakPolarHBondContact O-CB 3.28Å; V757-S761 PolarHBondContact O-N 3.16Å; I758-S761 PolarHBondContact O-N 2.83Å; S761-V764 PolarHBondContact O-N 2.9Å; S761-G765 PolarHBondContact O-N 3.34Å
762	V	97.4	Very high	94	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-64.9	-40.7	174.3	172.7	0	0	0	0	111.8	V524 M551 F552 A555 I758 A759 Y760 V764 G765 A766	V524-V762 HydrophobicContact CG1-CG1 4.5Å; V524-V762 HydrophobicContact CG2-CG2 4.32Å; M551-V762 HydrophobicContact CE-CG1 3.72Å; M551-V762 HydrophobicContact CG-CG1 4.04Å; M551-V762 HydrophobicContact SD-CG1 4Å; F552-V762 HydrophobicContact CD1-CB 4.44Å; F552-V762 HydrophobicContact CD1-CG2 3.9Å; F552-V762 HydrophobicContact CD2-CG1 4.29Å; F552-V762 HydrophobicContact CE1-CB 4.2Å; F552-V762 HydrophobicContact CE1-CG1 4.21Å; F552-V762 HydrophobicContact CE1-CG2 4.17Å; F552-V762 HydrophobicContact CE2-CG1 3.91Å; F552-V762 HydrophobicContact CG-CG2 4.12Å; F552-V762 HydrophobicContact CZ-CB 4.36Å; F552-V762 HydrophobicContact CZ-CG1 3.88Å; A555-V762 HydrophobicContact CB-CG2 3.96Å; I758-V762 WeakPolarHBondContact O-CG2 3.46Å; I758-V762 PolarHBondContact O-N 3.08Å; A759-V762 PolarHBondContact O-N 3.38Å; Y760-V762 VanDerWaalsContact C-N 3.28Å; Y760-V762 PolarHBondContact O-N 3.41Å; V762-V764 PolarHBondContact O-N 3.11Å; V762-G765 PolarHBondContact O-N 3.2Å; V762-A766 VanDerWaalsContact O-CB 3.26Å; V762-A766 WeakPolarHBondContact O-CB 3.34Å; V762-A766 PolarHBondContact O-N 2.84Å
763	I	96.4	Very high	94.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-55.4	-53.2	172.6	-67.4	166.5	0	0	0	109.9	I738 L739 V742 Y746 A759 Y760 G765 A766 L767 M805	I738-I763 HydrophobicContact CG2-CG2 4.38Å; L739-I763 HydrophobicContact CD2-CD1 4.22Å; L739-I763 HydrophobicContact CD2-CG1 4.48Å; L739-I763 HydrophobicContact CD2-CG2 3.93Å; V742-I763 HydrophobicContact CB-CD1 3.92Å; V742-I763 HydrophobicContact CB-CG1 3.78Å; V742-I763 HydrophobicContact CG1-CD1 3.39Å; V742-I763 HydrophobicContact CG1-CG1 3.68Å; V742-I763 HydrophobicContact CG2-CD1 4.25Å; V742-I763 HydrophobicContact CG2-CG1 3.55Å; Y746-I763 HydrophobicContact CE2-CD1 4.49Å; A759-I763 WeakPolarHBondContact O-CG1 3.32Å; A759-I763 PolarHBondContact O-N 2.97Å; Y760-I763 HydrophobicContact CD2-CD1 4.07Å; Y760-I763 WeakPolarHBondContact O-CB 3.39Å; Y760-I763 PolarHBondContact O-N 3Å; Y760-I763 VanDerWaalsContact O-N 3.16Å; I763-G765 PolarHBondContact O-N 2.86Å; I763-A766 PolarHBondContact O-N 3.38Å; I763-L767 HydrophobicContact CG2-CD1 3.47Å; I763-L767 VanDerWaalsContact CG2-CD1 3.47Å; I763-L767 HydrophobicContact CG2-CG 4.05Å; I763-L767 WeakPolarHBondContact O-CB 3.38Å; I763-L767 VanDerWaalsContact O-CG 3.25Å; I763-L767 WeakPolarHBondContact O-CG 3.43Å; I763-L767 PolarHBondContact O-N 3.41Å; I763-M805 HydrophobicContact CD1-CE 4.27Å; I763-M805 HydrophobicContact CG2-CE 3.6Å; I763-M805 HydrophobicContact CG2-SD 4.19Å
764	V	96.5	Very high	94.2	Very high	3 Å²	3	10.5 Å²	10.5	2%	0.018	7%	0.069	C	C	.	.	H	α-helix	trans	-58.9	-48.6	-176.9	174.2	0	0	0	0	110.5	L496 M500 A521 Y760 S761 V762 L767 M768 V774	L496-V764 HydrophobicContact CD2-CG1 4.26Å; M500-V764 HydrophobicContact CE-CB 3.89Å; M500-V764 HydrophobicContact CE-CG1 4.03Å; M500-V764 HydrophobicContact CE-CG2 3.88Å; A521-V764 HydrophobicContact CB-CB 4.24Å; A521-V764 HydrophobicContact CB-CG1 4.03Å; Y760-V764 HydrophobicContact CD1-CG2 4.2Å; Y760-V764 HydrophobicContact CE1-CG2 3.99Å; Y760-V764 WeakPolarHBondContact O-CG2 3.23Å; Y760-V764 PolarHBondContact O-N 3.47Å; S761-V764 PolarHBondContact O-N 2.9Å; V762-V764 PolarHBondContact O-N 3.11Å; V764-L767 PolarHBondContact O-N 2.85Å; V764-M768 HydrophobicContact CG1-SD 3.84Å; V764-M768 WeakPolarHBondContact O-CB 3.48Å; V764-M768 WeakPolarHBondContact O-CG 3.16Å; V764-M768 PolarHBondContact O-N 3.35Å; V764-V774 HydrophobicContact CG2-CB 4.44Å; V764-V774 HydrophobicContact CG2-CG2 4.14Å
765	G	96.5	Very high	94.3	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.7	-44.9	178.9	0	0	0	0	0	113.7	A521 M525 S761 V762 I763 M768 A769	A521-G765 WeakPolarHBondContact O-CA 3.43Å; M525-G765 VanDerWaalsContact CA-O 3.26Å; M525-G765 WeakPolarHBondContact CA-O 3.45Å; M525-G765 WeakPolarHBondContact CB-O 3.13Å; S761-G765 PolarHBondContact O-N 3.34Å; V762-G765 PolarHBondContact O-N 3.2Å; I763-G765 PolarHBondContact O-N 2.86Å; G765-M768 PolarHBondContact O-N 3.14Å; G765-A769 PolarHBondContact O-N 2.86Å
766	A	95.9	Very high	94.2	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.008	8%	0.075	C	C	.	.	H	α-helix	trans	-67.6	-38	-179.7	0	0	0	0	0	112.5	I738 V762 I763 A769 S770	I738-A766 HydrophobicContact CD1-CB 3.8Å; I738-A766 HydrophobicContact CG1-CB 4Å; I738-A766 HydrophobicContact CG2-CB 3.89Å; V762-A766 VanDerWaalsContact O-CB 3.26Å; V762-A766 WeakPolarHBondContact O-CB 3.34Å; V762-A766 PolarHBondContact O-N 2.84Å; I763-A766 PolarHBondContact O-N 3.38Å; A766-A769 WeakPolarHBondContact O-CB 3.38Å; A766-A769 PolarHBondContact O-N 3.44Å; A766-S770 PolarHBondContact O-N 2.91Å
767	L	95.1	Very high	94.3	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.9	-41.3	174.4	-71.3	174	0	0	0	111.1	C735 I738 I763 V764 A769 S770 G771 K772 V774 M805 L807	C735-L767 HydrophobicContact CB-CD2 3.86Å; C735-L767 VanDerWaalsContact SG-CD2 3.53Å; I738-L767 HydrophobicContact CD1-CD2 3.93Å; I738-L767 HydrophobicContact CD1-CG 4.38Å; I738-L767 HydrophobicContact CG2-CD2 4.5Å; I738-L767 HydrophobicContact CG2-CG 4.39Å; I763-L767 HydrophobicContact CG2-CD1 3.47Å; I763-L767 VanDerWaalsContact CG2-CD1 3.47Å; I763-L767 HydrophobicContact CG2-CG 4.05Å; I763-L767 WeakPolarHBondContact O-CB 3.38Å; I763-L767 VanDerWaalsContact O-CG 3.25Å; I763-L767 WeakPolarHBondContact O-CG 3.43Å; I763-L767 PolarHBondContact O-N 3.41Å; V764-L767 PolarHBondContact O-N 2.85Å; L767-A769 VanDerWaalsContact C-N 3.28Å; L767-A769 PolarHBondContact O-N 2.85Å; L767-S770 CarbonylContact O-C 3.56Å; L767-S770 WeakPolarHBondContact O-CA 3.2Å; L767-S770 WeakPolarHBondContact O-CB 3.19Å; L767-S770 PolarHBondContact O-N 3.24Å; L767-S770 PolarHBondContact O-OG 3.26Å; L767-G771 PolarHBondContact O-N 3.39Å; L767-K772 CarbonylContact C-O 3.12Å; L767-K772 PolarHBondContact O-N 3.13Å; L767-K772 VanDerWaalsContact O-O 3.09Å; L767-V774 HydrophobicContact CD1-CG2 3.97Å; L767-M805 HydrophobicContact CD1-SD 3.86Å; L767-L807 HydrophobicContact CD1-CD2 3.94Å
768	M	94.1	Very high	94.3	Very high	3 Å²	3	14.7 Å²	14.7	2%	0.015	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-37.5	175.1	-70.9	172.6	69.5	0	0	111.8	L496 L522 M525 V764 G765 S770 G771 K772 I810 Y814	L496-M768 HydrophobicContact CD1-CE 4.01Å; L496-M768 HydrophobicContact CD1-SD 4.01Å; L496-M768 HydrophobicContact CD2-SD 4.13Å; L522-M768 HydrophobicContact CD2-CE 4.02Å; M525-M768 HydrophobicContact CB-CB 4.13Å; M525-M768 HydrophobicContact CG-CB 3.72Å; M525-M768 HydrophobicContact SD-CB 3.8Å; M525-M768 HydrophobicContact SD-CE 3.73Å; V764-M768 HydrophobicContact CG1-SD 3.84Å; V764-M768 WeakPolarHBondContact O-CB 3.48Å; V764-M768 WeakPolarHBondContact O-CG 3.16Å; V764-M768 PolarHBondContact O-N 3.35Å; G765-M768 PolarHBondContact O-N 3.14Å; M768-S770 PolarHBondContact O-N 2.83Å; M768-G771 PolarHBondContact O-N 2.82Å; M768-K772 WeakPolarHBondContact CA-O 3.26Å; M768-K772 PolarHBondContact N-O 3.35Å; M768-K772 VanDerWaalsContact N-O 3.13Å; M768-I810 HydrophobicContact CB-CD1 4Å; M768-I810 HydrophobicContact CE-CD1 4.46Å; M768-I810 HydrophobicContact CG-CD1 4.45Å; M768-I810 VanDerWaalsContact O-CD1 3.32Å; M768-I810 WeakPolarHBondContact O-CD1 3.24Å; M768-Y814 HydrophobicContact CE-CD1 3.44Å; M768-Y814 VanDerWaalsContact CE-CD1 3.44Å; M768-Y814 HydrophobicContact CE-CE1 3.16Å; M768-Y814 HydrophobicContact CE-CE2 4.32Å; M768-Y814 HydrophobicContact CE-CG 4.11Å
769	A	92.4	Very high	94.1	Very high	9 Å²	9	16.7 Å²	16.7	7%	0.074	10%	0.098	C	C	.	.	H	α-helix	trans	-62.7	-30.1	173.6	0	0	0	0	0	112.9	M525 V528 H529 W532 G765 A766 L767 G771	M525-A769 HydrophobicContact CG-CB 4.4Å; V528-A769 HydrophobicContact CB-CB 3.81Å; V528-A769 HydrophobicContact CG1-CB 3.62Å; H529-A769 HydrophobicContact CB-CB 4.27Å; W532-A769 HydrophobicContact CE3-CB 4.47Å; W532-A769 HydrophobicContact CH2-CB 4.28Å; W532-A769 HydrophobicContact CZ3-CB 3.97Å; G765-A769 PolarHBondContact O-N 2.86Å; A766-A769 WeakPolarHBondContact O-CB 3.38Å; A766-A769 PolarHBondContact O-N 3.44Å; L767-A769 VanDerWaalsContact C-N 3.28Å; L767-A769 PolarHBondContact O-N 2.85Å; A769-G771 PolarHBondContact O-N 3.11Å
770	S	91.5	Very high	93.9	Very high	12 Å²	12	24.8 Å²	24.8	8%	0.084	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	5	172.3	74.2	0	0	0	0	114.6	A766 L767 M768	A766-S770 PolarHBondContact O-N 2.91Å; L767-S770 CarbonylContact O-C 3.56Å; L767-S770 WeakPolarHBondContact O-CA 3.2Å; L767-S770 WeakPolarHBondContact O-CB 3.19Å; L767-S770 PolarHBondContact O-N 3.24Å; L767-S770 PolarHBondContact O-OG 3.26Å; M768-S770 PolarHBondContact O-N 2.83Å
771	G	89.3	Confident	93.6	Very high	27 Å²	27	24.8 Å²	24.8	28%	0.278	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	16.8	180	0	0	0	0	0	114.7	L767 M768 A769 I810	L767-G771 PolarHBondContact O-N 3.39Å; M768-G771 PolarHBondContact O-N 2.82Å; A769-G771 PolarHBondContact O-N 3.11Å; G771-I810 WeakPolarHBondContact O-CB 3.39Å; G771-I810 PolarHBondContact O-N 2.96Å
772	K	91.1	Very high	93.4	Very high	54 Å²	54	27.4 Å²	27.4	24%	0.235	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.1	177.9	-61.9	-64.1	-174.6	179.3	0	111	L767 M768 K808	L767-K772 CarbonylContact C-O 3.12Å; L767-K772 PolarHBondContact O-N 3.13Å; L767-K772 VanDerWaalsContact O-O 3.09Å; M768-K772 WeakPolarHBondContact CA-O 3.26Å; M768-K772 PolarHBondContact N-O 3.35Å; M768-K772 VanDerWaalsContact N-O 3.13Å; K772-K808 CarbonylContact C-O 3.51Å; K772-K808 VanDerWaalsContact CA-O 3.29Å; K772-K808 WeakPolarHBondContact CA-O 3.49Å
773	E	91.5	Very high	93.2	Very high	26 Å²	26	27.4 Å²	27.4	12%	0.121	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137.9	174.4	-175.9	-178.2	171.5	0	0	110.7	R495 L807 K808 Y814	R495-E773 IonicContact CZ-OE1 3.85Å; R495-E773 IonicContact NH2-OE1 2.68Å; R495-E773 PolarHBondContact NH2-OE1 3.02Å; E773-L807 WeakPolarHBondContact O-CA 3.41Å; E773-K808 PolarHBondContact N-O 2.6Å; E773-K808 PolarHBondContact O-N 3.12Å; E773-Y814 HydrophobicContact CG-CE2 4.37Å; E773-Y814 PolarHBondContact OE1-OH 2.86Å; E773-Y814 WeakPolarHBondContact OE2-CE2 3.43Å
774	V	92.9	Very high	93.1	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	115.4	171	179.2	0	0	0	0	108.5	L499 V764 L767 M805 L807	L499-V774 VanDerWaalsContact CD1-O 3.28Å; L499-V774 WeakPolarHBondContact CD1-O 3.49Å; V764-V774 HydrophobicContact CG2-CB 4.44Å; V764-V774 HydrophobicContact CG2-CG2 4.14Å; L767-V774 HydrophobicContact CD1-CG2 3.97Å; V774-M805 HydrophobicContact CG1-CB 4.02Å; V774-M805 HydrophobicContact CG1-CG 4.14Å; V774-M805 WeakPolarHBondContact CG1-O 3.37Å; V774-M805 HydrophobicContact CG2-CB 4.4Å; V774-M805 HydrophobicContact CG2-CG 4.46Å; V774-L807 HydrophobicContact CG2-CD2 3.91Å
775	A	91.7	Very high	92.9	Very high	35 Å²	35	28.1 Å²	28.1	29%	0.289	15%	0.15	S	C	.	.			trans	-109.3	-12.2	179	0	0	0	0	0	113.2	M805 N806 K808	A775-M805 PolarHBondContact N-O 3.25Å; A775-M805 VanDerWaalsContact N-O 3.11Å; A775-N806 PolarHBondContact N-O 3.44Å; A775-K808 HydrophobicContact CB-CD 3.91Å; A775-K808 HydrophobicContact CB-CG 4.35Å
776	G	92.2	Very high	92.7	Very high	10 Å²	10	28.2 Å²	28.2	10%	0.103	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-90	153.8	-179.6	0	0	0	0	0	112.8	W804 M805	G776-W804 WeakPolarHBondContact CA-O 3.4Å; G776-M805 PolarHBondContact N-O 3.05Å
777	K	93.4	Very high	92.6	Very high	117 Å²	117	28.4 Å²	28.4	51%	0.509	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-93.5	157.3	171.6	-68.7	-175.5	174.3	-172.6	0	110.5	L499 E503	L499-K777 HydrophobicContact CD2-CG 3.67Å; E503-K777 IonicContact OE1-NZ 3.67Å
778	I	94.1	Very high	92.6	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-64	127.3	168.5	-57.6	167.8	0	0	0	108.2	Y502 Y760 K782 V784	Y502-I778 HydrophobicContact CD1-CD1 3.84Å; Y502-I778 HydrophobicContact CD1-CG2 4.05Å; Y502-I778 HydrophobicContact CE1-CD1 3.66Å; Y502-I778 HydrophobicContact CE1-CG2 4.22Å; Y760-I778 HydrophobicContact CD1-CD1 4.39Å; Y760-I778 HydrophobicContact CE1-CD1 4.06Å; Y760-I778 HydrophobicContact CE1-CG1 4.29Å; I778-K782 HydrophobicContact CG2-CB 4.26Å; I778-K782 WeakPolarHBondContact CG2-O 3.34Å; I778-V784 HydrophobicContact CD1-CG2 3.84Å; I778-V784 HydrophobicContact CG1-CG2 4.09Å; I778-V784 HydrophobicContact CG2-CG2 4.25Å
779	P	93.7	Very high	92.4	Very high	42 Å²	42	28.6 Å²	28.6	27%	0.273	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-63.9	151.3	-177.7	-21.1	32.1	0	0	0	112.5	G781 K782 W804	P779-G781 PolarHBondContact O-N 2.92Å; P779-K782 HydrophobicContact CB-CB 4.48Å; P779-K782 HydrophobicContact CB-CG 3.94Å; P779-K782 HydrophobicContact CG-CG 4.39Å; P779-K782 WeakPolarHBondContact O-CB 3.3Å; P779-K782 PolarHBondContact O-N 3.28Å; P779-K782 VanDerWaalsContact O-N 3.08Å; P779-W804 HydrophobicContact CG-CB 4.08Å; P779-W804 VanDerWaalsContact CG-CD1 3.48Å; P779-W804 HydrophobicContact CG-CD2 3.68Å; P779-W804 HydrophobicContact CG-CE3 4.42Å; P779-W804 HydrophobicContact CG-CG 3.47Å; P779-W804 VanDerWaalsContact CG-CG 3.47Å
780	K	91.9	Very high	92.3	Very high	171 Å²	171	30.2 Å²	30.2	74%	0.743	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	134.6	175.9	-172.1	179.1	-179.6	175.7	0	111.6	E503 K782	E503-K780 HydrophobicContact CB-CB 4.39Å; E503-K780 HydrophobicContact CB-CG 4.47Å; E503-K780 WeakPolarHBondContact O-CA 3.39Å; E503-K780 VanDerWaalsContact O-CG 3.31Å; E503-K780 WeakPolarHBondContact O-CG 3.49Å; K780-K782 PolarHBondContact O-N 3.37Å
781	G	90.4	Very high	92.3	Very high	7 Å²	7	30 Å²	30	7%	0.072	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	5.2	-179.7	0	0	0	0	0	115	E503 P779	E503-G781 PolarHBondContact O-N 3.33Å; P779-G781 PolarHBondContact O-N 2.92Å
782	K	92.6	Very high	92.3	Very high	54 Å²	54	33.8 Å²	33.8	24%	0.235	18%	0.181	C	C	.	.			trans	-104.9	140	178.8	-57	-61.1	179.5	-169.6	0	112.4	Y602 I778 P779 K780 E787 W804	Y602-K782 VanDerWaalsContact OH-CA 3.32Å; Y602-K782 WeakPolarHBondContact OH-CA 3.49Å; I778-K782 HydrophobicContact CG2-CB 4.26Å; I778-K782 WeakPolarHBondContact CG2-O 3.34Å; P779-K782 HydrophobicContact CB-CB 4.48Å; P779-K782 HydrophobicContact CB-CG 3.94Å; P779-K782 HydrophobicContact CG-CG 4.39Å; P779-K782 WeakPolarHBondContact O-CB 3.3Å; P779-K782 PolarHBondContact O-N 3.28Å; P779-K782 VanDerWaalsContact O-N 3.08Å; K780-K782 PolarHBondContact O-N 3.37Å; K782-E787 WeakPolarHBondContact CD-OE1 3.28Å; K782-E787 IonicContact NZ-OE1 3.81Å; K782-W804 HydrophobicContact CB-CH2 4.23Å; K782-W804 HydrophobicContact CB-CZ3 4.39Å; K782-W804 HydrophobicContact CD-CH2 4.39Å; K782-W804 HydrophobicContact CD-CZ2 4.44Å; K782-W804 HydrophobicContact CG-CH2 4.23Å; K782-W804 HydrophobicContact CG-CZ2 4.24Å
783	L	93.9	Very high	92.4	Very high	2 Å²	2	32 Å²	32	1%	0.01	18%	0.177	C	C	.	.			trans	-122.9	121.1	176.4	-66.4	179.8	0	0	0	108.4	Y502 T504 F507 Y599 Y602 D785 F786 E787	Y502-L783 HydrophobicContact CD1-CD2 3.8Å; Y502-L783 HydrophobicContact CD2-CD2 3.72Å; Y502-L783 HydrophobicContact CE1-CD2 3.99Å; Y502-L783 HydrophobicContact CE2-CD2 3.91Å; Y502-L783 HydrophobicContact CG-CD2 3.67Å; T504-L783 HydrophobicContact CG2-CD2 3.85Å; F507-L783 HydrophobicContact CE2-CD2 3.9Å; F507-L783 HydrophobicContact CZ-CD2 4.01Å; Y599-L783 HydrophobicContact CD1-CD1 3.49Å; Y599-L783 VanDerWaalsContact CD1-CD1 3.49Å; Y599-L783 HydrophobicContact CE1-CD1 3.45Å; Y599-L783 VanDerWaalsContact CE1-CD1 3.45Å; Y602-L783 HydrophobicContact CE2-CB 3.96Å; Y602-L783 HydrophobicContact CE2-CD1 4.26Å; Y602-L783 HydrophobicContact CE2-CG 4.1Å; Y602-L783 PolarHBondContact OH-N 3.16Å; Y602-L783 PolarHBondContact OH-O 3.05Å; L783-D785 VanDerWaalsContact C-N 3.34Å; L783-D785 WeakPolarHBondContact CB-OD1 3.37Å; L783-D785 PolarHBondContact O-N 3.47Å; L783-F786 HydrophobicContact CB-CB 4.12Å; L783-F786 HydrophobicContact CD1-CD2 4.44Å; L783-F786 PolarHBondContact O-N 3.25Å; L783-E787 WeakPolarHBondContact O-CG 3.34Å; L783-E787 PolarHBondContact O-N 3.48Å
784	V	94	Very high	92.6	Very high	3 Å²	3	31 Å²	31	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-67.6	-37.7	-169.2	-179	0	0	0	0	111.4	Y502 Y746 Y760 I778 E787 A788 F797	Y502-V784 HydrophobicContact CE1-CG2 4.11Å; Y502-V784 PolarHBondContact OH-N 2.93Å; Y746-V784 HydrophobicContact CE2-CG1 3.66Å; Y760-V784 HydrophobicContact CD2-CB 4.29Å; Y760-V784 HydrophobicContact CD2-CG1 3.94Å; Y760-V784 HydrophobicContact CD2-CG2 3.89Å; Y760-V784 HydrophobicContact CE2-CG1 4.29Å; Y760-V784 HydrophobicContact CE2-CG2 3.85Å; I778-V784 HydrophobicContact CD1-CG2 3.84Å; I778-V784 HydrophobicContact CG1-CG2 4.09Å; I778-V784 HydrophobicContact CG2-CG2 4.25Å; V784-E787 PolarHBondContact O-N 3.33Å; V784-A788 PolarHBondContact O-N 3.3Å; V784-F797 HydrophobicContact CG1-CE2 4.02Å; V784-F797 HydrophobicContact CG1-CZ 4.02Å
785	D	92.9	Very high	92.6	Very high	14 Å²	14	38.5 Å²	38.5	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-46.5	174.9	48.8	5.6	0	0	0	112.3	Y746 M749 S756 L783 E787 A788 M789	Y746-D785 HydrophobicContact CD1-CB 3.65Å; Y746-D785 HydrophobicContact CE1-CB 3.91Å; Y746-D785 HydrophobicContact CG-CB 4.23Å; M749-D785 HydrophobicContact CE-CB 3.69Å; S756-D785 WeakPolarHBondContact CB-OD2 3.26Å; S756-D785 PolarHBondContact OG-OD2 2.85Å; L783-D785 VanDerWaalsContact C-N 3.34Å; L783-D785 WeakPolarHBondContact CB-OD1 3.37Å; L783-D785 PolarHBondContact O-N 3.47Å; D785-E787 VanDerWaalsContact C-N 3.31Å; D785-E787 PolarHBondContact O-N 2.97Å; D785-A788 WeakPolarHBondContact O-CB 3.43Å; D785-A788 PolarHBondContact O-N 3.28Å; D785-M789 WeakPolarHBondContact O-CB 3.19Å; D785-M789 VanDerWaalsContact O-CG 3.26Å; D785-M789 WeakPolarHBondContact O-CG 3.49Å; D785-M789 PolarHBondContact O-N 3.22Å
786	F	92.7	Very high	92.8	Very high	3 Å²	3	38.4 Å²	38.4	1%	0.013	21%	0.207	C	C	.	.	H	α-helix	trans	-66.8	-32	176.8	-94.5	-108.5	0	0	0	112.6	I587 L589 Y599 Y602 I606 L783 A788 M789 T790	I587-F786 HydrophobicContact CD1-CE2 3.77Å; I587-F786 HydrophobicContact CD1-CZ 4.07Å; I587-F786 HydrophobicContact CG2-CZ 4.28Å; L589-F786 HydrophobicContact CD2-CZ 4.42Å; Y599-F786 HydrophobicContact CD1-CD1 4.22Å; Y599-F786 AromaticContact CD1-CD2 3.83Å; Y599-F786 HydrophobicContact CD1-CD2 3.83Å; Y599-F786 AromaticContact CD1-CE1 3.84Å; Y599-F786 HydrophobicContact CD1-CE1 3.84Å; Y599-F786 AromaticContact CD1-CE2 3.45Å; Y599-F786 HydrophobicContact CD1-CE2 3.45Å; Y599-F786 VanDerWaalsContact CD1-CE2 3.45Å; Y599-F786 HydrophobicContact CD1-CG 4.21Å; Y599-F786 AromaticContact CD1-CZ 3.44Å; Y599-F786 HydrophobicContact CD1-CZ 3.44Å; Y599-F786 VanDerWaalsContact CD1-CZ 3.44Å; Y599-F786 AromaticContact CE1-CD2 3.6Å; Y599-F786 HydrophobicContact CE1-CD2 3.6Å; Y599-F786 HydrophobicContact CE1-CE1 4.35Å; Y599-F786 AromaticContact CE1-CE2 3.09Å; Y599-F786 HydrophobicContact CE1-CE2 3.09Å; Y599-F786 HydrophobicContact CE1-CG 4.41Å; Y599-F786 AromaticContact CE1-CZ 3.54Å; Y599-F786 HydrophobicContact CE1-CZ 3.54Å; Y599-F786 HydrophobicContact CG-CZ 4.22Å; Y602-F786 HydrophobicContact CD1-CB 3.85Å; Y602-F786 HydrophobicContact CD1-CD1 4.11Å; Y602-F786 HydrophobicContact CD1-CG 4.43Å; Y602-F786 HydrophobicContact CD2-CB 4.32Å; Y602-F786 HydrophobicContact CD2-CD1 4.4Å; Y602-F786 HydrophobicContact CE1-CB 3.7Å; Y602-F786 HydrophobicContact CE2-CB 4.18Å; Y602-F786 HydrophobicContact CG-CB 4.18Å; Y602-F786 AromaticContact CG-CD1 3.92Å; Y602-F786 HydrophobicContact CG-CD1 3.92Å; Y602-F786 HydrophobicContact CG-CG 4.37Å; I606-F786 HydrophobicContact CD1-CD1 4.48Å; I606-F786 HydrophobicContact CD1-CE1 4.02Å; L783-F786 HydrophobicContact CB-CB 4.12Å; L783-F786 HydrophobicContact CD1-CD2 4.44Å; L783-F786 PolarHBondContact O-N 3.25Å; F786-A788 VanDerWaalsContact C-N 3.33Å; F786-M789 PolarHBondContact O-N 2.74Å; F786-T790 WeakPolarHBondContact O-CB 3.39Å; F786-T790 WeakPolarHBondContact O-CG2 3.45Å; F786-T790 PolarHBondContact O-N 3.43Å; F786-T790 PolarHBondContact O-OG1 2.98Å
787	E	94.1	Very high	92.9	Very high	4 Å²	4	38 Å²	38	2%	0.019	20%	0.202	C	C	.	.	H	α-helix	trans	-69.4	-33.4	174	-66.1	-77.5	163.3	0	0	111.6	Y602 K605 K782 L783 V784 D785 A791 W804	Y602-E787 HydrophobicContact CE1-CG 4.04Å; Y602-E787 WeakPolarHBondContact CE1-OE1 3.2Å; Y602-E787 VanDerWaalsContact OH-CG 3.23Å; Y602-E787 WeakPolarHBondContact OH-CG 3.41Å; Y602-E787 PolarHBondContact OH-OE1 3.17Å; K605-E787 IonicContact NZ-OE1 3.73Å; K605-E787 PolarHBondContact NZ-OE1 2.72Å; K605-E787 IonicContact NZ-OE2 2.72Å; K605-E787 PolarHBondContact NZ-OE2 3.47Å; K782-E787 WeakPolarHBondContact CD-OE1 3.28Å; K782-E787 IonicContact NZ-OE1 3.81Å; L783-E787 WeakPolarHBondContact O-CG 3.34Å; L783-E787 PolarHBondContact O-N 3.48Å; V784-E787 PolarHBondContact O-N 3.33Å; D785-E787 VanDerWaalsContact C-N 3.31Å; D785-E787 PolarHBondContact O-N 2.97Å; E787-A791 WeakPolarHBondContact O-CB 3.16Å; E787-A791 PolarHBondContact O-N 2.74Å; E787-W804 HydrophobicContact CB-CH2 4.14Å; E787-W804 HydrophobicContact CB-CZ3 4.33Å; E787-W804 HydrophobicContact CG-CH2 3.52Å; E787-W804 HydrophobicContact CG-CZ3 3.96Å
788	A	93.9	Very high	93	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-70.6	-46.6	170.5	0	0	0	0	0	112	Y743 Y746 V784 D785 F786 T790 A791 F797	Y743-A788 HydrophobicContact CD2-CB 4.16Å; Y743-A788 WeakPolarHBondContact CE2-O 3.39Å; Y746-A788 HydrophobicContact CD2-CB 3.53Å; Y746-A788 HydrophobicContact CE2-CB 4.5Å; Y746-A788 HydrophobicContact CG-CB 3.95Å; V784-A788 PolarHBondContact O-N 3.3Å; D785-A788 WeakPolarHBondContact O-CB 3.43Å; D785-A788 PolarHBondContact O-N 3.28Å; F786-A788 VanDerWaalsContact C-N 3.33Å; A788-T790 PolarHBondContact O-N 3.4Å; A788-A791 PolarHBondContact O-N 2.94Å; A788-F797 VanDerWaalsContact CA-CD2 3.46Å; A788-F797 HydrophobicContact CB-CD2 3.67Å; A788-F797 HydrophobicContact CB-CE2 3.63Å; A788-F797 HydrophobicContact CB-CG 4.16Å; A788-F797 HydrophobicContact CB-CZ 4.09Å
789	M	91.1	Very high	93	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.039	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-39.2	-177.8	-69.6	172.2	71	0	0	111.9	F676 V692 T694 M749 D785 F786	F676-M789 HydrophobicContact CB-CE 3.57Å; F676-M789 HydrophobicContact CD1-CB 3.95Å; F676-M789 HydrophobicContact CD1-CE 3.67Å; F676-M789 HydrophobicContact CD2-CE 4.42Å; F676-M789 HydrophobicContact CE1-CB 3.91Å; F676-M789 HydrophobicContact CE1-CE 4.46Å; F676-M789 VanDerWaalsContact CE1-O 3.32Å; F676-M789 WeakPolarHBondContact CE1-O 3.35Å; F676-M789 HydrophobicContact CG-CE 3.65Å; V692-M789 HydrophobicContact CG1-CE 3.89Å; T694-M789 HydrophobicContact CG2-CE 3.79Å; M749-M789 HydrophobicContact CE-SD 3.77Å; D785-M789 WeakPolarHBondContact O-CB 3.19Å; D785-M789 VanDerWaalsContact O-CG 3.26Å; D785-M789 WeakPolarHBondContact O-CG 3.49Å; D785-M789 PolarHBondContact O-N 3.22Å; F786-M789 PolarHBondContact O-N 2.74Å
790	T	90.3	Very high	93	Very high	42 Å²	42	40.8 Å²	40.8	26%	0.258	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-4	-179.2	60.7	0	0	0	0	114	F676 F786 A788	F676-T790 HydrophobicContact CZ-CG2 4.47Å; F786-T790 WeakPolarHBondContact O-CB 3.39Å; F786-T790 WeakPolarHBondContact O-CG2 3.45Å; F786-T790 PolarHBondContact O-N 3.43Å; F786-T790 PolarHBondContact O-OG1 2.98Å; A788-T790 PolarHBondContact O-N 3.4Å
791	A	91.5	Very high	93.1	Very high	9 Å²	9	32.8 Å²	32.8	7%	0.074	18%	0.178	C	C	.	.	S	Bend	trans	-74.8	140.5	175.2	0	0	0	0	0	111.3	Y743 E787 A788 G793 A796 F797	Y743-A791 HydrophobicContact CE2-CB 4.25Å; E787-A791 WeakPolarHBondContact O-CB 3.16Å; E787-A791 PolarHBondContact O-N 2.74Å; A788-A791 PolarHBondContact O-N 2.94Å; A791-G793 PolarHBondContact O-N 3.43Å; A791-G793 VanDerWaalsContact O-N 3.16Å; A791-A796 HydrophobicContact CB-CB 4.48Å; A791-F797 HydrophobicContact CB-CB 3.91Å
792	P	89.3	Confident	93.3	Very high	106 Å²	106	34.5 Å²	34.5	69%	0.688	18%	0.184	S	C	*	.	S	Bend	trans	-66.5	-17.4	-179.9	27.5	-35.8	0	0	0	113.6	A796	P792-A796 HydrophobicContact CG-CB 3.7Å
793	G	92.4	Very high	93.3	Very high	15 Å²	15	35.8 Å²	35.8	16%	0.155	20%	0.2	C	C	.	.	S	Bend	trans	-174.3	172.9	178.4	0	0	0	0	0	111.9	A791 E795 A796 F797	A791-G793 PolarHBondContact O-N 3.43Å; A791-G793 VanDerWaalsContact O-N 3.16Å; G793-E795 VanDerWaalsContact C-N 3.32Å; G793-E795 PolarHBondContact O-N 2.94Å; G793-A796 PolarHBondContact O-N 3.44Å; G793-F797 PolarHBondContact O-N 3.38Å; G793-F797 VanDerWaalsContact O-N 3.14Å
794	S	94.8	Very high	93.2	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-34.4	-177.6	55.5	0	0	0	0	113.7	L666 F797 S798	L666-S794 WeakPolarHBondContact CD1-OG 3.47Å; S794-F797 PolarHBondContact O-N 3.05Å; S794-S798 WeakPolarHBondContact O-CB 3.39Å; S794-S798 PolarHBondContact O-N 3.28Å; S794-S798 PolarHBondContact O-OG 3.23Å
795	E	94.4	Very high	93.1	Very high	159 Å²	159	38.1 Å²	38.1	74%	0.743	21%	0.208	S	C	*	.	H	α-helix	trans	-66.5	-42.7	176.9	-65.5	-176.3	175.9	0	0	112.1	G793 S798 K799	G793-E795 VanDerWaalsContact C-N 3.32Å; G793-E795 PolarHBondContact O-N 2.94Å; E795-S798 WeakPolarHBondContact O-CB 3.46Å; E795-S798 PolarHBondContact O-N 3.48Å; E795-K799 PolarHBondContact O-N 2.88Å
796	A	94.8	Very high	93	Very high	34 Å²	34	41.6 Å²	41.6	28%	0.281	23%	0.226	S	C	.	.	H	α-helix	trans	-64.2	-45	177.2	0	0	0	0	0	110.8	A791 P792 G793 S798 K799 I800	A791-A796 HydrophobicContact CB-CB 4.48Å; P792-A796 HydrophobicContact CG-CB 3.7Å; G793-A796 PolarHBondContact O-N 3.44Å; A796-S798 VanDerWaalsContact C-N 3.33Å; A796-S798 PolarHBondContact O-N 2.93Å; A796-K799 PolarHBondContact O-N 3.16Å; A796-I800 VanDerWaalsContact O-CG1 3.31Å; A796-I800 WeakPolarHBondContact O-CG1 3.25Å; A796-I800 PolarHBondContact O-N 3.02Å; A796-I800 VanDerWaalsContact O-N 3.11Å
797	F	95.6	Very high	93	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-44.6	172.4	171.5	-110.2	0	0	0	111.7	L739 Y743 Y746 V784 A788 A791 G793 S794 K799 I800 A801	L739-F797 HydrophobicContact CB-CE1 4.44Å; L739-F797 HydrophobicContact CD2-CE1 4.45Å; Y743-F797 HydrophobicContact CD2-CB 3.75Å; Y743-F797 HydrophobicContact CD2-CD1 4.22Å; Y743-F797 HydrophobicContact CD2-CG 4.05Å; Y743-F797 HydrophobicContact CE2-CB 4.36Å; Y743-F797 HydrophobicContact CG-CD1 4.47Å; Y746-F797 HydrophobicContact CD2-CZ 4.21Å; Y746-F797 HydrophobicContact CE2-CZ 4.07Å; V784-F797 HydrophobicContact CG1-CE2 4.02Å; V784-F797 HydrophobicContact CG1-CZ 4.02Å; A788-F797 VanDerWaalsContact CA-CD2 3.46Å; A788-F797 HydrophobicContact CB-CD2 3.67Å; A788-F797 HydrophobicContact CB-CE2 3.63Å; A788-F797 HydrophobicContact CB-CG 4.16Å; A788-F797 HydrophobicContact CB-CZ 4.09Å; A791-F797 HydrophobicContact CB-CB 3.91Å; G793-F797 PolarHBondContact O-N 3.38Å; G793-F797 VanDerWaalsContact O-N 3.14Å; S794-F797 PolarHBondContact O-N 3.05Å; F797-K799 VanDerWaalsContact C-N 3.31Å; F797-K799 PolarHBondContact O-N 3.34Å; F797-I800 PolarHBondContact O-N 3.13Å; F797-I800 VanDerWaalsContact O-N 3.17Å; F797-A801 HydrophobicContact CE2-CB 4.33Å; F797-A801 HydrophobicContact CZ-CB 4.22Å; F797-A801 WeakPolarHBondContact O-CB 3.29Å; F797-A801 PolarHBondContact O-N 3.05Å
798	S	95.3	Very high	92.8	Very high	3 Å²	3	49 Å²	49	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-41.8	180	-63.5	0	0	0	0	112.1	L739 S794 E795 A796 K802	L739-S798 VanDerWaalsContact CB-OG 3.31Å; L739-S798 WeakPolarHBondContact CB-OG 3.46Å; S794-S798 WeakPolarHBondContact O-CB 3.39Å; S794-S798 PolarHBondContact O-N 3.28Å; S794-S798 PolarHBondContact O-OG 3.23Å; E795-S798 WeakPolarHBondContact O-CB 3.46Å; E795-S798 PolarHBondContact O-N 3.48Å; A796-S798 VanDerWaalsContact C-N 3.33Å; A796-S798 PolarHBondContact O-N 2.93Å; S798-K802 VanDerWaalsContact O-CB 3.3Å; S798-K802 WeakPolarHBondContact O-CB 3.37Å; S798-K802 VanDerWaalsContact O-CG 3.24Å; S798-K802 WeakPolarHBondContact O-CG 3.29Å; S798-K802 PolarHBondContact O-N 3.26Å
799	K	94.7	Very high	92.6	Very high	169 Å²	169	53.7 Å²	53.7	74%	0.735	29%	0.293	S	S	*	.	H	α-helix	trans	-63	-44.4	175.6	-173	178.7	-179.5	-179.9	0	111.9	E795 A796 F797 S803	E795-K799 PolarHBondContact O-N 2.88Å; A796-K799 PolarHBondContact O-N 3.16Å; F797-K799 VanDerWaalsContact C-N 3.31Å; F797-K799 PolarHBondContact O-N 3.34Å; K799-S803 PolarHBondContact O-N 3.45Å
800	I	93.7	Very high	92.4	Very high	49 Å²	49	55.3 Å²	55.3	25%	0.251	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-53.2	177.7	-67.8	167.1	0	0	0	110.1	A796 F797 K802 S803 W804	A796-I800 VanDerWaalsContact O-CG1 3.31Å; A796-I800 WeakPolarHBondContact O-CG1 3.25Å; A796-I800 PolarHBondContact O-N 3.02Å; A796-I800 VanDerWaalsContact O-N 3.11Å; F797-I800 PolarHBondContact O-N 3.13Å; F797-I800 VanDerWaalsContact O-N 3.17Å; I800-K802 PolarHBondContact O-N 3.29Å; I800-S803 WeakPolarHBondContact O-CB 3.34Å; I800-S803 PolarHBondContact O-N 3.09Å; I800-S803 VanDerWaalsContact O-N 3.14Å; I800-S803 PolarHBondContact O-OG 3.21Å; I800-W804 HydrophobicContact CG2-CD2 4.41Å; I800-W804 HydrophobicContact CG2-CE3 4.33Å; I800-W804 HydrophobicContact CG2-CH2 3.14Å; I800-W804 HydrophobicContact CG2-CZ2 3.25Å; I800-W804 HydrophobicContact CG2-CZ3 3.73Å
801	A	93.9	Very high	92.2	Very high	2 Å²	2	55.3 Å²	55.3	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-59.5	-46.5	-178.6	0	0	0	0	0	112.3	L739 F797 S803 W804 M805	L739-A801 HydrophobicContact CD1-CB 4.41Å; L739-A801 HydrophobicContact CD2-CB 3.98Å; F797-A801 HydrophobicContact CE2-CB 4.33Å; F797-A801 HydrophobicContact CZ-CB 4.22Å; F797-A801 WeakPolarHBondContact O-CB 3.29Å; F797-A801 PolarHBondContact O-N 3.05Å; A801-S803 VanDerWaalsContact C-N 3.25Å; A801-S803 PolarHBondContact O-N 3.15Å; A801-W804 PolarHBondContact O-N 2.9Å; A801-W804 VanDerWaalsContact O-N 3.15Å; A801-M805 HydrophobicContact CB-CE 3.93Å; A801-M805 HydrophobicContact CB-SD 4.45Å; A801-M805 VanDerWaalsContact O-CG 3.29Å; A801-M805 WeakPolarHBondContact O-CG 3.31Å; A801-M805 PolarHBondContact O-N 3.37Å; A801-M805 VanDerWaalsContact O-N 3.09Å
802	K	92.8	Very high	91.8	Very high	44 Å²	44	59.8 Å²	59.8	19%	0.191	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-34.5	177.2	-76.6	179.5	176.1	-173.5	0	112.8	D732 N736 L739 S798 I800 W804 L807	D732-K802 VanDerWaalsContact CG-NZ 3.35Å; D732-K802 IonicContact OD1-NZ 3.36Å; D732-K802 PolarHBondContact OD1-NZ 2.94Å; D732-K802 IonicContact OD2-NZ 3.77Å; D732-K802 PolarHBondContact OD2-NZ 3.29Å; N736-K802 VanDerWaalsContact CG-NZ 3.32Å; N736-K802 VanDerWaalsContact OD1-CE 3.24Å; N736-K802 WeakPolarHBondContact OD1-CE 3.38Å; N736-K802 PolarHBondContact OD1-NZ 3.28Å; L739-K802 HydrophobicContact CD1-CD 4.31Å; L739-K802 HydrophobicContact CD1-CG 3.74Å; S798-K802 VanDerWaalsContact O-CB 3.3Å; S798-K802 WeakPolarHBondContact O-CB 3.37Å; S798-K802 VanDerWaalsContact O-CG 3.24Å; S798-K802 WeakPolarHBondContact O-CG 3.29Å; S798-K802 PolarHBondContact O-N 3.26Å; I800-K802 PolarHBondContact O-N 3.29Å; K802-W804 PolarHBondContact O-N 3.02Å; K802-L807 HydrophobicContact CG-CD1 4.29Å
803	S	93.3	Very high	91.5	Very high	81 Å²	81	56.8 Å²	56.8	57%	0.566	31%	0.313	S	S	*	.	H	α-helix	trans	-63.6	-25.8	179.7	78.5	0	0	0	0	113.2	K799 I800 A801	K799-S803 PolarHBondContact O-N 3.45Å; I800-S803 WeakPolarHBondContact O-CB 3.34Å; I800-S803 PolarHBondContact O-N 3.09Å; I800-S803 VanDerWaalsContact O-N 3.14Å; I800-S803 PolarHBondContact O-OG 3.21Å; A801-S803 VanDerWaalsContact C-N 3.25Å; A801-S803 PolarHBondContact O-N 3.15Å
804	W	91.6	Very high	91.2	Very high	51 Å²	51	56.4 Å²	56.4	19%	0.193	31%	0.307	C	S	.	.	H	α-helix	trans	-99.3	-32.7	-178.8	-53.1	-25.1	0	0	0	113.2	G776 P779 K782 E787 I800 A801 K802 N806	G776-W804 WeakPolarHBondContact CA-O 3.4Å; P779-W804 HydrophobicContact CG-CB 4.08Å; P779-W804 VanDerWaalsContact CG-CD1 3.48Å; P779-W804 HydrophobicContact CG-CD2 3.68Å; P779-W804 HydrophobicContact CG-CE3 4.42Å; P779-W804 HydrophobicContact CG-CG 3.47Å; P779-W804 VanDerWaalsContact CG-CG 3.47Å; K782-W804 HydrophobicContact CB-CH2 4.23Å; K782-W804 HydrophobicContact CB-CZ3 4.39Å; K782-W804 HydrophobicContact CD-CH2 4.39Å; K782-W804 HydrophobicContact CD-CZ2 4.44Å; K782-W804 HydrophobicContact CG-CH2 4.23Å; K782-W804 HydrophobicContact CG-CZ2 4.24Å; E787-W804 HydrophobicContact CB-CH2 4.14Å; E787-W804 HydrophobicContact CB-CZ3 4.33Å; E787-W804 HydrophobicContact CG-CH2 3.52Å; E787-W804 HydrophobicContact CG-CZ3 3.96Å; I800-W804 HydrophobicContact CG2-CD2 4.41Å; I800-W804 HydrophobicContact CG2-CE3 4.33Å; I800-W804 HydrophobicContact CG2-CH2 3.14Å; I800-W804 HydrophobicContact CG2-CZ2 3.25Å; I800-W804 HydrophobicContact CG2-CZ3 3.73Å; A801-W804 PolarHBondContact O-N 2.9Å; A801-W804 VanDerWaalsContact O-N 3.15Å; K802-W804 PolarHBondContact O-N 3.02Å; W804-N806 PolarHBondContact O-N 3.49Å
805	M	92.1	Very high	90.5	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-66.3	-21.3	-174.3	-74.3	172.3	-177.9	0	0	113.8	L739 Y760 I763 L767 V774 A775 G776 A801 L807	L739-M805 HydrophobicContact CD2-CE 3.9Å; L739-M805 HydrophobicContact CD2-SD 4.25Å; Y760-M805 HydrophobicContact CD2-CE 4.44Å; Y760-M805 HydrophobicContact CE2-CE 3.63Å; I763-M805 HydrophobicContact CD1-CE 4.27Å; I763-M805 HydrophobicContact CG2-CE 3.6Å; I763-M805 HydrophobicContact CG2-SD 4.19Å; L767-M805 HydrophobicContact CD1-SD 3.86Å; V774-M805 HydrophobicContact CG1-CB 4.02Å; V774-M805 HydrophobicContact CG1-CG 4.14Å; V774-M805 WeakPolarHBondContact CG1-O 3.37Å; V774-M805 HydrophobicContact CG2-CB 4.4Å; V774-M805 HydrophobicContact CG2-CG 4.46Å; A775-M805 PolarHBondContact N-O 3.25Å; A775-M805 VanDerWaalsContact N-O 3.11Å; G776-M805 PolarHBondContact N-O 3.05Å; A801-M805 HydrophobicContact CB-CE 3.93Å; A801-M805 HydrophobicContact CB-SD 4.45Å; A801-M805 VanDerWaalsContact O-CG 3.29Å; A801-M805 WeakPolarHBondContact O-CG 3.31Å; A801-M805 PolarHBondContact O-N 3.37Å; A801-M805 VanDerWaalsContact O-N 3.09Å; M805-L807 HydrophobicContact CB-CD2 3.7Å; M805-L807 HydrophobicContact CB-CG 4.12Å; M805-L807 PolarHBondContact O-N 3.32Å; M805-L807 HydrophobicContact SD-CD2 4.44Å
806	N	91.6	Very high	90.1	Very high	87 Å²	87	61.9 Å²	61.9	47%	0.465	34%	0.336	S	S	.	.			trans	47.1	62.7	-178.3	-173.6	17.8	0	0	0	111.5	A775 W804 K808	A775-N806 PolarHBondContact N-O 3.44Å; W804-N806 PolarHBondContact O-N 3.49Å; N806-K808 PolarHBondContact O-N 3.08Å
807	L	91.8	Very high	90.1	Very high	50 Å²	50	61 Å²	61	26%	0.262	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	121.5	-171.8	-60	178.5	0	0	0	111.4	L767 E773 V774 K802 M805	L767-L807 HydrophobicContact CD1-CD2 3.94Å; E773-L807 WeakPolarHBondContact O-CA 3.41Å; V774-L807 HydrophobicContact CG2-CD2 3.91Å; K802-L807 HydrophobicContact CG-CD1 4.29Å; M805-L807 HydrophobicContact CB-CD2 3.7Å; M805-L807 HydrophobicContact CB-CG 4.12Å; M805-L807 PolarHBondContact O-N 3.32Å; M805-L807 HydrophobicContact SD-CD2 4.44Å
808	K	90.4	Very high	90	Very high	114 Å²	114	62.2 Å²	62.2	50%	0.496	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	164.8	176.5	-65.6	-178	-177.1	178.5	0	110.9	K772 E773 A775 N806	K772-K808 CarbonylContact C-O 3.51Å; K772-K808 VanDerWaalsContact CA-O 3.29Å; K772-K808 WeakPolarHBondContact CA-O 3.49Å; E773-K808 PolarHBondContact N-O 2.6Å; E773-K808 PolarHBondContact O-N 3.12Å; A775-K808 HydrophobicContact CB-CD 3.91Å; A775-K808 HydrophobicContact CB-CG 4.35Å; N806-K808 PolarHBondContact O-N 3.08Å
809	S	88.8	Confident	90	Very high	97 Å²	97	62.7 Å²	62.7	68%	0.678	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	135.9	169.4	-60.1	0	0	0	0	109.9
810	I	87.4	Confident	90.1	Very high	42 Å²	42	54.6 Å²	54.6	22%	0.215	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-62.5	137.9	-177.4	-165.2	163.1	0	0	0	111.9	M525 M768 G771 Y814	M525-I810 HydrophobicContact SD-CD1 4.22Å; M768-I810 HydrophobicContact CB-CD1 4Å; M768-I810 HydrophobicContact CE-CD1 4.46Å; M768-I810 HydrophobicContact CG-CD1 4.45Å; M768-I810 VanDerWaalsContact O-CD1 3.32Å; M768-I810 WeakPolarHBondContact O-CD1 3.24Å; G771-I810 WeakPolarHBondContact O-CB 3.39Å; G771-I810 PolarHBondContact O-N 2.96Å; I810-Y814 HydrophobicContact CD1-CD2 4.12Å; I810-Y814 HydrophobicContact CD1-CG 4.18Å; I810-Y814 HydrophobicContact CG1-CD2 3.56Å; I810-Y814 HydrophobicContact CG1-CE2 4.2Å; I810-Y814 HydrophobicContact CG1-CG 4.1Å
811	S	86.5	Confident	90	Very high	43 Å²	43	54.2 Å²	54.2	30%	0.301	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-65.4	141.2	174.1	175.2	0	0	0	0	111.9	S813 Y814	S811-S813 PolarHBondContact O-N 3.43Å; S811-S813 VanDerWaalsContact O-N 3.16Å; S811-S813 PolarHBondContact OG-N 3.36Å; S811-S813 PolarHBondContact OG-OG 2.83Å; S811-Y814 WeakPolarHBondContact O-CD2 3.3Å; S811-Y814 PolarHBondContact O-N 2.64Å
812	P	82.8	Confident	90	Very high	103 Å²	103	61 Å²	61	67%	0.669	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-57.2	-25.8	171.6	-23.9	33.6	0	0	0	114	Y814 K815	P812-Y814 PolarHBondContact O-N 3.14Å; P812-K815 WeakPolarHBondContact O-CB 3.35Å; P812-K815 PolarHBondContact O-N 3.5Å
813	S	83.2	Confident	90.2	Very high	42 Å²	42	60.8 Å²	60.8	29%	0.294	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-61.4	-22.9	-179.6	61.9	0	0	0	0	113.7	S811 K815 T816	S811-S813 PolarHBondContact O-N 3.43Å; S811-S813 VanDerWaalsContact O-N 3.16Å; S811-S813 PolarHBondContact OG-N 3.36Å; S811-S813 PolarHBondContact OG-OG 2.83Å; S813-K815 VanDerWaalsContact C-N 3.27Å; S813-K815 PolarHBondContact O-N 3.17Å; S813-T816 PolarHBondContact O-N 3.34Å; S813-T816 PolarHBondContact O-OG1 2.99Å
814	Y	85.8	Confident	90.3	Very high	7 Å²	7	57.2 Å²	57.2	3%	0.027	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-68.6	-26.9	175.6	-73.8	-78	0	0	0	113.3	V492 R495 L496 L522 M768 E773 I810 S811 P812 T816 L817	V492-Y814 HydrophobicContact CG1-CD1 4.26Å; V492-Y814 HydrophobicContact CG1-CE1 3.42Å; V492-Y814 VanDerWaalsContact CG1-CE1 3.42Å; R495-Y814 PolarHBondContact NH2-OH 2.77Å; L496-Y814 HydrophobicContact CD1-CE1 4.38Å; L522-Y814 HydrophobicContact CD2-CD1 4.03Å; L522-Y814 HydrophobicContact CD2-CE1 4.03Å; M768-Y814 HydrophobicContact CE-CD1 3.44Å; M768-Y814 VanDerWaalsContact CE-CD1 3.44Å; M768-Y814 HydrophobicContact CE-CE1 3.16Å; M768-Y814 HydrophobicContact CE-CE2 4.32Å; M768-Y814 HydrophobicContact CE-CG 4.11Å; E773-Y814 HydrophobicContact CG-CE2 4.37Å; E773-Y814 PolarHBondContact OE1-OH 2.86Å; E773-Y814 WeakPolarHBondContact OE2-CE2 3.43Å; I810-Y814 HydrophobicContact CD1-CD2 4.12Å; I810-Y814 HydrophobicContact CD1-CG 4.18Å; I810-Y814 HydrophobicContact CG1-CD2 3.56Å; I810-Y814 HydrophobicContact CG1-CE2 4.2Å; I810-Y814 HydrophobicContact CG1-CG 4.1Å; S811-Y814 WeakPolarHBondContact O-CD2 3.3Å; S811-Y814 PolarHBondContact O-N 2.64Å; P812-Y814 PolarHBondContact O-N 3.14Å; Y814-T816 VanDerWaalsContact C-N 3.29Å; Y814-L817 HydrophobicContact CD1-CD1 3.83Å; Y814-L817 HydrophobicContact CE1-CD1 4.48Å; Y814-L817 PolarHBondContact O-N 3.46Å
815	K	80.3	Confident	90.4	Very high	184 Å²	184	57.6 Å²	57.6	80%	0.8	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-74.2	-22.3	179	-64.1	-175.4	177.8	-177.8	0	112.5	P812 S813	P812-K815 WeakPolarHBondContact O-CB 3.35Å; P812-K815 PolarHBondContact O-N 3.5Å; S813-K815 VanDerWaalsContact C-N 3.27Å; S813-K815 PolarHBondContact O-N 3.17Å
816	T	86.8	Confident	90.5	Very high	95 Å²	95	58.8 Å²	58.8	58%	0.583	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-89.2	-5.8	179.4	53.7	0	0	0	0	112.9	S813 Y814	S813-T816 PolarHBondContact O-N 3.34Å; S813-T816 PolarHBondContact O-OG1 2.99Å; Y814-T816 VanDerWaalsContact C-N 3.29Å
817	L	92.8	Very high	90.7	Very high	16 Å²	16	54.8 Å²	54.8	8%	0.084	31%	0.307	C	S	.	.	S	Bend	trans	-71.3	141.5	177.6	-64.4	178.3	0	0	0	111.3	E488 M489 V492 L522 Y814	E488-L817 HydrophobicContact CB-CD2 4.49Å; E488-L817 HydrophobicContact CG-CD2 4.11Å; M489-L817 HydrophobicContact CB-CD2 4.2Å; V492-L817 HydrophobicContact CG1-CD1 4.27Å; L522-L817 HydrophobicContact CD1-CD1 4.45Å; L522-L817 HydrophobicContact CD2-CD1 4.1Å; Y814-L817 HydrophobicContact CD1-CD1 3.83Å; Y814-L817 HydrophobicContact CE1-CD1 4.48Å; Y814-L817 PolarHBondContact O-N 3.46Å
818	P	95.1	Very high	90.9	Very high	26 Å²	26	54.1 Å²	54.1	17%	0.169	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-67.6	161.7	176.6	29.2	-34.1	0	0	0	111.6	E485 V486 M489 Q526 V820	E485-P818 HydrophobicContact CB-CG 4.35Å; V486-P818 HydrophobicContact CG2-CG 4.2Å; M489-P818 HydrophobicContact CE-CG 4.08Å; M489-P818 HydrophobicContact SD-CG 4.03Å; Q526-P818 PolarHBondContact NE2-O 3.23Å; P818-V820 PolarHBondContact O-N 3.14Å
819	S	94.8	Very high	91.1	Very high	12 Å²	12	49.3 Å²	49.3	8%	0.084	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-64.9	121.5	175.5	175.7	0	0	0	0	110.7	R530 S821 E822 T823	R530-S819 VanDerWaalsContact NH2-CB 3.31Å; R530-S819 PolarHBondContact NH2-OG 3.38Å; S819-S821 PolarHBondContact O-N 3.11Å; S819-S821 PolarHBondContact OG-OG 2.82Å; S819-E822 WeakPolarHBondContact CB-OE2 3.31Å; S819-E822 PolarHBondContact O-N 3.36Å; S819-E822 WeakPolarHBondContact OG-CG 3.49Å; S819-E822 PolarHBondContact OG-N 3.41Å; S819-T823 WeakPolarHBondContact O-CB 3.45Å; S819-T823 PolarHBondContact O-N 3.17Å; S819-T823 PolarHBondContact O-OG1 3.16Å
820	V	96.2	Very high	91.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-46.5	-179.4	179.1	0	0	0	0	110.3	M489 L519 L522 E523 W558 P818 E822 T823 F824	M489-V820 HydrophobicContact SD-CG2 3.73Å; L519-V820 HydrophobicContact CD2-CG1 4.41Å; L522-V820 HydrophobicContact CB-CG2 3.78Å; E523-V820 HydrophobicContact CB-CB 3.89Å; E523-V820 HydrophobicContact CB-CG1 3.96Å; E523-V820 HydrophobicContact CB-CG2 4.29Å; E523-V820 HydrophobicContact CG-CB 4.2Å; E523-V820 HydrophobicContact CG-CG1 4.37Å; W558-V820 HydrophobicContact CZ2-CG1 3.92Å; P818-V820 PolarHBondContact O-N 3.14Å; V820-E822 VanDerWaalsContact C-N 3.32Å; V820-E822 PolarHBondContact O-N 3.06Å; V820-T823 PolarHBondContact O-N 3.27Å; V820-F824 HydrophobicContact CG1-CD2 4.1Å; V820-F824 PolarHBondContact O-N 3.25Å
821	S	92.8	Very high	91.8	Very high	41 Å²	41	42.9 Å²	42.9	29%	0.287	24%	0.24	S	C	.	.	H	α-helix	trans	-70	-24.7	-177.9	51.3	0	0	0	0	114.3	S819 P825	S819-S821 PolarHBondContact O-N 3.11Å; S819-S821 PolarHBondContact OG-OG 2.82Å; S821-P825 WeakPolarHBondContact O-CA 3.42Å
822	E	93.3	Very high	92.2	Very high	143 Å²	143	42.8 Å²	42.8	67%	0.668	24%	0.235	S	C	*	.	H	α-helix	trans	-86	-30.1	173.6	-64	170.2	-177.9	0	0	111.6	S819 V820	S819-E822 WeakPolarHBondContact CB-OE2 3.31Å; S819-E822 PolarHBondContact O-N 3.36Å; S819-E822 WeakPolarHBondContact OG-CG 3.49Å; S819-E822 PolarHBondContact OG-N 3.41Å; V820-E822 VanDerWaalsContact C-N 3.32Å; V820-E822 PolarHBondContact O-N 3.06Å
823	T	96	Very high	92.8	Very high	41 Å²	41	37.9 Å²	37.9	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-73.7	-37.8	177.2	-53.7	0	0	0	0	111.2	V486 M489 S819 V820 P825	V486-T823 HydrophobicContact CG1-CG2 4.03Å; V486-T823 HydrophobicContact CG2-CG2 3.78Å; M489-T823 HydrophobicContact CE-CG2 3.83Å; S819-T823 WeakPolarHBondContact O-CB 3.45Å; S819-T823 PolarHBondContact O-N 3.17Å; S819-T823 PolarHBondContact O-OG1 3.16Å; V820-T823 PolarHBondContact O-N 3.27Å; T823-P825 VanDerWaalsContact C-CD 3.43Å; T823-P825 WeakPolarHBondContact O-CD 3.47Å
824	F	95.4	Very high	93.4	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.026	19%	0.191	C	C	.	.	S	Bend	trans	-123.4	68.9	-179.8	-49.2	-63.5	0	0	0	111.6	L433 Y482 V486 M489 L519 W558 V820 T826 S829 M830 V833	L433-F824 VanDerWaalsContact CD1-O 3.27Å; L433-F824 WeakPolarHBondContact CD1-O 3.43Å; Y482-F824 HydrophobicContact CE1-CE1 4.27Å; V486-F824 HydrophobicContact CG1-CZ 3.99Å; M489-F824 HydrophobicContact CE-CD2 4.41Å; M489-F824 HydrophobicContact CE-CE2 3.41Å; M489-F824 VanDerWaalsContact CE-CE2 3.41Å; M489-F824 HydrophobicContact CE-CZ 3.77Å; L519-F824 HydrophobicContact CD2-CE2 4.06Å; W558-F824 HydrophobicContact CH2-CB 4.32Å; W558-F824 HydrophobicContact CH2-CD2 4.12Å; W558-F824 HydrophobicContact CH2-CG 4.37Å; W558-F824 HydrophobicContact CZ2-CD2 4.33Å; V820-F824 HydrophobicContact CG1-CD2 4.1Å; V820-F824 PolarHBondContact O-N 3.25Å; F824-T826 VanDerWaalsContact C-N 3.33Å; F824-T826 PolarHBondContact O-N 2.8Å; F824-S829 WeakPolarHBondContact CA-OG 3.48Å; F824-M830 HydrophobicContact CB-CG 4.29Å; F824-V833 HydrophobicContact CD1-CB 4.14Å; F824-V833 HydrophobicContact CD1-CG1 4.02Å; F824-V833 HydrophobicContact CD2-CG1 4.36Å; F824-V833 HydrophobicContact CE1-CB 3.61Å; F824-V833 HydrophobicContact CE1-CG1 3.93Å; F824-V833 HydrophobicContact CE1-CG2 3.91Å; F824-V833 HydrophobicContact CE2-CB 4.46Å; F824-V833 HydrophobicContact CE2-CG1 4.25Å; F824-V833 HydrophobicContact CE2-CG2 4.2Å; F824-V833 HydrophobicContact CG-CG1 4.24Å; F824-V833 HydrophobicContact CZ-CB 3.8Å; F824-V833 HydrophobicContact CZ-CG1 4.06Å; F824-V833 HydrophobicContact CZ-CG2 3.57Å
825	P	94.3	Very high	93.7	Very high	59 Å²	59	37.3 Å²	37.3	38%	0.383	20%	0.198	S	C	.	.			trans	-79.4	-10.5	-170.8	32.2	-36.5	0	0	0	114.8	L433 S821 T823	L433-P825 WeakPolarHBondContact CG-O 3.45Å; L433-P825 PolarHBondContact N-O 3.16Å; S821-P825 WeakPolarHBondContact O-CA 3.42Å; T823-P825 VanDerWaalsContact C-CD 3.43Å; T823-P825 WeakPolarHBondContact O-CD 3.47Å
826	T	95.4	Very high	94.3	Very high	27 Å²	27	28.8 Å²	28.8	17%	0.166	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-129.8	159.4	-175.1	62.6	0	0	0	0	111.9	F824 R828 S829 M830	F824-T826 VanDerWaalsContact C-N 3.33Å; F824-T826 PolarHBondContact O-N 2.8Å; T826-R828 PolarHBondContact O-N 2.83Å; T826-S829 PolarHBondContact N-OG 3.28Å; T826-S829 VanDerWaalsContact N-OG 3.17Å; T826-S829 PolarHBondContact O-N 3.41Å; T826-S829 VanDerWaalsContact O-N 3.16Å; T826-S829 PolarHBondContact O-OG 3.07Å; T826-S829 PolarHBondContact OG1-N 3.38Å; T826-S829 PolarHBondContact OG1-OG 3.32Å; T826-M830 WeakPolarHBondContact O-CG 3.32Å; T826-M830 PolarHBondContact O-N 2.97Å; T826-M830 VanDerWaalsContact O-N 3.11Å
827	L	94.2	Very high	94.2	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-55	-38.7	173.8	-71.4	-178.2	0	0	0	112.4	L425 H428 L429 L433 Y436 I561 M830 M831	L425-L827 HydrophobicContact CD2-CD1 4.17Å; H428-L827 HydrophobicContact CB-CD1 4Å; H428-L827 WeakPolarHBondContact O-CD1 3.34Å; L429-L827 HydrophobicContact CD1-CB 4.23Å; L433-L827 HydrophobicContact CD2-CD2 3.77Å; L433-L827 HydrophobicContact CD2-CG 4.18Å; Y436-L827 HydrophobicContact CD1-CD2 4.27Å; Y436-L827 HydrophobicContact CD2-CD1 3.85Å; Y436-L827 HydrophobicContact CD2-CD2 4.35Å; Y436-L827 HydrophobicContact CD2-CG 4.29Å; Y436-L827 HydrophobicContact CE1-CD2 3.95Å; Y436-L827 HydrophobicContact CE2-CD1 3.53Å; Y436-L827 HydrophobicContact CE2-CD2 4.04Å; Y436-L827 HydrophobicContact CE2-CG 4.22Å; Y436-L827 HydrophobicContact CG-CD2 4.43Å; I561-L827 HydrophobicContact CD1-CD2 3.4Å; I561-L827 HydrophobicContact CG1-CD2 4.16Å; L827-M830 PolarHBondContact O-N 3Å; L827-M831 WeakPolarHBondContact O-CG 3.47Å; L827-M831 PolarHBondContact O-N 2.63Å
828	R	95.9	Very high	93.8	Very high	36 Å²	36	28.1 Å²	28.1	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-53.2	-57.6	174.8	-178.6	178.9	-58.9	-76.7	-3.8	111	L429 D430 K472 D473 V474 T826 M830 M831 E832	L429-R828 HydrophobicContact CD1-CB 4.14Å; L429-R828 HydrophobicContact CG-CB 4.04Å; L429-R828 WeakPolarHBondContact O-CB 3.26Å; L429-R828 PolarHBondContact O-N 2.83Å; D430-R828 IonicContact OD1-CZ 2.93Å; D430-R828 IonicContact OD1-NE 3.71Å; D430-R828 PolarHBondContact OD1-NE 3.46Å; D430-R828 IonicContact OD1-NH2 2.98Å; D430-R828 PolarHBondContact OD1-NH2 2.93Å; D430-R828 IonicContact OD2-CZ 3.24Å; D430-R828 IonicContact OD2-NE 3.84Å; D430-R828 IonicContact OD2-NH2 3.54Å; D430-R828 PolarHBondContact OD2-NH2 3.34Å; K472-R828 VanDerWaalsContact O-CZ 3.25Å; K472-R828 PolarHBondContact O-NH1 3.5Å; K472-R828 PolarHBondContact O-NH2 3.16Å; D473-R828 PolarHBondContact O-NH1 3.11Å; V474-R828 HydrophobicContact CG2-CG 4.38Å; T826-R828 PolarHBondContact O-N 2.83Å; R828-M830 VanDerWaalsContact C-N 3.28Å; R828-M830 PolarHBondContact O-N 2.82Å; R828-M831 PolarHBondContact O-N 3.32Å; R828-E832 HydrophobicContact CG-CG 4.33Å; R828-E832 VanDerWaalsContact CG-OE1 3.29Å; R828-E832 WeakPolarHBondContact CG-OE1 3.39Å; R828-E832 WeakPolarHBondContact O-CG 3.45Å; R828-E832 PolarHBondContact O-N 2.93Å
829	S	95.3	Very high	92.9	Very high	13 Å²	13	29 Å²	29	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-34.3	-176.3	64.2	0	0	0	0	112.6	F824 T826 V833	F824-S829 WeakPolarHBondContact CA-OG 3.48Å; T826-S829 PolarHBondContact N-OG 3.28Å; T826-S829 VanDerWaalsContact N-OG 3.17Å; T826-S829 PolarHBondContact O-N 3.41Å; T826-S829 VanDerWaalsContact O-N 3.16Å; T826-S829 PolarHBondContact O-OG 3.07Å; T826-S829 PolarHBondContact OG1-N 3.38Å; T826-S829 PolarHBondContact OG1-OG 3.32Å; S829-V833 WeakPolarHBondContact O-CG1 3.44Å; S829-V833 PolarHBondContact O-N 3.23Å; S829-V833 VanDerWaalsContact O-N 3.15Å
830	M	95.7	Very high	91.5	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-45.4	171.7	-65.1	179.1	83.7	0	0	111.7	L433 W558 I561 F824 T826 L827 R828 V833 L834	L433-M830 HydrophobicContact CD1-CG 4.01Å; L433-M830 HydrophobicContact CD1-SD 3.39Å; L433-M830 WeakPolarHBondContact CD1-SD 3.19Å; L433-M830 HydrophobicContact CD2-SD 3.49Å; L433-M830 WeakPolarHBondContact CD2-SD 3.41Å; L433-M830 HydrophobicContact CG-SD 4.05Å; W558-M830 HydrophobicContact CB-CE 4.5Å; W558-M830 HydrophobicContact CD2-CE 3.3Å; W558-M830 VanDerWaalsContact CE2-CE 3.44Å; W558-M830 HydrophobicContact CE3-CE 3.49Å; W558-M830 VanDerWaalsContact CE3-CE 3.49Å; W558-M830 HydrophobicContact CG-CE 3.78Å; W558-M830 HydrophobicContact CH2-CB 3.99Å; W558-M830 HydrophobicContact CH2-CE 3.91Å; W558-M830 HydrophobicContact CH2-CG 3.72Å; W558-M830 HydrophobicContact CZ2-CE 3.76Å; W558-M830 HydrophobicContact CZ2-CG 4.12Å; W558-M830 HydrophobicContact CZ3-CB 3.88Å; W558-M830 HydrophobicContact CZ3-CE 3.79Å; W558-M830 HydrophobicContact CZ3-CG 4.04Å; I561-M830 HydrophobicContact CD1-CB 4.25Å; I561-M830 HydrophobicContact CD1-CE 3.59Å; I561-M830 HydrophobicContact CD1-SD 3.44Å; I561-M830 WeakPolarHBondContact CD1-SD 3.46Å; F824-M830 HydrophobicContact CB-CG 4.29Å; T826-M830 WeakPolarHBondContact O-CG 3.32Å; T826-M830 PolarHBondContact O-N 2.97Å; T826-M830 VanDerWaalsContact O-N 3.11Å; L827-M830 PolarHBondContact O-N 3Å; R828-M830 VanDerWaalsContact C-N 3.28Å; R828-M830 PolarHBondContact O-N 2.82Å; M830-V833 WeakPolarHBondContact O-CG1 3.48Å; M830-L834 WeakPolarHBondContact O-CB 3.48Å; M830-L834 WeakPolarHBondContact O-CG 3.29Å; M830-L834 PolarHBondContact O-N 3.45Å; M830-L834 VanDerWaalsContact O-N 3.11Å
831	M	95.8	Very high	90.4	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-42	177.5	-74.4	-175.5	146.2	0	0	111.7	V382 F387 L425 L429 V474 I561 L827 R828 V833 L834 N835	V382-M831 WeakPolarHBondContact O-CE 3.27Å; F387-M831 HydrophobicContact CE1-CE 4.45Å; F387-M831 HydrophobicContact CE2-SD 4.25Å; F387-M831 HydrophobicContact CZ-CE 3.83Å; F387-M831 HydrophobicContact CZ-SD 3.87Å; L425-M831 HydrophobicContact CD1-CE 4.37Å; L429-M831 HydrophobicContact CD1-SD 4.05Å; V474-M831 HydrophobicContact CG1-CB 4.23Å; V474-M831 HydrophobicContact CG2-CB 4.06Å; V474-M831 HydrophobicContact CG2-SD 4.02Å; I561-M831 HydrophobicContact CG2-CE 4.15Å; I561-M831 HydrophobicContact CG2-CG 3.64Å; L827-M831 WeakPolarHBondContact O-CG 3.47Å; L827-M831 PolarHBondContact O-N 2.63Å; R828-M831 PolarHBondContact O-N 3.32Å; M831-V833 PolarHBondContact O-N 3.18Å; M831-L834 PolarHBondContact O-N 3.32Å; M831-N835 WeakPolarHBondContact O-CB 3.38Å; M831-N835 PolarHBondContact O-N 3.43Å; M831-N835 PolarHBondContact O-ND2 3.24Å
832	E	95.2	Very high	89.6	Confident	41 Å²	41	36.7 Å²	36.7	19%	0.192	19%	0.191	C	C	.	.	H	α-helix	trans	-56.4	-49.8	177.2	-71.7	170.8	169.3	0	0	111.7	V474 Q477 R828 L834 N835 T836	V474-E832 HydrophobicContact CG1-CB 4.47Å; V474-E832 HydrophobicContact CG1-CG 3.45Å; V474-E832 VanDerWaalsContact CG1-CG 3.45Å; Q477-E832 HydrophobicContact CB-CB 4.34Å; R828-E832 HydrophobicContact CG-CG 4.33Å; R828-E832 VanDerWaalsContact CG-OE1 3.29Å; R828-E832 WeakPolarHBondContact CG-OE1 3.39Å; R828-E832 WeakPolarHBondContact O-CG 3.45Å; R828-E832 PolarHBondContact O-N 2.93Å; E832-L834 PolarHBondContact O-N 3.42Å; E832-N835 PolarHBondContact O-N 2.81Å; E832-T836 PolarHBondContact O-N 3.5Å; E832-T836 PolarHBondContact O-OG1 3.4Å
833	V	95.8	Very high	88	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.2	-36.1	179.4	69.1	0	0	0	0	112.1	Y482 I490 R515 L519 W558 F824 S829 M830 M831 N835 T836	Y482-V833 WeakPolarHBondContact OH-CA 3.44Å; Y482-V833 PolarHBondContact OH-N 3.34Å; I490-V833 HydrophobicContact CD1-CG2 3.82Å; I490-V833 HydrophobicContact CG1-CG2 3.72Å; R515-V833 VanDerWaalsContact CD-O 3.31Å; R515-V833 WeakPolarHBondContact CD-O 3.45Å; R515-V833 PolarHBondContact NH1-O 2.86Å; L519-V833 HydrophobicContact CD1-CG1 3.84Å; L519-V833 HydrophobicContact CD1-CG2 4.11Å; W558-V833 HydrophobicContact CH2-CG1 3.89Å; W558-V833 HydrophobicContact CZ3-CG1 3.97Å; F824-V833 HydrophobicContact CD1-CB 4.14Å; F824-V833 HydrophobicContact CD1-CG1 4.02Å; F824-V833 HydrophobicContact CD2-CG1 4.36Å; F824-V833 HydrophobicContact CE1-CB 3.61Å; F824-V833 HydrophobicContact CE1-CG1 3.93Å; F824-V833 HydrophobicContact CE1-CG2 3.91Å; F824-V833 HydrophobicContact CE2-CB 4.46Å; F824-V833 HydrophobicContact CE2-CG1 4.25Å; F824-V833 HydrophobicContact CE2-CG2 4.2Å; F824-V833 HydrophobicContact CG-CG1 4.24Å; F824-V833 HydrophobicContact CZ-CB 3.8Å; F824-V833 HydrophobicContact CZ-CG1 4.06Å; F824-V833 HydrophobicContact CZ-CG2 3.57Å; S829-V833 WeakPolarHBondContact O-CG1 3.44Å; S829-V833 PolarHBondContact O-N 3.23Å; S829-V833 VanDerWaalsContact O-N 3.15Å; M830-V833 WeakPolarHBondContact O-CG1 3.48Å; M831-V833 PolarHBondContact O-N 3.18Å; V833-N835 VanDerWaalsContact C-N 3.27Å; V833-N835 PolarHBondContact O-N 2.99Å; V833-T836 PolarHBondContact O-N 3.4Å
834	L	95.3	Very high	85.8	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-25.9	176.6	-69.4	177.9	0	0	0	113.3	R512 R515 A516 W558 I561 M830 M831 E832	R512-L834 HydrophobicContact CG-CB 4.16Å; R515-L834 HydrophobicContact CB-CD2 4.24Å; R515-L834 HydrophobicContact CG-CD2 4.32Å; R515-L834 PolarHBondContact NH1-O 3.11Å; A516-L834 HydrophobicContact CB-CD2 3.64Å; W558-L834 HydrophobicContact CE3-CD1 4.24Å; W558-L834 HydrophobicContact CE3-CD2 4.21Å; W558-L834 HydrophobicContact CE3-CG 4.37Å; W558-L834 HydrophobicContact CZ3-CD1 4.27Å; W558-L834 HydrophobicContact CZ3-CD2 4.14Å; W558-L834 HydrophobicContact CZ3-CG 4.05Å; I561-L834 HydrophobicContact CB-CD1 4.39Å; I561-L834 HydrophobicContact CG2-CD1 3.92Å; M830-L834 WeakPolarHBondContact O-CB 3.48Å; M830-L834 WeakPolarHBondContact O-CG 3.29Å; M830-L834 PolarHBondContact O-N 3.45Å; M830-L834 VanDerWaalsContact O-N 3.11Å; M831-L834 PolarHBondContact O-N 3.32Å; E832-L834 PolarHBondContact O-N 3.42Å
835	N	92.5	Very high	83.3	Confident	32 Å²	32	49.1 Å²	49.1	17%	0.171	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-3	-179.3	-61.9	-29.5	0	0	0	113.9	A383 M384 R512 M831 E832 V833	A383-N835 PolarHBondContact O-OD1 3.03Å; M384-N835 VanDerWaalsContact C-ND2 3.35Å; M384-N835 VanDerWaalsContact CA-ND2 3.27Å; M384-N835 WeakPolarHBondContact CA-ND2 3.2Å; M384-N835 PolarHBondContact O-ND2 2.9Å; R512-N835 PolarHBondContact NE-OD1 3.34Å; M831-N835 WeakPolarHBondContact O-CB 3.38Å; M831-N835 PolarHBondContact O-N 3.43Å; M831-N835 PolarHBondContact O-ND2 3.24Å; E832-N835 PolarHBondContact O-N 2.81Å; V833-N835 VanDerWaalsContact C-N 3.27Å; V833-N835 PolarHBondContact O-N 2.99Å
836	T	91.2	Very high	80.7	Confident	4 Å²	4	52.6 Å²	52.6	3%	0.025	26%	0.259	C	S	.	.			trans	-72.3	135.2	-179.2	-58.9	0	0	0	0	110.8	Q477 F479 Y482 R515 E832 V833	Q477-T836 PolarHBondContact O-OG1 3.41Å; F479-T836 HydrophobicContact CB-CG2 3.76Å; F479-T836 HydrophobicContact CD2-CG2 3.94Å; F479-T836 HydrophobicContact CG-CG2 4.37Å; Y482-T836 HydrophobicContact CE2-CG2 3.92Å; Y482-T836 WeakPolarHBondContact CE2-OG1 3.5Å; Y482-T836 PolarHBondContact OH-OG1 2.93Å; R515-T836 VanDerWaalsContact CZ-O 3.23Å; R515-T836 PolarHBondContact NH1-O 3.46Å; R515-T836 PolarHBondContact NH2-O 3.13Å; E832-T836 PolarHBondContact O-N 3.5Å; E832-T836 PolarHBondContact O-OG1 3.4Å; V833-T836 PolarHBondContact O-N 3.4Å
837	D	86.1	Confident	80	Confident	94 Å²	94	53.9 Å²	53.9	50%	0.503	26%	0.264	S	S	.	.			trans	-88.4	111.9	170.3	-172.8	9	0	0	0	110.5	T839	D837-T839 VanDerWaalsContact OD1-CB 3.31Å; D837-T839 WeakPolarHBondContact OD1-CB 3.24Å; D837-T839 PolarHBondContact OD1-N 3.19Å; D837-T839 VanDerWaalsContact OD1-N 3.09Å; D837-T839 PolarHBondContact OD1-OG1 2.94Å
838	S	83.4	Confident	79.2	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.028	28%	0.277	C	S	.	.			trans	-103.9	-8.6	-178.9	63.7	0	0	0	0	112.9	D494 R515 P840 R841 C842	D494-S838 WeakPolarHBondContact OD2-CB 3.42Å; D494-S838 PolarHBondContact OD2-OG 2.67Å; R515-S838 PolarHBondContact NH2-OG 2.65Å; S838-P840 VanDerWaalsContact C-CD 3.44Å; S838-R841 PolarHBondContact O-N 2.92Å; S838-C842 PolarHBondContact O-N 2.79Å
839	T	76.1	Confident	78.3	Confident	45 Å²	45	57.7 Å²	57.7	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-53.3	-46.5	-170.2	-42.3	0	0	0	0	113.4	D837 R841 L843	D837-T839 VanDerWaalsContact OD1-CB 3.31Å; D837-T839 WeakPolarHBondContact OD1-CB 3.24Å; D837-T839 PolarHBondContact OD1-N 3.19Å; D837-T839 VanDerWaalsContact OD1-N 3.09Å; D837-T839 PolarHBondContact OD1-OG1 2.94Å; T839-R841 PolarHBondContact O-N 3.38Å; T839-R841 VanDerWaalsContact O-N 3.14Å; T839-L843 HydrophobicContact CG2-CD1 3.72Å; T839-L843 WeakPolarHBondContact O-CD1 3.45Å; T839-L843 WeakPolarHBondContact O-CG 3.46Å
840	P	65.1	Low	77.3	Confident	76 Å²	76	60.4 Å²	60.4	49%	0.494	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-16.9	-174.2	-18.9	32.2	0	0	0	114.8	S838	S838-P840 VanDerWaalsContact C-CD 3.44Å
841	R	73.3	Confident	76.1	Confident	130 Å²	130	64.1 Å²	64.1	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-115.9	-41.9	-168.7	-62.2	-62.2	-171.3	179	-2.7	112.9	F479 E480 S838 T839 L843 K844	F479-R841 HydrophobicContact CD1-CB 4.11Å; F479-R841 HydrophobicContact CD1-CG 4.07Å; F479-R841 HydrophobicContact CE1-CB 3.76Å; F479-R841 HydrophobicContact CE1-CG 4.18Å; E480-R841 IonicContact OE1-CZ 2.83Å; E480-R841 IonicContact OE1-NE 3.63Å; E480-R841 PolarHBondContact OE1-NE 3.44Å; E480-R841 IonicContact OE1-NH2 2.83Å; S838-R841 PolarHBondContact O-N 2.92Å; T839-R841 PolarHBondContact O-N 3.38Å; T839-R841 VanDerWaalsContact O-N 3.14Å; R841-L843 VanDerWaalsContact C-N 3.33Å; R841-L843 PolarHBondContact O-N 2.57Å; R841-K844 PolarHBondContact O-N 3.5Å
842	C	76.9	Confident	74.8	Confident	7 Å²	7	68.1 Å²	68.1	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-68.2	-32.9	179.6	-63.8	0	0	0	0	112.4	C491 S838 K844 K845 L846	C491-C842 WeakPolarHBondContact CA-SG 3.3Å; C491-C842 HydrophobicContact CB-CB 3.7Å; C491-C842 WeakPolarHBondContact CB-SG 3.36Å; C491-C842 WeakPolarHBondContact SG-CA 3.34Å; C491-C842 WeakPolarHBondContact SG-CB 3.48Å; C491-C842 CovalentContact SG-SG 2.04Å; C491-C842 PolarHBondContact SG-SG 3.47Å; S838-C842 PolarHBondContact O-N 2.79Å; C842-K844 PolarHBondContact O-N 3.03Å; C842-K845 PolarHBondContact O-N 3.25Å; C842-L846 PolarHBondContact O-N 3.38Å
843	L	60.2	Low	73.4	Confident	127 Å²	127	70.1 Å²	70.1	67%	0.665	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-15.6	174.7	-71.2	171.6	0	0	0	114.4	T839 R841	T839-L843 HydrophobicContact CG2-CD1 3.72Å; T839-L843 WeakPolarHBondContact O-CD1 3.45Å; T839-L843 WeakPolarHBondContact O-CG 3.46Å; R841-L843 VanDerWaalsContact C-N 3.33Å; R841-L843 PolarHBondContact O-N 2.57Å
844	K	47.9	Very low	71.6	Confident	166 Å²	166	75.5 Å²	75.5	72%	0.722	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-13.6	177.6	-69.3	-174.3	178.6	-176.6	0	113.5	R841 C842	R841-K844 PolarHBondContact O-N 3.5Å; C842-K844 PolarHBondContact O-N 3.03Å
845	K	44.7	Very low	69.7	Low	159 Å²	159	81.3 Å²	81.3	69%	0.691	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-19.1	-175.7	-79.5	-171.6	174	-175.6	0	113.5	C842	C842-K845 PolarHBondContact O-N 3.25Å
846	L	38.6	Very low	67.6	Low	131 Å²	131	85.7 Å²	85.7	69%	0.686	42%	0.421	S	S	*	.			trans	-97.2	0	174.1	-69.3	169	0	0	0	109.3	R495 C842	R495-L846 HydrophobicContact CB-CD1 4Å; R495-L846 HydrophobicContact CG-CD1 4.39Å; R495-L846 HydrophobicContact CG-CD2 4.46Å; C842-L846 PolarHBondContact O-N 3.38Å

Retrieved 846 of 846 residues in 181.2 ms (Link to these results)

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