A0A3Q0KR52_SCHMA Loading...

Gamma-tubulin complex component AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KR52, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,039 aa.

						>A0A3Q0KR52_SCHMA|A0A3Q0KR52
MISGVPDSLRLVVHDLITKILTTNRCESYSSADSVKQFYSFGENLFTCYSKPASLSEVEAQLFSILQVDGRDIDSVKLKRLLRILHNLPSVRRKAEILEFFYQLSNHNYCRRKADIPSVSESLFRNPNSFNNGSSGFVSDLISHSSVHPKSKPPTPTVRSTIRSGDSSNSATDHLVNLWGPSAGDSYKPPLSSSSLNRRFLSQRIKNSSLPKAASRTTVSEADLLRELVFVLNGIGGNLIKYDHIQDSFRLVSTANVPVGQQDSIHRIAECGWLHNQIKQFVSRARNDRSAGTIVQSFASGLHEHLTEYYRLVATLESQLNQDKHDFSGDHHTNQSDQGTDYGRSLENIASLMHGDVGGLDSHADRTGDHQSTSSLSFFQPLTITRLVLWTQEPRLRLRFLASLCDVCRGLRGGALASAVFSYTLHGDPEVALIMRHLMSNIASSLLHFISKWIYDGHLDDPYQEFFVESDPSVKMDRLWYDKYNLRHNMIPVFITASQANKILVTGKSINFLIHVCGEKQGIKNRESIRHTRLKKVESMFEQDFDQSFDQMLSTVYKQTSQHLLETLIGRYHFLDHLRATRQFLLLGQGDFIQHLMDLLDSNLNKPCSQILLSRLSGILETAIRDTNAQYEQPEILQRLDVRLLDISTGQDTGWDIFSLDYHVDGPLSTIFTDNCRFMYLFSFNFLWRAKRMEFTLSNLWKQQLCATRLGYGLQIDLSLVLHLLQLFGAEIRHFIQQLQYYINFEVLECAWENLVKQVHSAEDLGDIIKAHQAFLSNVFTRCLLDAESRQLLGQLRAIFNSILDYAQLHQDFNTTAMHENSIREKYASELQRAERTGHWGTDRLREEQESLRRKEFVDSKLAHLQARIRIQAAAYRANLIKFIDMLSNHTDCSLRLLAEHINFNGHYCNSTLGSSCTTSGSITSGYPSIMNHHQKYQSSHHEQQQHIQSLVSTPPPLPSSSSQPTSQQEEQNKTKYSNIIILKSAQPYSGSITPSSASSSLTIGSKQTESGVSHISDVEYRKNSSASDEYREFTLHPK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	32.7	Very low	44.7	Very low	131 Å²	131	100.7 Å²	100.7	65%	0.645	59%	0.587	S	S	*	*				0	6.2	0	-71.9	-165.5	117.2	0	0	114.6	R92	M1-R92 HydrophobicContact SD-CB 4.19Å; M1-R92 HydrophobicContact SD-CG 4.35Å
2	I	37.9	Very low	45.8	Very low	98 Å²	98	99.6 Å²	99.6	50%	0.503	58%	0.582	S	S	.	*			trans	-92.2	-0.9	175	-72.8	165.3	0	0	0	112.2	G4 F46	I2-G4 VanDerWaalsContact C-N 3.33Å; I2-G4 PolarHBondContact O-N 2.91Å; I2-F46 HydrophobicContact CD1-CB 3.38Å; I2-F46 HydrophobicContact CD1-CD1 4.45Å; I2-F46 HydrophobicContact CD1-CD2 3.95Å; I2-F46 HydrophobicContact CD1-CG 3.7Å
3	S	37.8	Very low	46.9	Very low	121 Å²	121	96.4 Å²	96.4	85%	0.846	56%	0.564	S	S	*	*	S	Bend	trans	-90.2	37	176.9	61.8	0	0	0	0	113.7
4	G	39.9	Very low	48	Very low	71 Å²	71	95 Å²	95	73%	0.732	55%	0.55	S	S	*	.	S	Bend	trans	167.8	35.6	-175.6	0	0	0	0	0	117	I2	I2-G4 VanDerWaalsContact C-N 3.33Å; I2-G4 PolarHBondContact O-N 2.91Å
5	V	43.3	Very low	48.9	Very low	81 Å²	81	94.3 Å²	94.3	49%	0.491	54%	0.543	S	S	.	.	S	Bend	trans	-126.3	139.7	173.8	-178.4	0	0	0	0	107.9	L9	V5-L9 HydrophobicContact CG1-CB 4.25Å; V5-L9 HydrophobicContact CG1-CD1 3.57Å
6	P	42.6	Very low	49.6	Very low	91 Å²	91	93.1 Å²	93.1	59%	0.591	53%	0.533	S	S	*	.			trans	-66.5	156.5	-163.8	-20.4	32.8	0	0	0	114.2	S8 L9	P6-S8 PolarHBondContact O-N 2.79Å; P6-L9 PolarHBondContact O-N 3.06Å
7	D	45.8	Very low	50.3	Low	109 Å²	109	88.2 Å²	88.2	58%	0.583	51%	0.505	S	S	*	.	H	α-helix	trans	-57.1	-19.2	179.3	-64.7	-57.7	0	0	0	114	L9 R10 L11	D7-L9 PolarHBondContact O-N 2.84Å; D7-R10 WeakPolarHBondContact O-CB 3.42Å; D7-R10 PolarHBondContact O-N 3.01Å; D7-R10 VanDerWaalsContact O-N 3.16Å; D7-R10 IonicContact OD1-NH1 3.32Å; D7-L11 PolarHBondContact O-N 3.11Å
8	S	45.9	Very low	51	Low	72 Å²	72	85.9 Å²	85.9	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-55.9	-34.5	170.7	58.9	0	0	0	0	113.3	P6 L11 V12	P6-S8 PolarHBondContact O-N 2.79Å; S8-L11 PolarHBondContact O-N 3.41Å; S8-V12 VanDerWaalsContact O-CG2 3.3Å; S8-V12 WeakPolarHBondContact O-CG2 3.42Å; S8-V12 PolarHBondContact O-N 3.49Å
9	L	52.4	Low	51.4	Low	97 Å²	97	88.4 Å²	88.4	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-77.1	-30.9	179.1	-127.9	168.5	0	0	0	111.9	V5 P6 D7 V13	V5-L9 HydrophobicContact CG1-CB 4.25Å; V5-L9 HydrophobicContact CG1-CD1 3.57Å; P6-L9 PolarHBondContact O-N 3.06Å; D7-L9 PolarHBondContact O-N 2.84Å; L9-V13 HydrophobicContact CD2-CG2 4.28Å; L9-V13 WeakPolarHBondContact O-CG2 3.4Å; L9-V13 PolarHBondContact O-N 3.12Å
10	R	56	Low	51.8	Low	126 Å²	126	86.5 Å²	86.5	48%	0.475	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-44.8	169.3	-80.5	176.9	159.1	166.3	-10.5	111.3	D7 V13 H14 Y39 E43	D7-R10 WeakPolarHBondContact O-CB 3.42Å; D7-R10 PolarHBondContact O-N 3.01Å; D7-R10 VanDerWaalsContact O-N 3.16Å; D7-R10 IonicContact OD1-NH1 3.32Å; R10-V13 PolarHBondContact O-N 2.85Å; R10-H14 WeakPolarHBondContact O-CB 3.44Å; R10-H14 PolarHBondContact O-N 2.79Å; R10-Y39 PolarHBondContact NE-OH 2.62Å; R10-E43 IonicContact NH2-OE1 2.68Å
11	L	57.9	Low	52.1	Low	111 Å²	111	85.2 Å²	85.2	58%	0.581	48%	0.478	S	S	*	.	H	α-helix	trans	-59.3	-45.9	174.3	-78	161.7	0	0	0	111.6	D7 S8 V13 H14 D15	D7-L11 PolarHBondContact O-N 3.11Å; S8-L11 PolarHBondContact O-N 3.41Å; L11-V13 PolarHBondContact O-N 2.78Å; L11-H14 PolarHBondContact O-N 2.75Å; L11-D15 WeakPolarHBondContact O-CB 3.24Å; L11-D15 PolarHBondContact O-N 3.39Å
12	V	57.8	Low	53.1	Low	87 Å²	87	83.8 Å²	83.8	53%	0.527	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-40.8	177.5	169.3	0	0	0	0	112.4	S8 L16	S8-V12 VanDerWaalsContact O-CG2 3.3Å; S8-V12 WeakPolarHBondContact O-CG2 3.42Å; S8-V12 PolarHBondContact O-N 3.49Å; V12-L16 WeakPolarHBondContact O-CB 3.48Å; V12-L16 PolarHBondContact O-N 2.9Å
13	V	59.5	Low	53.9	Low	58 Å²	58	84.4 Å²	84.4	35%	0.352	49%	0.485	S	S	.	.	H	α-helix	trans	-67.6	-41.4	175.9	171.5	0	0	0	0	111.1	L9 R10 L11 L16 I17	L9-V13 HydrophobicContact CD2-CG2 4.28Å; L9-V13 WeakPolarHBondContact O-CG2 3.4Å; L9-V13 PolarHBondContact O-N 3.12Å; R10-V13 PolarHBondContact O-N 2.85Å; L11-V13 PolarHBondContact O-N 2.78Å; V13-L16 PolarHBondContact O-N 3.21Å; V13-I17 HydrophobicContact CG1-CD1 3.82Å; V13-I17 HydrophobicContact CG1-CG1 4.49Å; V13-I17 WeakPolarHBondContact O-CB 3.37Å; V13-I17 VanDerWaalsContact O-CG1 3.3Å; V13-I17 WeakPolarHBondContact O-CG1 3.37Å; V13-I17 PolarHBondContact O-N 3.04Å
14	H	61.8	Low	54.2	Low	77 Å²	77	81.9 Å²	81.9	36%	0.356	46%	0.462	S	S	.	.	H	α-helix	trans	-60.2	-51.8	174.8	-176.8	-82.2	0	0	0	111.1	R10 L11 L16 I17 T18	R10-H14 WeakPolarHBondContact O-CB 3.44Å; R10-H14 PolarHBondContact O-N 2.79Å; L11-H14 PolarHBondContact O-N 2.75Å; H14-L16 VanDerWaalsContact C-N 3.3Å; H14-L16 PolarHBondContact O-N 2.84Å; H14-I17 PolarHBondContact O-N 3.46Å; H14-T18 WeakPolarHBondContact O-CB 3.41Å; H14-T18 PolarHBondContact O-N 3Å; H14-T18 PolarHBondContact O-OG1 3.32Å
15	D	62.5	Low	54	Low	85 Å²	85	89.6 Å²	89.6	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-59.2	-37.8	176.8	-93.9	19.4	0	0	0	112.9	L11 T18 K19	L11-D15 WeakPolarHBondContact O-CB 3.24Å; L11-D15 PolarHBondContact O-N 3.39Å; D15-T18 PolarHBondContact O-N 2.82Å; D15-K19 VanDerWaalsContact O-CB 3.28Å; D15-K19 WeakPolarHBondContact O-CB 3.32Å; D15-K19 VanDerWaalsContact O-CG 3.28Å; D15-K19 WeakPolarHBondContact O-CG 3.44Å; D15-K19 PolarHBondContact O-N 3.32Å
16	L	59.8	Low	53.7	Low	74 Å²	74	90.4 Å²	90.4	39%	0.387	48%	0.477	S	S	.	.	H	α-helix	trans	-71.2	-40.3	179.2	-164.5	152.7	0	0	0	110.9	V12 V13 H14 K19 I20 F101	V12-L16 WeakPolarHBondContact O-CB 3.48Å; V12-L16 PolarHBondContact O-N 2.9Å; V13-L16 PolarHBondContact O-N 3.21Å; H14-L16 VanDerWaalsContact C-N 3.3Å; H14-L16 PolarHBondContact O-N 2.84Å; L16-K19 PolarHBondContact O-N 3.21Å; L16-I20 HydrophobicContact CD2-CD1 3.55Å; L16-I20 HydrophobicContact CD2-CG1 4.31Å; L16-I20 VanDerWaalsContact O-CG1 3.31Å; L16-I20 WeakPolarHBondContact O-CG1 3.09Å; L16-I20 PolarHBondContact O-N 3.48Å; L16-F101 HydrophobicContact CD2-CE1 4.01Å; L16-F101 HydrophobicContact CD2-CZ 4.4Å
17	I	62.2	Low	53.2	Low	10 Å²	10	94.7 Å²	94.7	5%	0.051	49%	0.489	C	S	.	.	H	α-helix	trans	-63.6	-46.3	171.2	-69.3	168.1	0	0	0	110.4	V13 H14 K19 I20 L21 F38 F100	V13-I17 HydrophobicContact CG1-CD1 3.82Å; V13-I17 HydrophobicContact CG1-CG1 4.49Å; V13-I17 WeakPolarHBondContact O-CB 3.37Å; V13-I17 VanDerWaalsContact O-CG1 3.3Å; V13-I17 WeakPolarHBondContact O-CG1 3.37Å; V13-I17 PolarHBondContact O-N 3.04Å; H14-I17 PolarHBondContact O-N 3.46Å; I17-K19 PolarHBondContact O-N 3.03Å; I17-I20 PolarHBondContact O-N 3.31Å; I17-L21 HydrophobicContact CG2-CD1 3.84Å; I17-L21 WeakPolarHBondContact O-CB 3.35Å; I17-L21 WeakPolarHBondContact O-CG 3.46Å; I17-L21 PolarHBondContact O-N 2.82Å; I17-F38 HydrophobicContact CG2-CB 4.12Å; I17-F100 HydrophobicContact CD1-CZ 4.41Å
18	T	61.3	Low	52.6	Low	47 Å²	47	93.3 Å²	93.3	29%	0.288	49%	0.488	S	S	.	.	H	α-helix	trans	-60.3	-44.5	176.9	-54.3	0	0	0	0	111.1	H14 D15 L21 T22	H14-T18 WeakPolarHBondContact O-CB 3.41Å; H14-T18 PolarHBondContact O-N 3Å; H14-T18 PolarHBondContact O-OG1 3.32Å; D15-T18 PolarHBondContact O-N 2.82Å; T18-L21 PolarHBondContact O-N 2.87Å; T18-T22 HydrophobicContact CG2-CG2 4.41Å; T18-T22 WeakPolarHBondContact O-CG2 3.34Å; T18-T22 PolarHBondContact O-N 2.85Å; T18-T22 PolarHBondContact O-OG1 3.31Å
19	K	58.7	Low	52.1	Low	133 Å²	133	99.4 Å²	99.4	58%	0.578	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-40.4	176.3	-78.1	175.6	178.9	175.1	0	112.9	D15 L16 I17 L21 T22 T23	D15-K19 VanDerWaalsContact O-CB 3.28Å; D15-K19 WeakPolarHBondContact O-CB 3.32Å; D15-K19 VanDerWaalsContact O-CG 3.28Å; D15-K19 WeakPolarHBondContact O-CG 3.44Å; D15-K19 PolarHBondContact O-N 3.32Å; L16-K19 PolarHBondContact O-N 3.21Å; I17-K19 PolarHBondContact O-N 3.03Å; K19-L21 VanDerWaalsContact C-N 3.29Å; K19-L21 PolarHBondContact O-N 3.34Å; K19-T22 WeakPolarHBondContact CA-OG1 3.45Å; K19-T22 PolarHBondContact O-N 3.3Å; K19-T22 PolarHBondContact O-OG1 2.88Å; K19-T23 WeakPolarHBondContact O-CB 3.26Å; K19-T23 PolarHBondContact O-N 3.13Å; K19-T23 PolarHBondContact O-OG1 3.42Å
20	I	59.6	Low	51.5	Low	51 Å²	51	97.9 Å²	97.9	26%	0.262	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-38.6	175.1	-72.6	173.9	0	0	0	111.1	L16 I17 N24 L104	L16-I20 HydrophobicContact CD2-CD1 3.55Å; L16-I20 HydrophobicContact CD2-CG1 4.31Å; L16-I20 VanDerWaalsContact O-CG1 3.31Å; L16-I20 WeakPolarHBondContact O-CG1 3.09Å; L16-I20 PolarHBondContact O-N 3.48Å; I17-I20 PolarHBondContact O-N 3.31Å; I20-N24 PolarHBondContact O-N 3.19Å; I20-N24 PolarHBondContact O-ND2 3.44Å; I20-L104 HydrophobicContact CD1-CD2 3.95Å; I20-L104 HydrophobicContact CG2-CD2 4.34Å
21	L	58.2	Low	51.4	Low	60 Å²	60	96.6 Å²	96.6	31%	0.314	51%	0.51	S	S	.	.	H	α-helix	trans	-72.6	-36.6	177.5	-70.8	167.4	0	0	0	113	I17 T18 K19 V35 F38	I17-L21 HydrophobicContact CG2-CD1 3.84Å; I17-L21 WeakPolarHBondContact O-CB 3.35Å; I17-L21 WeakPolarHBondContact O-CG 3.46Å; I17-L21 PolarHBondContact O-N 2.82Å; T18-L21 PolarHBondContact O-N 2.87Å; K19-L21 VanDerWaalsContact C-N 3.29Å; K19-L21 PolarHBondContact O-N 3.34Å; L21-V35 HydrophobicContact CD1-CG2 3.51Å; L21-F38 HydrophobicContact CD1-CD2 4.18Å; L21-F38 HydrophobicContact CD2-CD2 4.31Å; L21-F38 HydrophobicContact CD2-CE2 3.91Å
22	T	54.7	Low	51.1	Low	101 Å²	101	94 Å²	94	62%	0.62	50%	0.504	S	S	*	.	H	α-helix	trans	-76.9	-26.1	176.4	56.2	0	0	0	0	113.6	T18 K19	T18-T22 HydrophobicContact CG2-CG2 4.41Å; T18-T22 WeakPolarHBondContact O-CG2 3.34Å; T18-T22 PolarHBondContact O-N 2.85Å; T18-T22 PolarHBondContact O-OG1 3.31Å; K19-T22 WeakPolarHBondContact CA-OG1 3.45Å; K19-T22 PolarHBondContact O-N 3.3Å; K19-T22 PolarHBondContact O-OG1 2.88Å
23	T	53.5	Low	51.1	Low	111 Å²	111	93.7 Å²	93.7	68%	0.681	50%	0.499	S	S	*	.	H	α-helix	trans	-76.8	-28	-179.9	-50.4	0	0	0	0	112.2	K19	K19-T23 WeakPolarHBondContact O-CB 3.26Å; K19-T23 PolarHBondContact O-N 3.13Å; K19-T23 PolarHBondContact O-OG1 3.42Å
24	N	45	Very low	51	Low	67 Å²	67	92.6 Å²	92.6	36%	0.358	49%	0.494	S	S	.	.	S	Bend	trans	-91.2	109.3	172.5	-70.7	-73.5	0	0	0	109.9	I20 C26	I20-N24 PolarHBondContact O-N 3.19Å; I20-N24 PolarHBondContact O-ND2 3.44Å; N24-C26 PolarHBondContact O-N 3.2Å
25	R	36.4	Very low	51	Low	233 Å²	233	90 Å²	90	88%	0.879	48%	0.483	S	S	*	.			trans	-66.9	70.1	176.6	-66.9	-175.3	179.7	178.5	-1.3	112.9	E27	R25-E27 PolarHBondContact O-N 2.94Å
26	C	35	Very low	51	Low	99 Å²	99	92.5 Å²	92.5	67%	0.669	49%	0.49	S	S	*	.			trans	-89.1	91	166.6	-77.1	0	0	0	0	109.4	N24 S28	N24-C26 PolarHBondContact O-N 3.2Å; C26-S28 PolarHBondContact O-N 2.87Å
27	E	32.6	Very low	51	Low	180 Å²	180	95.1 Å²	95.1	84%	0.841	50%	0.5	S	S	*	.			trans	-72.3	72.9	172.7	-67.8	176.7	177	0	0	110.9	R25	R25-E27 PolarHBondContact O-N 2.94Å
28	S	34.8	Very low	50.9	Low	81 Å²	81	96.5 Å²	96.5	57%	0.566	51%	0.506	S	S	*	.	S	Bend	trans	178.9	150.5	158	34.2	0	0	0	0	110.9	C26	C26-S28 PolarHBondContact O-N 2.87Å
29	Y	34.7	Very low	50.9	Low	199 Å²	199	97.4 Å²	97.4	78%	0.78	51%	0.505	S	S	*	.	S	Bend	trans	77.4	145.5	179	-51.6	-77.1	0	0	0	116.9	S31	Y29-S31 PolarHBondContact O-N 3.39Å
30	S	40.4	Very low	50.9	Low	66 Å²	66	93.7 Å²	93.7	46%	0.462	50%	0.496	S	S	.	.			trans	-63.2	125.7	-174.2	45	0	0	0	0	111.9	A32 D33	S30-A32 PolarHBondContact O-N 3.06Å; S30-D33 PolarHBondContact OG-OD2 3.37Å
31	S	53.8	Low	50.8	Low	99 Å²	99	94.8 Å²	94.8	69%	0.692	50%	0.499	S	S	*	.	H	α-helix	trans	-62.5	-29.1	-179.4	60	0	0	0	0	113.1	Y29 V35	Y29-S31 PolarHBondContact O-N 3.39Å; S31-V35 VanDerWaalsContact O-CG2 3.24Å; S31-V35 WeakPolarHBondContact O-CG2 3.43Å; S31-V35 PolarHBondContact O-N 3.49Å
32	A	51.1	Low	50.8	Low	55 Å²	55	92.3 Å²	92.3	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-67.9	-40.4	-176.4	0	0	0	0	0	114.3	S30 K36	S30-A32 PolarHBondContact O-N 3.06Å; A32-K36 WeakPolarHBondContact O-CG 3.44Å; A32-K36 PolarHBondContact O-N 2.79Å
33	D	57.3	Low	51	Low	82 Å²	82	91.5 Å²	91.5	44%	0.439	48%	0.477	S	S	.	.	H	α-helix	trans	-79.8	-36	-175.7	-61.6	-50.2	0	0	0	111.6	S30 K36 Q37	S30-D33 PolarHBondContact OG-OD2 3.37Å; D33-K36 PolarHBondContact O-N 2.85Å; D33-Q37 WeakPolarHBondContact O-CG 3.47Å; D33-Q37 PolarHBondContact O-N 3.27Å
34	S	58.3	Low	51	Low	34 Å²	34	90.9 Å²	90.9	24%	0.238	47%	0.469	C	S	.	.	H	α-helix	trans	-60.9	-45.1	173.3	-59.1	0	0	0	0	111.2	K36 Q37 F38	S34-K36 VanDerWaalsContact C-N 3.34Å; S34-K36 PolarHBondContact O-N 3.34Å; S34-Q37 PolarHBondContact O-N 3.06Å; S34-Q37 VanDerWaalsContact O-N 3.17Å; S34-F38 WeakPolarHBondContact O-CD2 3.16Å; S34-F38 PolarHBondContact O-N 3.13Å
35	V	61.2	Low	51.3	Low	22 Å²	22	89.7 Å²	89.7	13%	0.133	46%	0.463	C	S	.	.	H	α-helix	trans	-59.7	-42.2	175.9	171.1	0	0	0	0	111.5	L21 S31 Q37 F38 Y39	L21-V35 HydrophobicContact CD1-CG2 3.51Å; S31-V35 VanDerWaalsContact O-CG2 3.24Å; S31-V35 WeakPolarHBondContact O-CG2 3.43Å; S31-V35 PolarHBondContact O-N 3.49Å; V35-Q37 PolarHBondContact O-N 3.22Å; V35-F38 PolarHBondContact O-N 2.9Å; V35-Y39 VanDerWaalsContact O-CB 3.26Å; V35-Y39 WeakPolarHBondContact O-CB 3.36Å; V35-Y39 PolarHBondContact O-N 3.13Å
36	K	61.5	Low	52.1	Low	139 Å²	139	81.4 Å²	81.4	60%	0.604	43%	0.433	S	S	*	.	H	α-helix	trans	-65	-35.8	175.5	-71.6	172.4	-177.1	169.2	0	113.1	A32 D33 S34 S40	A32-K36 WeakPolarHBondContact O-CG 3.44Å; A32-K36 PolarHBondContact O-N 2.79Å; D33-K36 PolarHBondContact O-N 2.85Å; S34-K36 VanDerWaalsContact C-N 3.34Å; S34-K36 PolarHBondContact O-N 3.34Å; K36-S40 WeakPolarHBondContact O-CB 3.27Å; K36-S40 PolarHBondContact O-N 3.3Å; K36-S40 PolarHBondContact O-OG 3.05Å
37	Q	60.1	Low	53	Low	128 Å²	128	81.2 Å²	81.2	60%	0.598	43%	0.429	S	S	*	.	H	α-helix	trans	-66.7	-45.6	174.7	-72	174.7	13.3	0	0	111.1	D33 S34 V35 Y39 S40 F41	D33-Q37 WeakPolarHBondContact O-CG 3.47Å; D33-Q37 PolarHBondContact O-N 3.27Å; S34-Q37 PolarHBondContact O-N 3.06Å; S34-Q37 VanDerWaalsContact O-N 3.17Å; V35-Q37 PolarHBondContact O-N 3.22Å; Q37-Y39 PolarHBondContact O-N 3.09Å; Q37-S40 PolarHBondContact O-N 3.05Å; Q37-S40 PolarHBondContact O-OG 2.95Å; Q37-S40 VanDerWaalsContact O-OG 3.11Å; Q37-F41 VanDerWaalsContact O-CB 3.24Å; Q37-F41 WeakPolarHBondContact O-CB 3.3Å; Q37-F41 PolarHBondContact O-N 3.05Å
38	F	60.1	Low	53.4	Low	39 Å²	39	77.3 Å²	77.3	17%	0.171	42%	0.42	C	S	.	.	H	α-helix	trans	-67.5	-34.1	176.1	-69.4	-62.7	0	0	0	112.9	I17 L21 S34 V35 G42 L104	I17-F38 HydrophobicContact CG2-CB 4.12Å; L21-F38 HydrophobicContact CD1-CD2 4.18Å; L21-F38 HydrophobicContact CD2-CD2 4.31Å; L21-F38 HydrophobicContact CD2-CE2 3.91Å; S34-F38 WeakPolarHBondContact O-CD2 3.16Å; S34-F38 PolarHBondContact O-N 3.13Å; V35-F38 PolarHBondContact O-N 2.9Å; F38-G42 PolarHBondContact O-N 3.3Å; F38-L104 HydrophobicContact CD1-CD1 4.08Å; F38-L104 HydrophobicContact CE1-CD1 4.45Å
39	Y	62	Low	53.5	Low	66 Å²	66	85 Å²	85	26%	0.259	44%	0.439	S	S	.	.	H	α-helix	trans	-69.1	-44.9	175.8	-167.2	-84.3	0	0	0	112.1	R10 V35 Q37 G42 E43	R10-Y39 PolarHBondContact NE-OH 2.62Å; V35-Y39 VanDerWaalsContact O-CB 3.26Å; V35-Y39 WeakPolarHBondContact O-CB 3.36Å; V35-Y39 PolarHBondContact O-N 3.13Å; Q37-Y39 PolarHBondContact O-N 3.09Å; Y39-G42 PolarHBondContact O-N 2.89Å; Y39-E43 HydrophobicContact CD1-CG 4.31Å; Y39-E43 VanDerWaalsContact CE1-CD 3.49Å; Y39-E43 HydrophobicContact CE1-CG 3.93Å; Y39-E43 WeakPolarHBondContact CE1-OE1 3.38Å; Y39-E43 PolarHBondContact O-N 3.43Å; Y39-E43 PolarHBondContact OH-OE1 3.03Å
40	S	58.7	Low	53.9	Low	55 Å²	55	80.8 Å²	80.8	39%	0.385	44%	0.438	S	S	.	.	H	α-helix	trans	-68.9	-33.5	175.3	57.2	0	0	0	0	112.8	K36 Q37 E43 N44	K36-S40 WeakPolarHBondContact O-CB 3.27Å; K36-S40 PolarHBondContact O-N 3.3Å; K36-S40 PolarHBondContact O-OG 3.05Å; Q37-S40 PolarHBondContact O-N 3.05Å; Q37-S40 PolarHBondContact O-OG 2.95Å; Q37-S40 VanDerWaalsContact O-OG 3.11Å; S40-E43 PolarHBondContact O-N 2.93Å; S40-N44 WeakPolarHBondContact O-CB 3.37Å; S40-N44 PolarHBondContact O-N 2.88Å; S40-N44 PolarHBondContact O-ND2 3.26Å; S40-N44 VanDerWaalsContact O-ND2 3.13Å
41	F	57.2	Low	54.1	Low	74 Å²	74	86.7 Å²	86.7	33%	0.325	46%	0.456	S	S	.	.	H	α-helix	trans	-61.3	-42.8	169.1	-174.5	-109.3	0	0	0	111.7	Q37 N44 L45 Q103	Q37-F41 VanDerWaalsContact O-CB 3.24Å; Q37-F41 WeakPolarHBondContact O-CB 3.3Å; Q37-F41 PolarHBondContact O-N 3.05Å; F41-N44 PolarHBondContact O-N 3.24Å; F41-L45 HydrophobicContact CD1-CD1 3.75Å; F41-L45 HydrophobicContact CE1-CD1 3.3Å; F41-L45 HydrophobicContact CE2-CD1 4.15Å; F41-L45 HydrophobicContact CG-CD1 4.34Å; F41-L45 HydrophobicContact CZ-CD1 3.53Å; F41-L45 WeakPolarHBondContact O-CB 3.36Å; F41-L45 PolarHBondContact O-N 3.3Å; F41-Q103 HydrophobicContact CE1-CB 4.47Å
42	G	59.6	Low	53.8	Low	8 Å²	8	87.7 Å²	87.7	8%	0.082	46%	0.46	C	S	.	.	H	α-helix	trans	-59	-50.7	171.8	0	0	0	0	0	113.2	F38 Y39 N44 L45 F46	F38-G42 PolarHBondContact O-N 3.3Å; Y39-G42 PolarHBondContact O-N 2.89Å; G42-N44 VanDerWaalsContact C-N 3.31Å; G42-N44 PolarHBondContact O-N 3.38Å; G42-L45 PolarHBondContact O-N 3.02Å; G42-F46 WeakPolarHBondContact O-CD2 3.21Å; G42-F46 PolarHBondContact O-N 3.39Å
43	E	58.1	Low	53.8	Low	85 Å²	85	87.1 Å²	87.1	40%	0.397	46%	0.455	S	S	.	.	H	α-helix	trans	-63.7	-33.9	178.9	-70	-164.5	147.2	0	0	112.8	R10 Y39 S40 T47	R10-E43 IonicContact NH2-OE1 2.68Å; Y39-E43 HydrophobicContact CD1-CG 4.31Å; Y39-E43 VanDerWaalsContact CE1-CD 3.49Å; Y39-E43 HydrophobicContact CE1-CG 3.93Å; Y39-E43 WeakPolarHBondContact CE1-OE1 3.38Å; Y39-E43 PolarHBondContact O-N 3.43Å; Y39-E43 PolarHBondContact OH-OE1 3.03Å; S40-E43 PolarHBondContact O-N 2.93Å; E43-T47 WeakPolarHBondContact O-CG2 3.38Å; E43-T47 PolarHBondContact O-N 2.92Å; E43-T47 PolarHBondContact O-OG1 3.3Å
44	N	53.4	Low	53.7	Low	98 Å²	98	85.9 Å²	85.9	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-72	-38.5	175.7	-71.6	-27.8	0	0	0	113	S40 F41 G42 T47 C48	S40-N44 WeakPolarHBondContact O-CB 3.37Å; S40-N44 PolarHBondContact O-N 2.88Å; S40-N44 PolarHBondContact O-ND2 3.26Å; S40-N44 VanDerWaalsContact O-ND2 3.13Å; F41-N44 PolarHBondContact O-N 3.24Å; G42-N44 VanDerWaalsContact C-N 3.31Å; G42-N44 PolarHBondContact O-N 3.38Å; N44-T47 WeakPolarHBondContact CA-OG1 3.47Å; N44-T47 PolarHBondContact O-N 3.31Å; N44-T47 PolarHBondContact O-OG1 3.04Å; N44-T47 VanDerWaalsContact O-OG1 3.07Å; N44-C48 PolarHBondContact O-N 3.03Å; N44-C48 VanDerWaalsContact O-N 3.09Å
45	L	52.1	Low	53.9	Low	42 Å²	42	86.7 Å²	86.7	22%	0.22	45%	0.454	C	S	.	.	H	α-helix	trans	-64.4	-40.5	175.5	-99	154.5	0	0	0	112.5	F41 G42 T47 F100	F41-L45 HydrophobicContact CD1-CD1 3.75Å; F41-L45 HydrophobicContact CE1-CD1 3.3Å; F41-L45 HydrophobicContact CE2-CD1 4.15Å; F41-L45 HydrophobicContact CG-CD1 4.34Å; F41-L45 HydrophobicContact CZ-CD1 3.53Å; F41-L45 WeakPolarHBondContact O-CB 3.36Å; F41-L45 PolarHBondContact O-N 3.3Å; G42-L45 PolarHBondContact O-N 3.02Å; L45-T47 PolarHBondContact O-N 3.13Å; L45-F100 HydrophobicContact CD1-CD2 4.17Å
46	F	52.7	Low	54.1	Low	59 Å²	59	89.8 Å²	89.8	26%	0.259	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-3	179.6	-62.2	-57	0	0	0	115	I2 G42 R93 E96	I2-F46 HydrophobicContact CD1-CB 3.38Å; I2-F46 HydrophobicContact CD1-CD1 4.45Å; I2-F46 HydrophobicContact CD1-CD2 3.95Å; I2-F46 HydrophobicContact CD1-CG 3.7Å; G42-F46 WeakPolarHBondContact O-CD2 3.21Å; G42-F46 PolarHBondContact O-N 3.39Å; F46-R93 PolarHBondContact O-NH1 3.43Å; F46-E96 HydrophobicContact CE1-CB 4.37Å
47	T	54.1	Low	54.3	Low	95 Å²	95	88.3 Å²	88.3	58%	0.583	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-23.2	178.6	48.6	0	0	0	0	113.8	E43 N44 L45 Y49	E43-T47 WeakPolarHBondContact O-CG2 3.38Å; E43-T47 PolarHBondContact O-N 2.92Å; E43-T47 PolarHBondContact O-OG1 3.3Å; N44-T47 WeakPolarHBondContact CA-OG1 3.47Å; N44-T47 PolarHBondContact O-N 3.31Å; N44-T47 PolarHBondContact O-OG1 3.04Å; N44-T47 VanDerWaalsContact O-OG1 3.07Å; L45-T47 PolarHBondContact O-N 3.13Å; T47-Y49 PolarHBondContact O-N 2.55Å
48	C	40	Very low	54.4	Low	97 Å²	97	82.6 Å²	82.6	66%	0.655	45%	0.446	S	S	*	.			trans	-77	105.3	174.8	-79.7	0	0	0	0	112.8	N44 S50	N44-C48 PolarHBondContact O-N 3.03Å; N44-C48 VanDerWaalsContact O-N 3.09Å; C48-S50 PolarHBondContact O-N 3.06Å
49	Y	36.9	Very low	54.8	Low	244 Å²	244	82.5 Å²	82.5	96%	0.957	45%	0.446	S	S	*	.			trans	-71.1	89.8	167.5	-82.2	-94.6	0	0	0	111.3	T47	T47-Y49 PolarHBondContact O-N 2.55Å
50	S	42.9	Very low	55.1	Low	110 Å²	110	82 Å²	82	77%	0.769	46%	0.456	S	S	*	.			trans	-110	161.1	157	-165.2	0	0	0	0	109.9	C48	C48-S50 PolarHBondContact O-N 3.06Å
51	K	44.9	Very low	55.5	Low	189 Å²	189	83.4 Å²	83.4	82%	0.822	46%	0.456	S	S	*	.			trans	-57.9	137.3	-170.2	-69.8	177.5	178.9	176	0	111.5	A53	K51-A53 PolarHBondContact O-N 3.16Å; K51-A53 VanDerWaalsContact O-N 3.1Å
52	P	47.6	Very low	56	Low	121 Å²	121	80.8 Å²	80.8	79%	0.786	45%	0.445	S	S	*	.			trans	-65.4	114.2	175.9	27.7	-33.5	0	0	0	109.8
53	A	50.5	Low	56.6	Low	42 Å²	42	83 Å²	83	35%	0.347	45%	0.453	S	S	.	.			trans	-59.6	144.7	165.9	0	0	0	0	0	109.3	K51 L55 V58	K51-A53 PolarHBondContact O-N 3.16Å; K51-A53 VanDerWaalsContact O-N 3.1Å; A53-L55 PolarHBondContact O-N 2.94Å; A53-V58 HydrophobicContact CB-CG2 4.1Å
54	S	55.9	Low	57.1	Low	56 Å²	56	81.6 Å²	81.6	39%	0.392	45%	0.453	S	S	.	.			trans	-69	139.5	-177.9	75.2	0	0	0	0	109.8	S56 E57 V58	S54-S56 PolarHBondContact O-N 2.96Å; S54-S56 VanDerWaalsContact O-N 3.07Å; S54-E57 VanDerWaalsContact CB-OE2 3.31Å; S54-E57 WeakPolarHBondContact CB-OE2 3.46Å; S54-E57 PolarHBondContact N-OE2 3.01Å; S54-E57 PolarHBondContact O-N 2.87Å; S54-E57 VanDerWaalsContact OG-CG 3.26Å; S54-E57 WeakPolarHBondContact OG-CG 3.49Å; S54-E57 PolarHBondContact OG-OE2 3.38Å; S54-V58 PolarHBondContact O-N 3.09Å
55	L	63.6	Low	57.6	Low	51 Å²	51	78.8 Å²	78.8	27%	0.267	44%	0.437	S	S	.	.	H	α-helix	trans	-54.4	-34.8	-176.5	-166.5	79.3	0	0	0	112	A53 V58 E59 H86 K94 A95 L98	A53-L55 PolarHBondContact O-N 2.94Å; L55-V58 PolarHBondContact O-N 2.81Å; L55-E59 WeakPolarHBondContact O-CB 3.42Å; L55-E59 WeakPolarHBondContact O-CG 3.44Å; L55-E59 PolarHBondContact O-N 3.39Å; L55-H86 WeakPolarHBondContact CD2-CE1 3.44Å; L55-K94 HydrophobicContact CD1-CB 4.35Å; L55-A95 HydrophobicContact CD1-CB 4.22Å; L55-L98 HydrophobicContact CD1-CD1 3.81Å
56	S	64.6	Low	58.2	Low	88 Å²	88	78 Å²	78	62%	0.615	43%	0.433	S	S	*	.	H	α-helix	trans	-69.4	-29.5	179.1	-164.4	0	0	0	0	113.8	S54 A60	S54-S56 PolarHBondContact O-N 2.96Å; S54-S56 VanDerWaalsContact O-N 3.07Å; S56-A60 VanDerWaalsContact O-CB 3.22Å; S56-A60 WeakPolarHBondContact O-CB 3.5Å; S56-A60 PolarHBondContact O-N 3.46Å
57	E	64.4	Low	59	Low	108 Å²	108	82.3 Å²	82.3	51%	0.505	45%	0.454	S	S	.	.	H	α-helix	trans	-72	-43.6	175.1	-73.7	162.3	134.3	0	0	110.7	S54 A60 Q61	S54-E57 VanDerWaalsContact CB-OE2 3.31Å; S54-E57 WeakPolarHBondContact CB-OE2 3.46Å; S54-E57 PolarHBondContact N-OE2 3.01Å; S54-E57 PolarHBondContact O-N 2.87Å; S54-E57 VanDerWaalsContact OG-CG 3.26Å; S54-E57 WeakPolarHBondContact OG-CG 3.49Å; S54-E57 PolarHBondContact OG-OE2 3.38Å; E57-A60 PolarHBondContact O-N 2.84Å; E57-Q61 WeakPolarHBondContact O-CB 3.5Å; E57-Q61 VanDerWaalsContact O-CG 3.28Å; E57-Q61 WeakPolarHBondContact O-CG 3.46Å; E57-Q61 PolarHBondContact O-N 3.25Å
58	V	62.6	Low	59.6	Low	7 Å²	7	83.5 Å²	83.5	4%	0.042	46%	0.461	C	S	.	.	H	α-helix	trans	-68	-40.1	178.2	-174.6	0	0	0	0	111	A53 S54 L55 Q61 L62 L98	A53-V58 HydrophobicContact CB-CG2 4.1Å; S54-V58 PolarHBondContact O-N 3.09Å; L55-V58 PolarHBondContact O-N 2.81Å; V58-Q61 PolarHBondContact O-N 3.36Å; V58-L62 HydrophobicContact CG1-CD1 4.21Å; V58-L62 WeakPolarHBondContact O-CB 3.36Å; V58-L62 WeakPolarHBondContact O-CG 3.43Å; V58-L62 PolarHBondContact O-N 2.94Å; V58-L98 HydrophobicContact CG1-CB 3.91Å
59	E	68.1	Low	60.5	Low	38 Å²	38	81 Å²	81	18%	0.178	44%	0.441	C	S	.	.	H	α-helix	trans	-60.2	-47.9	171	-75.4	-178	-167.5	0	0	111.2	L55 Q61 L62 F63 L82 H86	L55-E59 WeakPolarHBondContact O-CB 3.42Å; L55-E59 WeakPolarHBondContact O-CG 3.44Å; L55-E59 PolarHBondContact O-N 3.39Å; E59-Q61 PolarHBondContact O-N 3.25Å; E59-L62 PolarHBondContact O-N 3.16Å; E59-F63 HydrophobicContact CB-CE2 4.43Å; E59-F63 WeakPolarHBondContact O-CD2 3.13Å; E59-F63 PolarHBondContact O-N 2.71Å; E59-L82 HydrophobicContact CG-CD1 4.04Å; E59-L82 HydrophobicContact CG-CD2 4.12Å; E59-H86 IonicContact OE1-CD2 3.75Å; E59-H86 IonicContact OE1-CE1 3.18Å; E59-H86 IonicContact OE1-NE2 2.88Å; E59-H86 PolarHBondContact OE1-NE2 2.7Å
60	A	69.4	Low	61.4	Low	56 Å²	56	71.6 Å²	71.6	46%	0.463	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-39.5	178.2	0	0	0	0	0	112.9	S56 E57 F63 S64	S56-A60 VanDerWaalsContact O-CB 3.22Å; S56-A60 WeakPolarHBondContact O-CB 3.5Å; S56-A60 PolarHBondContact O-N 3.46Å; E57-A60 PolarHBondContact O-N 2.84Å; A60-F63 PolarHBondContact O-N 3.49Å; A60-S64 WeakPolarHBondContact O-CB 3.49Å; A60-S64 PolarHBondContact O-N 2.68Å
61	Q	65.9	Low	62.7	Low	84 Å²	84	71.8 Å²	71.8	39%	0.393	40%	0.402	S	S	.	.	H	α-helix	trans	-67.7	-40.7	176.4	-73	174.2	10.1	0	0	112.4	E57 V58 E59 S64 I65 Y102	E57-Q61 WeakPolarHBondContact O-CB 3.5Å; E57-Q61 VanDerWaalsContact O-CG 3.28Å; E57-Q61 WeakPolarHBondContact O-CG 3.46Å; E57-Q61 PolarHBondContact O-N 3.25Å; V58-Q61 PolarHBondContact O-N 3.36Å; E59-Q61 PolarHBondContact O-N 3.25Å; Q61-S64 WeakPolarHBondContact CA-OG 3.49Å; Q61-S64 PolarHBondContact O-N 2.86Å; Q61-S64 PolarHBondContact O-OG 3.19Å; Q61-I65 WeakPolarHBondContact O-CG1 3.36Å; Q61-I65 PolarHBondContact O-N 3.45Å; Q61-Y102 HydrophobicContact CB-CD2 4.42Å; Q61-Y102 HydrophobicContact CB-CE2 3.82Å
62	L	67.8	Low	63.9	Low	19 Å²	19	67.3 Å²	67.3	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-64	-42.2	173.7	-76.3	167.3	0	0	0	111.7	V58 E59 L66 L78 L98 Y102	V58-L62 HydrophobicContact CG1-CD1 4.21Å; V58-L62 WeakPolarHBondContact O-CB 3.36Å; V58-L62 WeakPolarHBondContact O-CG 3.43Å; V58-L62 PolarHBondContact O-N 2.94Å; E59-L62 PolarHBondContact O-N 3.16Å; L62-L66 WeakPolarHBondContact O-CG 3.48Å; L62-L66 PolarHBondContact O-N 3.21Å; L62-L66 VanDerWaalsContact O-N 3.15Å; L62-L78 HydrophobicContact CB-CD2 4.09Å; L62-L98 HydrophobicContact CD1-CD2 4.3Å; L62-Y102 HydrophobicContact CD2-CD2 4.05Å; L62-Y102 HydrophobicContact CG-CD2 4.25Å
63	F	72.6	Confident	64.9	Low	54 Å²	54	67.7 Å²	67.7	24%	0.237	38%	0.381	C	S	.	.	H	α-helix	trans	-64.7	-39.4	173.2	-75.9	-61.4	0	0	0	112	E59 A60 I65 L66 Q67 L78 K79 L82	E59-F63 HydrophobicContact CB-CE2 4.43Å; E59-F63 WeakPolarHBondContact O-CD2 3.13Å; E59-F63 PolarHBondContact O-N 2.71Å; A60-F63 PolarHBondContact O-N 3.49Å; F63-I65 PolarHBondContact O-N 3.36Å; F63-L66 PolarHBondContact O-N 2.84Å; F63-Q67 VanDerWaalsContact O-CB 3.26Å; F63-Q67 WeakPolarHBondContact O-CB 3.03Å; F63-Q67 PolarHBondContact O-N 2.92Å; F63-L78 HydrophobicContact CD1-CD2 4.27Å; F63-L78 HydrophobicContact CE1-CD2 3.95Å; F63-L78 HydrophobicContact CZ-CD2 4.08Å; F63-K79 HydrophobicContact CE1-CB 4.15Å; F63-K79 HydrophobicContact CZ-CB 3.92Å; F63-K79 HydrophobicContact CZ-CD 4.46Å; F63-K79 HydrophobicContact CZ-CG 4.23Å; F63-L82 HydrophobicContact CE2-CD1 3.97Å; F63-L82 HydrophobicContact CZ-CD1 3.91Å
64	S	68.7	Low	65.9	Low	56 Å²	56	68.1 Å²	68.1	39%	0.392	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-39.3	178.3	69.9	0	0	0	0	112.7	A60 Q61 Q67 V68	A60-S64 WeakPolarHBondContact O-CB 3.49Å; A60-S64 PolarHBondContact O-N 2.68Å; Q61-S64 WeakPolarHBondContact CA-OG 3.49Å; Q61-S64 PolarHBondContact O-N 2.86Å; Q61-S64 PolarHBondContact O-OG 3.19Å; S64-Q67 PolarHBondContact O-N 3.41Å; S64-V68 WeakPolarHBondContact O-CB 3.47Å; S64-V68 VanDerWaalsContact O-CG2 3.26Å; S64-V68 WeakPolarHBondContact O-CG2 3.39Å; S64-V68 PolarHBondContact O-N 2.92Å
65	I	65	Low	66.6	Low	38 Å²	38	66.8 Å²	66.8	20%	0.195	37%	0.368	C	S	.	.	H	α-helix	trans	-65.8	-45.8	176.2	-67.9	174.7	0	0	0	110.5	Q61 F63 Q67 V68 D69 Y102	Q61-I65 WeakPolarHBondContact O-CG1 3.36Å; Q61-I65 PolarHBondContact O-N 3.45Å; F63-I65 PolarHBondContact O-N 3.36Å; I65-Q67 VanDerWaalsContact C-N 3.29Å; I65-Q67 PolarHBondContact O-N 3.47Å; I65-V68 PolarHBondContact O-N 2.98Å; I65-D69 WeakPolarHBondContact O-CB 3.49Å; I65-D69 PolarHBondContact O-N 3.47Å; I65-Y102 HydrophobicContact CD1-CD2 4.18Å; I65-Y102 HydrophobicContact CD1-CE2 3.54Å
66	L	64.9	Low	67.1	Low	25 Å²	25	69 Å²	69	13%	0.131	38%	0.384	C	S	.	.	H	α-helix	trans	-64.8	-32.2	178.6	-70.2	172.4	0	0	0	113.2	L62 F63 G70 R71 D74 L78	L62-L66 WeakPolarHBondContact O-CG 3.48Å; L62-L66 PolarHBondContact O-N 3.21Å; L62-L66 VanDerWaalsContact O-N 3.15Å; F63-L66 PolarHBondContact O-N 2.84Å; L66-G70 PolarHBondContact O-N 3.19Å; L66-R71 PolarHBondContact O-N 3.46Å; L66-D74 HydrophobicContact CD2-CB 4.34Å; L66-L78 HydrophobicContact CD1-CB 4.1Å; L66-L78 HydrophobicContact CD1-CD1 4.47Å; L66-L78 HydrophobicContact CD1-CD2 3.8Å; L66-L78 HydrophobicContact CD1-CG 4.33Å
67	Q	67.8	Low	67.5	Low	150 Å²	150	70.1 Å²	70.1	70%	0.701	38%	0.377	S	S	*	.	H	α-helix	trans	-75.4	-36.3	176.2	-168.4	172	8.7	0	0	112.1	F63 S64 I65 D69 G70	F63-Q67 VanDerWaalsContact O-CB 3.26Å; F63-Q67 WeakPolarHBondContact O-CB 3.03Å; F63-Q67 PolarHBondContact O-N 2.92Å; S64-Q67 PolarHBondContact O-N 3.41Å; I65-Q67 VanDerWaalsContact C-N 3.29Å; I65-Q67 PolarHBondContact O-N 3.47Å; Q67-D69 VanDerWaalsContact C-N 3.31Å; Q67-G70 PolarHBondContact O-N 3.26Å
68	V	67.5	Low	67.8	Low	120 Å²	120	66.9 Å²	66.9	73%	0.727	36%	0.363	S	S	*	.	H	α-helix	trans	-65.8	-34.7	170.6	167.9	0	0	0	0	111.5	S64 I65 G70	S64-V68 WeakPolarHBondContact O-CB 3.47Å; S64-V68 VanDerWaalsContact O-CG2 3.26Å; S64-V68 WeakPolarHBondContact O-CG2 3.39Å; S64-V68 PolarHBondContact O-N 2.92Å; I65-V68 PolarHBondContact O-N 2.98Å; V68-G70 VanDerWaalsContact C-N 3.26Å; V68-G70 PolarHBondContact O-N 3.4Å
69	D	59.7	Low	68.4	Low	46 Å²	46	72.4 Å²	72.4	25%	0.246	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-8.4	174.7	-97.2	3.8	0	0	0	114.5	I65 Q67 R71 Y109	I65-D69 WeakPolarHBondContact O-CB 3.49Å; I65-D69 PolarHBondContact O-N 3.47Å; Q67-D69 VanDerWaalsContact C-N 3.31Å; D69-R71 HydrophobicContact CB-CB 4.39Å; D69-R71 HydrophobicContact CB-CG 4.18Å; D69-R71 PolarHBondContact O-N 3.12Å; D69-R71 IonicContact OD2-CZ 3.8Å; D69-R71 IonicContact OD2-NE 2.72Å; D69-R71 PolarHBondContact OD2-NE 3.18Å; D69-R71 VanDerWaalsContact OD2-NE 3.16Å; D69-R71 IonicContact OD2-NH2 3.66Å; D69-R71 PolarHBondContact OD2-NH2 2.83Å; D69-Y109 PolarHBondContact OD1-OH 3.41Å
70	G	56	Low	68.9	Low	46 Å²	46	79.1 Å²	79.1	47%	0.474	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	21.6	-174.5	0	0	0	0	0	114.3	L66 Q67 V68 D72	L66-G70 PolarHBondContact O-N 3.19Å; Q67-G70 PolarHBondContact O-N 3.26Å; V68-G70 VanDerWaalsContact C-N 3.26Å; V68-G70 PolarHBondContact O-N 3.4Å; G70-D72 PolarHBondContact O-N 3.06Å
71	R	69	Low	69.1	Low	114 Å²	114	81.7 Å²	81.7	43%	0.43	42%	0.416	S	S	.	.			trans	-95.7	58.8	-176.2	-71.8	-165.3	-79.7	162.9	-10.3	112	L66 D69 I73 D74 S75	L66-R71 PolarHBondContact O-N 3.46Å; D69-R71 HydrophobicContact CB-CB 4.39Å; D69-R71 HydrophobicContact CB-CG 4.18Å; D69-R71 PolarHBondContact O-N 3.12Å; D69-R71 IonicContact OD2-CZ 3.8Å; D69-R71 IonicContact OD2-NE 2.72Å; D69-R71 PolarHBondContact OD2-NE 3.18Å; D69-R71 VanDerWaalsContact OD2-NE 3.16Å; D69-R71 IonicContact OD2-NH2 3.66Å; D69-R71 PolarHBondContact OD2-NH2 2.83Å; R71-I73 VanDerWaalsContact C-N 3.26Å; R71-I73 PolarHBondContact O-N 3.45Å; R71-D74 HydrophobicContact CB-CB 4.28Å; R71-D74 IonicContact NH1-OD2 3.19Å; R71-D74 PolarHBondContact O-N 3.44Å; R71-S75 PolarHBondContact O-N 3.24Å
72	D	69.5	Low	69.4	Low	95 Å²	95	78.1 Å²	78.1	51%	0.508	40%	0.4	S	S	.	.	H	α-helix	trans	-54.9	-39.1	-176.4	-60	-35.3	0	0	0	112.9	G70 D74 S75 V76	G70-D72 PolarHBondContact O-N 3.06Å; D72-D74 VanDerWaalsContact C-N 3.33Å; D72-D74 PolarHBondContact O-N 2.68Å; D72-S75 WeakPolarHBondContact O-CB 3.32Å; D72-S75 PolarHBondContact O-N 2.97Å; D72-S75 VanDerWaalsContact O-N 3.14Å; D72-S75 PolarHBondContact O-OG 2.96Å; D72-V76 PolarHBondContact O-N 3.28Å; D72-V76 VanDerWaalsContact O-N 3.1Å
73	I	70.6	Confident	69.6	Low	128 Å²	128	84.6 Å²	84.6	66%	0.656	42%	0.423	S	S	*	.	H	α-helix	trans	-61.5	-41.9	178	-58.1	170.3	0	0	0	111	R71 S75 V76 K77	R71-I73 VanDerWaalsContact C-N 3.26Å; R71-I73 PolarHBondContact O-N 3.45Å; I73-S75 VanDerWaalsContact C-N 3.32Å; I73-V76 PolarHBondContact O-N 3.1Å; I73-K77 WeakPolarHBondContact O-CG 3.08Å; I73-K77 PolarHBondContact O-N 3.09Å
74	D	70.9	Confident	69.7	Low	51 Å²	51	86 Å²	86	27%	0.273	43%	0.431	S	S	.	.	H	α-helix	trans	-74	-27	178.3	-66.9	-23.3	0	0	0	111.2	L66 R71 D72 V76 K77 L78	L66-D74 HydrophobicContact CD2-CB 4.34Å; R71-D74 HydrophobicContact CB-CB 4.28Å; R71-D74 IonicContact NH1-OD2 3.19Å; R71-D74 PolarHBondContact O-N 3.44Å; D72-D74 VanDerWaalsContact C-N 3.33Å; D72-D74 PolarHBondContact O-N 2.68Å; D74-V76 VanDerWaalsContact C-N 3.35Å; D74-K77 PolarHBondContact O-N 3.37Å; D74-K77 IonicContact OD1-NZ 3.85Å; D74-K77 PolarHBondContact OD1-NZ 3.4Å; D74-L78 VanDerWaalsContact O-CB 3.26Å; D74-L78 WeakPolarHBondContact O-CB 3.39Å; D74-L78 PolarHBondContact O-N 2.91Å
75	S	69.6	Low	69.7	Low	28 Å²	28	85.2 Å²	85.2	20%	0.196	42%	0.423	C	S	.	.	H	α-helix	trans	-62.8	-39	168.4	90.8	0	0	0	0	112.3	R71 D72 I73 L78 K79	R71-S75 PolarHBondContact O-N 3.24Å; D72-S75 WeakPolarHBondContact O-CB 3.32Å; D72-S75 PolarHBondContact O-N 2.97Å; D72-S75 VanDerWaalsContact O-N 3.14Å; D72-S75 PolarHBondContact O-OG 2.96Å; I73-S75 VanDerWaalsContact C-N 3.32Å; S75-L78 PolarHBondContact O-N 3.44Å; S75-K79 VanDerWaalsContact O-CB 3.3Å; S75-K79 WeakPolarHBondContact O-CB 3.47Å; S75-K79 PolarHBondContact O-N 3.22Å
76	V	73.8	Confident	69.8	Low	98 Å²	98	87.5 Å²	87.5	59%	0.594	43%	0.433	S	S	*	.	H	α-helix	trans	-70.5	-41.8	176.7	177.5	0	0	0	0	110.9	D72 I73 D74 K79 R80	D72-V76 PolarHBondContact O-N 3.28Å; D72-V76 VanDerWaalsContact O-N 3.1Å; I73-V76 PolarHBondContact O-N 3.1Å; D74-V76 VanDerWaalsContact C-N 3.35Å; V76-K79 PolarHBondContact O-N 3.09Å; V76-R80 PolarHBondContact O-N 3.29Å
77	K	73	Confident	70.1	Confident	112 Å²	112	92.8 Å²	92.8	49%	0.487	46%	0.461	S	S	.	.	H	α-helix	trans	-59.5	-47.5	171.3	-67.3	173.9	-165.1	153	0	111	I73 D74 K79 R80 L81	I73-K77 WeakPolarHBondContact O-CG 3.08Å; I73-K77 PolarHBondContact O-N 3.09Å; D74-K77 PolarHBondContact O-N 3.37Å; D74-K77 IonicContact OD1-NZ 3.85Å; D74-K77 PolarHBondContact OD1-NZ 3.4Å; K77-K79 PolarHBondContact O-N 3.45Å; K77-R80 WeakPolarHBondContact O-CB 3.33Å; K77-R80 PolarHBondContact O-N 3.48Å; K77-R80 VanDerWaalsContact O-N 3.14Å; K77-L81 WeakPolarHBondContact O-CB 3.45Å; K77-L81 WeakPolarHBondContact O-CG 3.47Å; K77-L81 PolarHBondContact O-N 3.43Å
78	L	71.8	Confident	70.1	Confident	40 Å²	40	89.3 Å²	89.3	21%	0.209	45%	0.447	C	S	.	.	H	α-helix	trans	-58.5	-46.3	176.3	-167.4	91.8	0	0	0	110.5	L62 F63 L66 D74 S75 R80 L81 L82	L62-L78 HydrophobicContact CB-CD2 4.09Å; F63-L78 HydrophobicContact CD1-CD2 4.27Å; F63-L78 HydrophobicContact CE1-CD2 3.95Å; F63-L78 HydrophobicContact CZ-CD2 4.08Å; L66-L78 HydrophobicContact CD1-CB 4.1Å; L66-L78 HydrophobicContact CD1-CD1 4.47Å; L66-L78 HydrophobicContact CD1-CD2 3.8Å; L66-L78 HydrophobicContact CD1-CG 4.33Å; D74-L78 VanDerWaalsContact O-CB 3.26Å; D74-L78 WeakPolarHBondContact O-CB 3.39Å; D74-L78 PolarHBondContact O-N 2.91Å; S75-L78 PolarHBondContact O-N 3.44Å; L78-R80 VanDerWaalsContact C-N 3.27Å; L78-R80 PolarHBondContact O-N 2.87Å; L78-L81 PolarHBondContact O-N 3.17Å; L78-L82 HydrophobicContact CD2-CD1 3.73Å; L78-L82 HydrophobicContact CG-CD1 3.85Å; L78-L82 HydrophobicContact CG-CG 4.25Å; L78-L82 VanDerWaalsContact O-CB 3.27Å; L78-L82 WeakPolarHBondContact O-CB 3.46Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 2.72Å
79	K	74.9	Confident	69.6	Low	123 Å²	123	89.4 Å²	89.4	54%	0.535	45%	0.45	S	S	.	.	H	α-helix	trans	-65.9	-24.9	177.9	-167.1	167.7	-175	173	0	113.6	F63 S75 V76 K77 R83	F63-K79 HydrophobicContact CE1-CB 4.15Å; F63-K79 HydrophobicContact CZ-CB 3.92Å; F63-K79 HydrophobicContact CZ-CD 4.46Å; F63-K79 HydrophobicContact CZ-CG 4.23Å; S75-K79 VanDerWaalsContact O-CB 3.3Å; S75-K79 WeakPolarHBondContact O-CB 3.47Å; S75-K79 PolarHBondContact O-N 3.22Å; V76-K79 PolarHBondContact O-N 3.09Å; K77-K79 PolarHBondContact O-N 3.45Å; K79-R83 PolarHBondContact O-N 3.44Å; K79-R83 PolarHBondContact O-NE 2.96Å
80	R	78.2	Confident	69.4	Low	178 Å²	178	92 Å²	92	67%	0.672	47%	0.472	S	S	*	.	H	α-helix	trans	-78	-45.5	170	-175.6	177.3	179	172.7	0.2	111.2	V76 K77 L78 R83 I84	V76-R80 PolarHBondContact O-N 3.29Å; K77-R80 WeakPolarHBondContact O-CB 3.33Å; K77-R80 PolarHBondContact O-N 3.48Å; K77-R80 VanDerWaalsContact O-N 3.14Å; L78-R80 VanDerWaalsContact C-N 3.27Å; L78-R80 PolarHBondContact O-N 2.87Å; R80-R83 PolarHBondContact O-N 3.12Å; R80-I84 HydrophobicContact CG-CD1 4.18Å; R80-I84 WeakPolarHBondContact O-CG1 3.42Å; R80-I84 PolarHBondContact O-N 3.02Å
81	L	74.1	Confident	69.6	Low	110 Å²	110	91.8 Å²	91.8	58%	0.576	46%	0.461	S	S	*	.	H	α-helix	trans	-66.3	-39.1	178.6	-70.3	170.3	0	0	0	112.2	K77 L78 I84 L85	K77-L81 WeakPolarHBondContact O-CB 3.45Å; K77-L81 WeakPolarHBondContact O-CG 3.47Å; K77-L81 PolarHBondContact O-N 3.43Å; L78-L81 PolarHBondContact O-N 3.17Å; L81-I84 PolarHBondContact O-N 3.19Å; L81-L85 WeakPolarHBondContact O-CB 3.27Å; L81-L85 PolarHBondContact O-N 3.2Å
82	L	71.9	Confident	69	Low	10 Å²	10	96.2 Å²	96.2	5%	0.052	48%	0.478	C	S	.	.	H	α-helix	trans	-62.1	-45.1	170.8	-77.7	167.8	0	0	0	110.8	E59 F63 L78 I84 L85 H86 L98	E59-L82 HydrophobicContact CG-CD1 4.04Å; E59-L82 HydrophobicContact CG-CD2 4.12Å; F63-L82 HydrophobicContact CE2-CD1 3.97Å; F63-L82 HydrophobicContact CZ-CD1 3.91Å; L78-L82 HydrophobicContact CD2-CD1 3.73Å; L78-L82 HydrophobicContact CG-CD1 3.85Å; L78-L82 HydrophobicContact CG-CG 4.25Å; L78-L82 VanDerWaalsContact O-CB 3.27Å; L78-L82 WeakPolarHBondContact O-CB 3.46Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 2.72Å; L82-I84 VanDerWaalsContact C-N 3.3Å; L82-I84 PolarHBondContact O-N 2.97Å; L82-L85 CarbonylContact O-C 3.37Å; L82-L85 PolarHBondContact O-N 3.39Å; L82-L85 VanDerWaalsContact O-N 3.17Å; L82-H86 WeakPolarHBondContact O-CB 3.16Å; L82-H86 PolarHBondContact O-CD2 3.17Å; L82-H86 PolarHBondContact O-N 3.31Å; L82-L98 HydrophobicContact CD2-CD1 3.72Å; L82-L98 HydrophobicContact CD2-CD2 3.82Å; L82-L98 HydrophobicContact CD2-CG 4.45Å
83	R	72.2	Confident	68.7	Low	155 Å²	155	94.7 Å²	94.7	59%	0.585	47%	0.465	S	S	*	.	H	α-helix	trans	-59.5	-39.4	173	-92	-176.3	-77.4	176.3	-7.1	112.7	K79 R80 N87	K79-R83 PolarHBondContact O-N 3.44Å; K79-R83 PolarHBondContact O-NE 2.96Å; R80-R83 PolarHBondContact O-N 3.12Å; R83-N87 WeakPolarHBondContact O-CB 3.23Å; R83-N87 PolarHBondContact O-N 3.32Å; R83-N87 PolarHBondContact O-OD1 3.21Å
84	I	75.3	Confident	68.4	Low	82 Å²	82	90.6 Å²	90.6	42%	0.421	44%	0.442	S	S	.	.	H	α-helix	trans	-64.9	-47	173.6	-67.3	162.5	0	0	0	110.2	R80 L81 L82 H86 N87 L88	R80-I84 HydrophobicContact CG-CD1 4.18Å; R80-I84 WeakPolarHBondContact O-CG1 3.42Å; R80-I84 PolarHBondContact O-N 3.02Å; L81-I84 PolarHBondContact O-N 3.19Å; L82-I84 VanDerWaalsContact C-N 3.3Å; L82-I84 PolarHBondContact O-N 2.97Å; I84-H86 VanDerWaalsContact C-N 3.34Å; I84-H86 PolarHBondContact O-N 3.12Å; I84-N87 CarbonylContact O-C 3.58Å; I84-N87 PolarHBondContact O-N 3.5Å; I84-N87 VanDerWaalsContact O-N 3.07Å; I84-L88 HydrophobicContact CG2-CD1 3.73Å; I84-L88 WeakPolarHBondContact O-CD1 3.43Å; I84-L88 PolarHBondContact O-N 3.44Å
85	L	68.1	Low	68.1	Low	41 Å²	41	89.4 Å²	89.4	22%	0.215	44%	0.44	C	S	.	.	H	α-helix	trans	-61.8	-39	178.5	-171.6	68.9	0	0	0	112.3	L81 L82 L88 K94 L98	L81-L85 WeakPolarHBondContact O-CB 3.27Å; L81-L85 PolarHBondContact O-N 3.2Å; L82-L85 CarbonylContact O-C 3.37Å; L82-L85 PolarHBondContact O-N 3.39Å; L82-L85 VanDerWaalsContact O-N 3.17Å; L85-L88 PolarHBondContact O-N 2.89Å; L85-K94 HydrophobicContact CG-CD 4.48Å; L85-K94 VanDerWaalsContact O-CE 3.29Å; L85-K94 WeakPolarHBondContact O-CE 3.47Å; L85-K94 PolarHBondContact O-NZ 2.92Å; L85-L98 HydrophobicContact CD2-CD1 4.27Å; L85-L98 HydrophobicContact CD2-CD2 4.03Å; L85-L98 HydrophobicContact CD2-CG 4.13Å
86	H	67.2	Low	67.7	Low	86 Å²	86	91.4 Å²	91.4	40%	0.398	45%	0.446	S	S	.	.	H	α-helix	trans	-59.3	-46.8	170.3	-90.7	-80.5	0	0	0	111.1	L55 E59 L82 I84 L88 K94	L55-H86 WeakPolarHBondContact CD2-CE1 3.44Å; E59-H86 IonicContact OE1-CD2 3.75Å; E59-H86 IonicContact OE1-CE1 3.18Å; E59-H86 IonicContact OE1-NE2 2.88Å; E59-H86 PolarHBondContact OE1-NE2 2.7Å; L82-H86 WeakPolarHBondContact O-CB 3.16Å; L82-H86 PolarHBondContact O-CD2 3.17Å; L82-H86 PolarHBondContact O-N 3.31Å; I84-H86 VanDerWaalsContact C-N 3.34Å; I84-H86 PolarHBondContact O-N 3.12Å; H86-L88 VanDerWaalsContact C-N 3.34Å; H86-L88 PolarHBondContact O-N 3.46Å; H86-K94 PolarHBondContact O-NZ 3.49Å
87	N	70.4	Confident	67.4	Low	135 Å²	135	89.2 Å²	89.2	72%	0.722	43%	0.43	S	S	*	.	H	α-helix	trans	-72.5	-15.7	-178.4	-70.8	-3	0	0	0	115.1	R83 I84 P89	R83-N87 WeakPolarHBondContact O-CB 3.23Å; R83-N87 PolarHBondContact O-N 3.32Å; R83-N87 PolarHBondContact O-OD1 3.21Å; I84-N87 CarbonylContact O-C 3.58Å; I84-N87 PolarHBondContact O-N 3.5Å; I84-N87 VanDerWaalsContact O-N 3.07Å; N87-P89 VanDerWaalsContact O-CD 3.29Å; N87-P89 WeakPolarHBondContact O-CD 3.31Å
88	L	68.4	Low	67	Low	77 Å²	77	84.5 Å²	84.5	40%	0.403	41%	0.41	S	S	.	.			trans	-77.1	115.9	172.1	-91.4	82.4	0	0	0	111	I84 L85 H86 S90 K94	I84-L88 HydrophobicContact CG2-CD1 3.73Å; I84-L88 WeakPolarHBondContact O-CD1 3.43Å; I84-L88 PolarHBondContact O-N 3.44Å; L85-L88 PolarHBondContact O-N 2.89Å; H86-L88 VanDerWaalsContact C-N 3.34Å; H86-L88 PolarHBondContact O-N 3.46Å; L88-S90 VanDerWaalsContact C-N 3.29Å; L88-S90 PolarHBondContact O-N 3.02Å; L88-K94 WeakPolarHBondContact O-CE 3.28Å; L88-K94 PolarHBondContact O-NZ 3.27Å
89	P	56.4	Low	66.6	Low	122 Å²	122	85.7 Å²	85.7	79%	0.792	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-16.1	-179.4	31	-35.8	0	0	0	113.6	N87 V91	N87-P89 VanDerWaalsContact O-CD 3.29Å; N87-P89 WeakPolarHBondContact O-CD 3.31Å; P89-V91 PolarHBondContact O-N 3.13Å
90	S	57.1	Low	66.2	Low	101 Å²	101	80.6 Å²	80.6	71%	0.706	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-18.3	-166.9	-35.7	0	0	0	0	115.1	L88	L88-S90 VanDerWaalsContact C-N 3.29Å; L88-S90 PolarHBondContact O-N 3.02Å
91	V	59.2	Low	65.7	Low	42 Å²	42	76 Å²	76	26%	0.255	38%	0.378	S	S	.	.			trans	-101.7	97.9	-170.6	-175.8	0	0	0	0	109.9	P89 R93 K94 I97	P89-V91 PolarHBondContact O-N 3.13Å; V91-R93 VanDerWaalsContact C-N 3.26Å; V91-R93 PolarHBondContact O-N 3.38Å; V91-K94 HydrophobicContact CB-CG 4.17Å; V91-K94 HydrophobicContact CG1-CG 3.98Å; V91-K94 VanDerWaalsContact O-CE 3.23Å; V91-K94 WeakPolarHBondContact O-CE 3.48Å; V91-K94 VanDerWaalsContact O-CG 3.26Å; V91-K94 WeakPolarHBondContact O-CG 3.3Å; V91-I97 HydrophobicContact CG1-CD1 3.55Å
92	R	56.4	Low	65.3	Low	207 Å²	207	73.1 Å²	73.1	78%	0.781	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.5	178.9	-66.7	-164.6	-173.4	170.7	0.2	114.5	M1	M1-R92 HydrophobicContact SD-CB 4.19Å; M1-R92 HydrophobicContact SD-CG 4.35Å
93	R	62.5	Low	64.9	Low	63 Å²	63	75.2 Å²	75.2	24%	0.238	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	50.4	-172.7	-50.3	-153.5	-124.4	175.2	6.2	113.3	F46 V91 A95 E96 I97	F46-R93 PolarHBondContact O-NH1 3.43Å; V91-R93 VanDerWaalsContact C-N 3.26Å; V91-R93 PolarHBondContact O-N 3.38Å; R93-A95 VanDerWaalsContact C-N 3.31Å; R93-A95 PolarHBondContact O-N 3.38Å; R93-E96 HydrophobicContact CB-CB 4.31Å; R93-E96 WeakPolarHBondContact CD-OE1 3.48Å; R93-E96 WeakPolarHBondContact CD-OE2 3.45Å; R93-E96 IonicContact CZ-OE2 3.02Å; R93-E96 IonicContact NE-OE2 2.61Å; R93-E96 IonicContact NH1-OE1 3.91Å; R93-E96 IonicContact NH1-OE2 2.73Å; R93-E96 PolarHBondContact NH1-OE2 3.38Å; R93-E96 PolarHBondContact O-N 3.29Å; R93-I97 WeakPolarHBondContact O-CG1 3.4Å; R93-I97 PolarHBondContact O-N 2.92Å
94	K	65.9	Low	64.5	Low	42 Å²	42	68.6 Å²	68.6	18%	0.183	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-37.9	-176.6	-54.9	-174.2	-175.5	-173	0	112.5	L55 L85 H86 L88 V91 I97 L98	L55-K94 HydrophobicContact CD1-CB 4.35Å; L85-K94 HydrophobicContact CG-CD 4.48Å; L85-K94 VanDerWaalsContact O-CE 3.29Å; L85-K94 WeakPolarHBondContact O-CE 3.47Å; L85-K94 PolarHBondContact O-NZ 2.92Å; H86-K94 PolarHBondContact O-NZ 3.49Å; L88-K94 WeakPolarHBondContact O-CE 3.28Å; L88-K94 PolarHBondContact O-NZ 3.27Å; V91-K94 HydrophobicContact CB-CG 4.17Å; V91-K94 HydrophobicContact CG1-CG 3.98Å; V91-K94 VanDerWaalsContact O-CE 3.23Å; V91-K94 WeakPolarHBondContact O-CE 3.48Å; V91-K94 VanDerWaalsContact O-CG 3.26Å; V91-K94 WeakPolarHBondContact O-CG 3.3Å; K94-I97 PolarHBondContact O-N 3.38Å; K94-L98 WeakPolarHBondContact O-CG 3.3Å; K94-L98 PolarHBondContact O-N 3.24Å; K94-L98 VanDerWaalsContact O-N 3.1Å
95	A	62.8	Low	64.1	Low	26 Å²	26	66.7 Å²	66.7	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-50.8	178	0	0	0	0	0	112.4	L55 R93 I97 L98 E99	L55-A95 HydrophobicContact CD1-CB 4.22Å; R93-A95 VanDerWaalsContact C-N 3.31Å; R93-A95 PolarHBondContact O-N 3.38Å; A95-I97 PolarHBondContact O-N 2.9Å; A95-L98 PolarHBondContact O-N 3.46Å; A95-L98 VanDerWaalsContact O-N 3.1Å; A95-E99 WeakPolarHBondContact O-CB 3.46Å; A95-E99 PolarHBondContact O-N 3.35Å
96	E	62.7	Low	63.8	Low	69 Å²	69	67.2 Å²	67.2	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-58.5	-34.7	178.7	-68.3	169.3	-128.1	0	0	112.7	F46 R93 F100	F46-E96 HydrophobicContact CE1-CB 4.37Å; R93-E96 HydrophobicContact CB-CB 4.31Å; R93-E96 WeakPolarHBondContact CD-OE1 3.48Å; R93-E96 WeakPolarHBondContact CD-OE2 3.45Å; R93-E96 IonicContact CZ-OE2 3.02Å; R93-E96 IonicContact NE-OE2 2.61Å; R93-E96 IonicContact NH1-OE1 3.91Å; R93-E96 IonicContact NH1-OE2 2.73Å; R93-E96 PolarHBondContact NH1-OE2 3.38Å; R93-E96 PolarHBondContact O-N 3.29Å; E96-F100 WeakPolarHBondContact O-CB 3.47Å; E96-F100 PolarHBondContact O-N 2.92Å
97	I	65.8	Low	63.1	Low	52 Å²	52	68 Å²	68	27%	0.267	35%	0.345	S	S	.	.	H	α-helix	trans	-71.7	-42	176.8	-66.4	165.7	0	0	0	111.2	V91 R93 K94 A95 F100 F101	V91-I97 HydrophobicContact CG1-CD1 3.55Å; R93-I97 WeakPolarHBondContact O-CG1 3.4Å; R93-I97 PolarHBondContact O-N 2.92Å; K94-I97 PolarHBondContact O-N 3.38Å; A95-I97 PolarHBondContact O-N 2.9Å; I97-F100 PolarHBondContact O-N 3.48Å; I97-F101 HydrophobicContact CG2-CD2 3.89Å; I97-F101 HydrophobicContact CG2-CE2 3.57Å; I97-F101 WeakPolarHBondContact O-CD2 3.1Å; I97-F101 PolarHBondContact O-N 2.89Å
98	L	66.2	Low	62.2	Low	13 Å²	13	64.6 Å²	64.6	7%	0.068	33%	0.327	C	S	.	.	H	α-helix	trans	-68.9	-36.3	175.8	-70.1	174	0	0	0	111.9	L55 V58 L62 L82 L85 K94 A95 F101 Y102	L55-L98 HydrophobicContact CD1-CD1 3.81Å; V58-L98 HydrophobicContact CG1-CB 3.91Å; L62-L98 HydrophobicContact CD1-CD2 4.3Å; L82-L98 HydrophobicContact CD2-CD1 3.72Å; L82-L98 HydrophobicContact CD2-CD2 3.82Å; L82-L98 HydrophobicContact CD2-CG 4.45Å; L85-L98 HydrophobicContact CD2-CD1 4.27Å; L85-L98 HydrophobicContact CD2-CD2 4.03Å; L85-L98 HydrophobicContact CD2-CG 4.13Å; K94-L98 WeakPolarHBondContact O-CG 3.3Å; K94-L98 PolarHBondContact O-N 3.24Å; K94-L98 VanDerWaalsContact O-N 3.1Å; A95-L98 PolarHBondContact O-N 3.46Å; A95-L98 VanDerWaalsContact O-N 3.1Å; L98-F101 PolarHBondContact O-N 3.22Å; L98-Y102 VanDerWaalsContact O-CB 3.29Å; L98-Y102 WeakPolarHBondContact O-CB 3.25Å; L98-Y102 PolarHBondContact O-N 3.35Å
99	E	63.5	Low	61	Low	66 Å²	66	65.2 Å²	65.2	31%	0.308	33%	0.325	S	S	.	.	H	α-helix	trans	-65.3	-42.3	173.1	-174.7	173.5	-172.7	0	0	111.4	A95 F101 Y102 Q103	A95-E99 WeakPolarHBondContact O-CB 3.46Å; A95-E99 PolarHBondContact O-N 3.35Å; E99-F101 PolarHBondContact O-N 3.15Å; E99-Y102 PolarHBondContact O-N 3.12Å; E99-Q103 HydrophobicContact CG-CG 4.4Å; E99-Q103 WeakPolarHBondContact O-CB 3.38Å; E99-Q103 WeakPolarHBondContact O-CG 3.49Å; E99-Q103 PolarHBondContact O-N 3.22Å; E99-Q103 PolarHBondContact OE1-NE2 3.19Å; E99-Q103 VanDerWaalsContact OE1-NE2 3.12Å
100	F	65	Low	60.1	Low	16 Å²	16	64 Å²	64	7%	0.07	32%	0.318	C	S	.	.	H	α-helix	trans	-56.9	-47.8	171.8	174.8	-97.8	0	0	0	111.7	I17 L45 E96 I97 Q103 L104	I17-F100 HydrophobicContact CD1-CZ 4.41Å; L45-F100 HydrophobicContact CD1-CD2 4.17Å; E96-F100 WeakPolarHBondContact O-CB 3.47Å; E96-F100 PolarHBondContact O-N 2.92Å; I97-F100 PolarHBondContact O-N 3.48Å; F100-Q103 PolarHBondContact O-N 3.46Å; F100-L104 HydrophobicContact CE1-CD1 4.41Å; F100-L104 HydrophobicContact CE2-CD1 4.49Å; F100-L104 HydrophobicContact CZ-CD1 4.04Å; F100-L104 WeakPolarHBondContact O-CB 3.31Å; F100-L104 PolarHBondContact O-N 2.96Å
101	F	67.4	Low	59.4	Low	80 Å²	80	67.8 Å²	67.8	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-37.2	176.4	-73.8	-57.8	0	0	0	113.2	L16 I97 L98 E99 L104 S105	L16-F101 HydrophobicContact CD2-CE1 4.01Å; L16-F101 HydrophobicContact CD2-CZ 4.4Å; I97-F101 HydrophobicContact CG2-CD2 3.89Å; I97-F101 HydrophobicContact CG2-CE2 3.57Å; I97-F101 WeakPolarHBondContact O-CD2 3.1Å; I97-F101 PolarHBondContact O-N 2.89Å; L98-F101 PolarHBondContact O-N 3.22Å; E99-F101 PolarHBondContact O-N 3.15Å; F101-L104 PolarHBondContact O-N 3.15Å; F101-S105 WeakPolarHBondContact O-CB 3.24Å; F101-S105 PolarHBondContact O-N 3.12Å
102	Y	67.2	Low	58.5	Low	50 Å²	50	74.6 Å²	74.6	20%	0.196	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-49.5	174.6	174.8	-99	0	0	0	111.1	Q61 L62 I65 L98 E99 L104 S105 N106	Q61-Y102 HydrophobicContact CB-CD2 4.42Å; Q61-Y102 HydrophobicContact CB-CE2 3.82Å; L62-Y102 HydrophobicContact CD2-CD2 4.05Å; L62-Y102 HydrophobicContact CG-CD2 4.25Å; I65-Y102 HydrophobicContact CD1-CD2 4.18Å; I65-Y102 HydrophobicContact CD1-CE2 3.54Å; L98-Y102 VanDerWaalsContact O-CB 3.29Å; L98-Y102 WeakPolarHBondContact O-CB 3.25Å; L98-Y102 PolarHBondContact O-N 3.35Å; E99-Y102 PolarHBondContact O-N 3.12Å; Y102-L104 PolarHBondContact O-N 3.17Å; Y102-S105 WeakPolarHBondContact O-CB 3.25Å; Y102-S105 PolarHBondContact O-N 3.4Å; Y102-S105 VanDerWaalsContact O-N 3.1Å; Y102-S105 PolarHBondContact O-OG 3.14Å; Y102-N106 WeakPolarHBondContact CE1-ND2 3.44Å; Y102-N106 PolarHBondContact O-N 3.19Å; Y102-N106 PolarHBondContact OH-ND2 2.89Å
103	Q	63.8	Low	57.5	Low	55 Å²	55	72.9 Å²	72.9	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-38.5	177.1	-66.7	-174.4	21.5	0	0	111.9	F41 E99 F100 S105 N106 H107	F41-Q103 HydrophobicContact CE1-CB 4.47Å; E99-Q103 HydrophobicContact CG-CG 4.4Å; E99-Q103 WeakPolarHBondContact O-CB 3.38Å; E99-Q103 WeakPolarHBondContact O-CG 3.49Å; E99-Q103 PolarHBondContact O-N 3.22Å; E99-Q103 PolarHBondContact OE1-NE2 3.19Å; E99-Q103 VanDerWaalsContact OE1-NE2 3.12Å; F100-Q103 PolarHBondContact O-N 3.46Å; Q103-S105 VanDerWaalsContact C-N 3.28Å; Q103-S105 PolarHBondContact O-N 2.95Å; Q103-N106 PolarHBondContact O-N 2.87Å; Q103-H107 WeakPolarHBondContact O-CB 3.3Å; Q103-H107 PolarHBondContact O-N 3.01Å
104	L	63.9	Low	56.2	Low	16 Å²	16	73.4 Å²	73.4	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-36.8	172.1	-149.3	92.2	0	0	0	111.7	I20 F38 F100 F101 Y102 N108	I20-L104 HydrophobicContact CD1-CD2 3.95Å; I20-L104 HydrophobicContact CG2-CD2 4.34Å; F38-L104 HydrophobicContact CD1-CD1 4.08Å; F38-L104 HydrophobicContact CE1-CD1 4.45Å; F100-L104 HydrophobicContact CE1-CD1 4.41Å; F100-L104 HydrophobicContact CE2-CD1 4.49Å; F100-L104 HydrophobicContact CZ-CD1 4.04Å; F100-L104 WeakPolarHBondContact O-CB 3.31Å; F100-L104 PolarHBondContact O-N 2.96Å; F101-L104 PolarHBondContact O-N 3.15Å; Y102-L104 PolarHBondContact O-N 3.17Å; L104-N108 PolarHBondContact O-N 2.7Å; L104-N108 PolarHBondContact O-ND2 3.37Å
105	S	65.7	Low	54.5	Low	41 Å²	41	79 Å²	79	29%	0.287	39%	0.386	S	S	.	.	H	α-helix	trans	-68.7	-46	176.5	80.6	0	0	0	0	111.9	F101 Y102 Q103 H107 N108 Y109	F101-S105 WeakPolarHBondContact O-CB 3.24Å; F101-S105 PolarHBondContact O-N 3.12Å; Y102-S105 WeakPolarHBondContact O-CB 3.25Å; Y102-S105 PolarHBondContact O-N 3.4Å; Y102-S105 VanDerWaalsContact O-N 3.1Å; Y102-S105 PolarHBondContact O-OG 3.14Å; Q103-S105 VanDerWaalsContact C-N 3.28Å; Q103-S105 PolarHBondContact O-N 2.95Å; S105-H107 PolarHBondContact O-N 2.86Å; S105-N108 PolarHBondContact O-N 2.88Å; S105-Y109 PolarHBondContact O-N 2.94Å
106	N	61.1	Low	53	Low	52 Å²	52	84.9 Å²	84.9	28%	0.278	41%	0.412	S	S	.	.	H	α-helix	trans	-62.7	-40.1	177.4	-80.5	-10.5	0	0	0	112.4	Y102 Q103 N108 Y109 C110	Y102-N106 WeakPolarHBondContact CE1-ND2 3.44Å; Y102-N106 PolarHBondContact O-N 3.19Å; Y102-N106 PolarHBondContact OH-ND2 2.89Å; Q103-N106 PolarHBondContact O-N 2.87Å; N106-N108 VanDerWaalsContact C-N 3.26Å; N106-N108 PolarHBondContact O-N 3.42Å; N106-Y109 WeakPolarHBondContact O-CA 3.41Å; N106-Y109 WeakPolarHBondContact O-CB 3.36Å; N106-Y109 PolarHBondContact O-N 2.92Å; N106-C110 PolarHBondContact O-N 3.47Å
107	H	54	Low	51.4	Low	102 Å²	102	87.1 Å²	87.1	47%	0.472	43%	0.433	S	S	.	.	H	α-helix	trans	-66.1	-28.6	179.2	-156.4	-53.3	0	0	0	112.8	Q103 S105	Q103-H107 WeakPolarHBondContact O-CB 3.3Å; Q103-H107 PolarHBondContact O-N 3.01Å; S105-H107 PolarHBondContact O-N 2.86Å
108	N	51.7	Low	49.6	Very low	64 Å²	64	90 Å²	90	34%	0.342	46%	0.458	S	S	.	.	H	α-helix	trans	-78	-30.8	169.7	-75.3	-61.2	0	0	0	112.3	L104 S105 N106	L104-N108 PolarHBondContact O-N 2.7Å; L104-N108 PolarHBondContact O-ND2 3.37Å; S105-N108 PolarHBondContact O-N 2.88Å; N106-N108 VanDerWaalsContact C-N 3.26Å; N106-N108 PolarHBondContact O-N 3.42Å
109	Y	42.9	Very low	47.9	Very low	90 Å²	90	95.3 Å²	95.3	35%	0.353	49%	0.49	S	S	.	.	H	α-helix	trans	-71.7	-41.6	-179.4	-138.4	-81.8	0	0	0	112.6	D69 S105 N106 R111 R112	D69-Y109 PolarHBondContact OD1-OH 3.41Å; S105-Y109 PolarHBondContact O-N 2.94Å; N106-Y109 WeakPolarHBondContact O-CA 3.41Å; N106-Y109 WeakPolarHBondContact O-CB 3.36Å; N106-Y109 PolarHBondContact O-N 2.92Å; Y109-R111 VanDerWaalsContact C-N 3.31Å; Y109-R111 PolarHBondContact O-N 3.09Å; Y109-R112 PolarHBondContact O-N 3.28Å
110	C	37.7	Very low	46.3	Very low	96 Å²	96	96.9 Å²	96.9	65%	0.649	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-32	177.1	-68	0	0	0	0	113.3	N106 R112	N106-C110 PolarHBondContact O-N 3.47Å; C110-R112 VanDerWaalsContact C-N 3.33Å; C110-R112 PolarHBondContact O-N 2.92Å
111	R	41.3	Very low	44.6	Very low	181 Å²	181	105.5 Å²	105.5	68%	0.683	55%	0.549	S	S	*	.	H	α-helix	trans	-69.7	-23.2	177.5	-93.7	-168.2	-179.1	-168.9	3	114.4	Y109	Y109-R111 VanDerWaalsContact C-N 3.31Å; Y109-R111 PolarHBondContact O-N 3.09Å
112	R	40.2	Very low	42.7	Very low	185 Å²	185	106.7 Å²	106.7	70%	0.698	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-3.9	-176.9	-67.3	-172.9	-171.9	176.5	1.6	115	Y109 C110	Y109-R112 PolarHBondContact O-N 3.28Å; C110-R112 VanDerWaalsContact C-N 3.33Å; C110-R112 PolarHBondContact O-N 2.92Å
113	K	36.5	Very low	40.8	Very low	171 Å²	171	111.8 Å²	111.8	74%	0.743	60%	0.598	S	S	*	*	S	Bend	trans	-122.3	7.4	179.4	-83.1	-173.1	172.7	-177.9	0	114.1	D115	K113-D115 VanDerWaalsContact C-N 3.28Å; K113-D115 PolarHBondContact O-N 3.46Å; K113-D115 VanDerWaalsContact O-N 3.13Å
114	A	34.9	Very low	39.3	Very low	74 Å²	74	119.1 Å²	119.1	61%	0.612	63%	0.629	S	S	*	*			trans	-88	44.1	-172.4	0	0	0	0	0	114.3
115	D	30.5	Very low	37.8	Very low	159 Å²	159	129.8 Å²	129.8	85%	0.85	67%	0.668	S	S	*	*			trans	-111.3	42.5	171.9	-84	-36.6	0	0	0	112	K113	K113-D115 VanDerWaalsContact C-N 3.28Å; K113-D115 PolarHBondContact O-N 3.46Å; K113-D115 VanDerWaalsContact O-N 3.13Å
116	I	30.6	Very low	36.3	Very low	150 Å²	150	134.8 Å²	134.8	77%	0.769	69%	0.691	S	S	*	*	S	Bend	trans	-144.6	126	155.7	-73.1	101.7	0	0	0	107.1
117	P	29.2	Very low	34.7	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	72%	0.716	S	S	*	*			trans	-91.6	133.3	-175.4	33.8	-33.3	0	0	0	113.3
118	S	27.6	Very low	33.7	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	74%	0.736	S	S	*	*				158.6	160.5	129.9	54	0	0	0	0	113.5
119	V	31.2	Very low	32.8	Very low	124 Å²	124	143.9 Å²	143.9	75%	0.752	76%	0.76	S	S	*	*			trans	87.3	86.8	169.2	-165.9	0	0	0	0	117.6
120	S	30.9	Very low	32.2	Very low	100 Å²	100	148.5 Å²	148.5	70%	0.699	78%	0.782	S	S	*	*			trans	60.4	104.5	145	63.6	0	0	0	0	121.9
121	E	27.8	Very low	32	Very low	197 Å²	197	150.1 Å²	150.1	92%	0.921	78%	0.784	S	S	*	*			trans	-65.3	143.5	139.3	-59.9	171.1	118.4	0	0	110.3
122	S	28.2	Very low	31.5	Very low	105 Å²	105	148.9 Å²	148.9	73%	0.734	79%	0.791	S	S	*	*			trans	174.1	65.4	148.9	42.2	0	0	0	0	114.4
123	L	27.2	Very low	31.1	Very low	157 Å²	157	143.1 Å²	143.1	82%	0.822	79%	0.79	S	S	*	*			trans	-136.6	155.8	156.3	-74.7	178	0	0	0	109.5
124	F	31.9	Very low	30.9	Very low	209 Å²	209	140 Å²	140	92%	0.917	79%	0.79	S	S	*	*			trans	77.9	69.1	-177.2	-47.7	-69.1	0	0	0	117.3
125	R	32.4	Very low	30.8	Very low	239 Å²	239	142.3 Å²	142.3	90%	0.902	80%	0.801	S	S	*	*			trans	-128.7	117.6	149.4	-155.4	179.1	-157	-160.6	6.5	111.2
126	N	33.6	Very low	30.8	Very low	146 Å²	146	138 Å²	138	78%	0.781	79%	0.794	S	S	*	*			trans	33.5	116.7	166.8	-71.5	2.2	0	0	0	120.4	N128	N126-N128 PolarHBondContact O-N 3.25Å
127	P	29.1	Very low	30.8	Very low	122 Å²	122	139.9 Å²	139.9	79%	0.792	80%	0.797	S	S	*	*			trans	-78.4	117.8	156.9	32.6	-28.7	0	0	0	110.1
128	N	31.5	Very low	30.7	Very low	168 Å²	168	139.2 Å²	139.2	90%	0.898	79%	0.791	S	S	*	*			trans	179	84	151.9	-95.7	-18.2	0	0	0	110.7	N126	N126-N128 PolarHBondContact O-N 3.25Å
129	S	33.5	Very low	30.7	Very low	119 Å²	119	138.4 Å²	138.4	83%	0.832	79%	0.785	S	S	*	*			trans	-179.8	142.2	132.6	-167.4	0	0	0	0	111.2
130	F	30.9	Very low	30.5	Very low	187 Å²	187	139.2 Å²	139.2	82%	0.82	79%	0.785	S	S	*	*			trans	-55.9	157.8	-171.6	-73.3	-99.2	0	0	0	119
131	N	32.7	Very low	30.4	Very low	130 Å²	130	140.7 Å²	140.7	70%	0.695	78%	0.784	S	S	*	*			trans	89	113.1	145.6	-77	-1	0	0	0	121.8
132	N	31.6	Very low	30.4	Very low	155 Å²	155	137.4 Å²	137.4	83%	0.829	77%	0.772	S	S	*	*			trans	71.8	131.8	135.9	-64.9	-8.7	0	0	0	120.4
133	G	31.1	Very low	30.3	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	77%	0.766	S	S	*	*			trans	126.4	64.3	141.5	0	0	0	0	0	117.1
134	S	33.5	Very low	30.5	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	77%	0.766	S	S	*	*			trans	40.1	120.5	140.9	57	0	0	0	0	121
135	S	32.9	Very low	30.4	Very low	121 Å²	121	132.7 Å²	132.7	85%	0.846	76%	0.758	S	S	*	*			trans	67.3	140.3	135	67.1	0	0	0	0	120.9
136	G	30.5	Very low	30.3	Very low	69 Å²	69	126.1 Å²	126.1	71%	0.711	75%	0.748	S	S	*	*			trans	126.8	73.4	135	0	0	0	0	0	117.7
137	F	30.5	Very low	30.3	Very low	189 Å²	189	125.5 Å²	125.5	83%	0.829	75%	0.75	S	S	*	*			trans	59.3	104.2	130.4	-148.9	-99.7	0	0	0	120.5
138	V	26.3	Very low	30.6	Very low	103 Å²	103	127.7 Å²	127.7	62%	0.624	75%	0.749	S	S	*	*				45.7	118	129	-170.7	0	0	0	0	119.4
139	S	26.6	Very low	30.9	Very low	96 Å²	96	125.1 Å²	125.1	67%	0.671	74%	0.741	S	S	*	*			trans	55	120.2	152.5	-55	0	0	0	0	119.1
140	D	27.7	Very low	30.6	Very low	140 Å²	140	129.4 Å²	129.4	75%	0.749	75%	0.745	S	S	*	*				-177.4	148.1	102.8	-97.3	-13.4	0	0	0	115.1
141	L	28.3	Very low	30.9	Very low	131 Å²	131	125.6 Å²	125.6	69%	0.686	74%	0.742	S	S	*	*			trans	60.7	130	141.7	-85.8	57.4	0	0	0	123.4
142	I	29.2	Very low	30.9	Very low	129 Å²	129	129.4 Å²	129.4	66%	0.662	75%	0.752	S	S	*	*				72.6	99.1	126.2	-64.5	175.1	0	0	0	119.4
143	S	25.8	Very low	31.3	Very low	87 Å²	87	127.4 Å²	127.4	61%	0.608	75%	0.748	S	S	*	*				33.1	166.1	122.7	64.1	0	0	0	0	124.1
144	H	30.1	Very low	31.5	Very low	178 Å²	178	130.1 Å²	130.1	82%	0.824	75%	0.753	S	S	*	*			trans	83.6	136.1	-178.5	-45.4	-69.3	0	0	0	113.1
145	S	30.6	Very low	31.3	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	76%	0.755	S	S	*	*			cis	-149.1	147.8	8.4	65.2	0	0	0	0	110.3
146	S	29.6	Very low	31.5	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	75%	0.75	S	S	*	*				64.4	136.3	108.3	-148.1	0	0	0	0	114.8
147	V	34.6	Very low	31.5	Very low	133 Å²	133	133.6 Å²	133.6	81%	0.806	75%	0.753	S	S	*	*			cis	-148.5	151.6	47.2	180	0	0	0	0	113.1
148	H	35.4	Very low	31.7	Very low	168 Å²	168	131.1 Å²	131.1	78%	0.778	75%	0.754	S	S	*	*			trans	-65.7	-172.8	172	-83.8	-65.5	0	0	0	114.5
149	P	36.6	Very low	31.9	Very low	114 Å²	114	136.7 Å²	136.7	74%	0.74	76%	0.764	S	S	*	*			cis	-135.7	167.9	9.1	36.2	-15.1	0	0	0	118.5
150	K	28.7	Very low	32.3	Very low	210 Å²	210	137.3 Å²	137.3	91%	0.913	77%	0.767	S	S	*	*			trans	-113.3	140.3	155.7	-78.3	-178	175.2	177.8	0	109
151	S	36.9	Very low	32.6	Very low	107 Å²	107	136 Å²	136	75%	0.748	77%	0.765	S	S	*	*			trans	-147.4	99.2	172.2	58	0	0	0	0	113.8
152	K	33.1	Very low	32.8	Very low	210 Å²	210	136.6 Å²	136.6	91%	0.913	77%	0.767	S	S	*	*			trans	53.5	163.4	132.9	-82.1	-173.3	174.1	-179.7	0	121.3
153	P	38.7	Very low	32.8	Very low	113 Å²	113	140.7 Å²	140.7	73%	0.734	77%	0.774	S	S	*	*			trans	-107.2	-172.2	-143.9	48	-41.9	0	0	0	113
154	P	36	Very low	33	Very low	121 Å²	121	142.3 Å²	142.3	79%	0.786	79%	0.785	S	S	*	*				-149.7	170.5	71.7	39.8	-19.3	0	0	0	117.4
155	T	30.3	Very low	32.9	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	78%	0.776	S	S	*	*			trans	-69.5	151.9	158.7	48.2	0	0	0	0	111.4
156	P	37	Very low	32.7	Very low	112 Å²	112	139.6 Å²	139.6	73%	0.727	78%	0.783	S	S	*	*				-147.6	142.3	92.6	34.9	-16.3	0	0	0	117
157	T	29	Very low	32.7	Very low	129 Å²	129	140 Å²	140	79%	0.791	79%	0.786	S	S	*	*				47.2	114.9	120	-41.8	0	0	0	0	120.9
158	V	35	Very low	32.6	Very low	137 Å²	137	139 Å²	139	83%	0.83	79%	0.785	S	S	*	*				170.4	133.9	124.2	154.2	0	0	0	0	105.5
159	R	30.1	Very low	32.4	Very low	221 Å²	221	138.9 Å²	138.9	83%	0.834	79%	0.79	S	S	*	*			cis	179.1	150	-14.7	-179.8	177.5	-172.7	169.5	2.6	103.3
160	S	36.2	Very low	32.1	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	79%	0.788	S	S	*	*			trans	72.7	143.9	172.4	76.7	0	0	0	0	117
161	T	33.9	Very low	32.1	Very low	112 Å²	112	132.3 Å²	132.3	69%	0.687	78%	0.778	S	S	*	*			cis	-164.7	122.8	-16.6	-92.9	0	0	0	0	106.3
162	I	32.2	Very low	31.8	Very low	145 Å²	145	133.3 Å²	133.3	74%	0.744	78%	0.78	S	S	*	*				35.4	135.2	122.2	-65.7	162.5	0	0	0	116.1
163	R	28.9	Very low	31.6	Very low	215 Å²	215	130.7 Å²	130.7	81%	0.811	78%	0.776	S	S	*	*			cis	-177.4	157.2	-0.4	-119	-176.1	170.7	174.5	-7.2	105.9
164	S	29.3	Very low	31.4	Very low	120 Å²	120	134.5 Å²	134.5	84%	0.839	78%	0.784	S	S	*	*			trans	61.1	154.1	155.2	-53	0	0	0	0	115.6
165	G	28.6	Very low	31.1	Very low	60 Å²	60	137 Å²	137	62%	0.619	79%	0.789	S	S	*	*			cis	166.4	164	7.3	0	0	0	0	0	106.3
166	D	27.5	Very low	31.4	Very low	169 Å²	169	137.1 Å²	137.1	90%	0.904	79%	0.79	S	S	*	*			trans	62.7	96.3	172.2	-49.4	-23.4	0	0	0	116
167	S	29.9	Very low	31.4	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	80%	0.796	S	S	*	*			trans	-114.3	91.6	166.8	27.7	0	0	0	0	110.7	N169	S167-N169 PolarHBondContact O-N 3.18Å
168	S	30.7	Very low	31.6	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	80%	0.799	S	S	*	*			trans	-68.6	110.2	160.5	50.1	0	0	0	0	109.7	S170	S168-S170 PolarHBondContact O-N 2.61Å; S168-S170 VanDerWaalsContact O-N 3.14Å
169	N	31.5	Very low	31.7	Very low	165 Å²	165	147.1 Å²	147.1	88%	0.882	81%	0.807	S	S	*	*			trans	-83.2	91.9	178.5	-79	-14.6	0	0	0	111.1	S167	S167-N169 PolarHBondContact O-N 3.18Å
170	S	30.1	Very low	31.8	Very low	100 Å²	100	140.2 Å²	140.2	70%	0.699	81%	0.805	S	S	*	*			trans	-131.5	133.1	161.5	72.7	0	0	0	0	111.1	S168	S168-S170 PolarHBondContact O-N 2.61Å; S168-S170 VanDerWaalsContact O-N 3.14Å
171	A	29.4	Very low	31.8	Very low	87 Å²	87	141.2 Å²	141.2	72%	0.719	81%	0.809	S	S	*	*	S	Bend	trans	68	146.8	160.1	0	0	0	0	0	119.4
172	T	31.4	Very low	31.6	Very low	128 Å²	128	141.5 Å²	141.5	79%	0.785	82%	0.815	S	S	*	*			trans	50.4	104.6	161	58	0	0	0	0	118.9
173	D	28.5	Very low	31.6	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	82%	0.821	S	S	*	*				-170.2	87.6	127.8	-105.7	-14.8	0	0	0	113.1
174	H	33.3	Very low	31.8	Very low	193 Å²	193	132.7 Å²	132.7	89%	0.894	82%	0.818	S	S	*	*	S	Bend	trans	-149.2	141	155	-81.3	-48.3	0	0	0	109.7
175	L	31.3	Very low	31.9	Very low	173 Å²	173	134 Å²	134	91%	0.906	82%	0.815	S	S	*	*			trans	83	45.1	171.8	-46.7	-176.7	0	0	0	118.9
176	V	34.8	Very low	32	Very low	132 Å²	132	135.2 Å²	135.2	80%	0.8	81%	0.814	S	S	*	*			trans	-120.4	107.7	148.8	179.3	0	0	0	0	108.8
177	N	37.9	Very low	32.5	Very low	158 Å²	158	138.9 Å²	138.9	85%	0.845	82%	0.817	S	S	*	*			trans	164.4	69.8	157.4	-87.7	-25	0	0	0	111
178	L	33.7	Very low	32.8	Very low	166 Å²	166	143.3 Å²	143.3	87%	0.869	82%	0.823	S	S	*	*			trans	-138.5	25.5	179.6	-139.1	96.4	0	0	0	115.5
179	W	36.1	Very low	33.5	Very low	263 Å²	263	142.7 Å²	142.7	100%	0.996	82%	0.816	S	S	*	*			trans	-138.5	107.3	176.4	-77.5	69.9	0	0	0	110.8
180	G	33.4	Very low	33.9	Very low	77 Å²	77	140.5 Å²	140.5	79%	0.794	81%	0.811	S	S	*	*			trans	154.9	117.6	178.1	0	0	0	0	0	112.6
181	P	35.8	Very low	34.1	Very low	129 Å²	129	143.5 Å²	143.5	84%	0.838	82%	0.818	S	S	*	*			trans	-113.9	168.6	-159.4	41.1	-35.2	0	0	0	116.9
182	S	28.7	Very low	34.6	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	82%	0.819	S	S	*	*			trans	113.1	137.4	138.2	-154.9	0	0	0	0	119.2
183	A	33.2	Very low	34.9	Very low	103 Å²	103	143.6 Å²	143.6	85%	0.851	82%	0.819	S	S	*	*			trans	65.4	137.9	158.6	0	0	0	0	0	120
184	G	32.2	Very low	35.4	Very low	73 Å²	73	141.2 Å²	141.2	75%	0.753	81%	0.814	S	S	*	*			trans	142.2	59.7	163.2	0	0	0	0	0	117.7
185	D	31.8	Very low	35.7	Very low	146 Å²	146	137 Å²	137	78%	0.781	81%	0.807	S	S	*	*			trans	41.2	122.6	148.6	-88.7	-63.5	0	0	0	124.4
186	S	31.2	Very low	36.1	Very low	86 Å²	86	135.7 Å²	135.7	60%	0.601	80%	0.8	S	S	*	*				50.1	116.1	120	-58.2	0	0	0	0	121.1
187	Y	37.5	Very low	36.1	Very low	246 Å²	246	135.1 Å²	135.1	97%	0.965	79%	0.792	S	S	*	*				-152.9	152	120	-88.5	-64.5	0	0	0	110.8
188	K	36.4	Very low	36.1	Very low	203 Å²	203	137.6 Å²	137.6	88%	0.883	79%	0.79	S	S	*	*			trans	-130.5	-177.4	-161.3	-116.3	-162.5	174	171.6	0	112.1
189	P	44.7	Very low	36	Very low	98 Å²	98	138.8 Å²	138.8	64%	0.636	78%	0.783	S	S	*	*			trans	-118.9	-159.9	-140.6	45.7	-30.8	0	0	0	113.5
190	P	40.3	Very low	35.9	Very low	119 Å²	119	133.3 Å²	133.3	77%	0.773	77%	0.766	S	S	*	*			trans	-133.5	141.5	137.5	33.2	-18.8	0	0	0	112.4
191	L	35.4	Very low	35.9	Very low	162 Å²	162	136.5 Å²	136.5	85%	0.848	76%	0.764	S	S	*	*			cis	94.2	106.9	45.4	-87.1	167.6	0	0	0	115.8
192	S	38.6	Very low	35.8	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	76%	0.758	S	S	*	*			trans	-156.8	113.5	146.2	40.2	0	0	0	0	106.5
193	S	39	Very low	36.3	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	77%	0.765	S	S	*	*				67.7	130.9	76.6	76.4	0	0	0	0	112.6
194	S	37.9	Very low	36.2	Very low	104 Å²	104	145.6 Å²	145.6	73%	0.727	77%	0.766	S	S	*	*			cis	-165.3	175.5	11	57.8	0	0	0	0	113.5
195	S	39.8	Very low	36.5	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	76%	0.764	S	S	*	*			trans	76.8	145.1	158.4	82.3	0	0	0	0	118.3
196	L	39.7	Very low	36.8	Very low	144 Å²	144	149.8 Å²	149.8	75%	0.754	76%	0.762	S	S	*	*			cis	-152.1	125.5	-18.6	-92.8	150.4	0	0	0	105.3
197	N	35.4	Very low	37	Very low	120 Å²	120	152.8 Å²	152.8	64%	0.642	77%	0.771	S	S	*	*				72.6	86.1	70.6	-150.6	8.5	0	0	0	116.4
198	R	37.7	Very low	36.9	Very low	211 Å²	211	146.2 Å²	146.2	80%	0.796	76%	0.761	S	S	*	*				165.7	161.1	119.6	-90.3	170.6	-98.3	-150.5	-4.1	112.3
199	R	31.7	Very low	37.1	Very low	191 Å²	191	142.1 Å²	142.1	72%	0.721	76%	0.758	S	S	*	*			cis	152.5	139.9	-21	-151.9	168.3	-175.5	-165.1	8	106
200	F	33.2	Very low	36.7	Very low	148 Å²	148	145 Å²	145	65%	0.649	77%	0.767	S	S	*	*			trans	99.1	125	154.4	-60.6	-58.1	0	0	0	123.5
201	L	34.8	Very low	36.8	Very low	143 Å²	143	145.3 Å²	145.3	75%	0.749	77%	0.769	S	S	*	*				63.3	110.7	126.6	-68.3	162.1	0	0	0	121.6
202	S	32.1	Very low	36.9	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	77%	0.771	S	S	*	*				25.9	110.8	127.8	62.6	0	0	0	0	119.2
203	Q	40.7	Very low	36.8	Very low	204 Å²	204	147.2 Å²	147.2	95%	0.953	78%	0.777	S	S	*	*			trans	-145.2	137.3	137.2	-115.3	167.8	10.4	0	0	111.7
204	R	30.1	Very low	36.9	Very low	234 Å²	234	146.7 Å²	146.7	88%	0.883	78%	0.779	S	S	*	*			trans	-97.9	164.4	-179.7	-175.1	-174.9	-176.7	174.5	1.3	108
205	I	39.1	Very low	37	Very low	136 Å²	136	146.8 Å²	146.8	70%	0.697	78%	0.78	S	S	*	*			trans	115.2	98.4	155.8	-59.9	177.4	0	0	0	116
206	K	36.8	Very low	37	Very low	171 Å²	171	153.4 Å²	153.4	74%	0.743	79%	0.789	S	S	*	*			trans	73.4	116.7	136.7	-66.9	177.3	-171.7	178	0	122.2
207	N	35	Very low	37.5	Very low	148 Å²	148	152.2 Å²	152.2	79%	0.791	79%	0.787	S	S	*	*				76.2	137.7	128.9	-59.5	7.8	0	0	0	117.2
208	S	36.5	Very low	38.6	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	79%	0.792	S	S	*	*			cis	-160.6	171.1	9	46.4	0	0	0	0	113.8
209	S	40.3	Very low	40	Very low	116 Å²	116	144.5 Å²	144.5	81%	0.811	77%	0.768	S	S	*	*			trans	83.4	123.5	165.9	69.5	0	0	0	0	119.7
210	L	36.6	Very low	42.1	Very low	160 Å²	160	137.7 Å²	137.7	84%	0.838	75%	0.75	S	S	*	*			trans	-84.2	163.4	175.9	-89.4	70	0	0	0	111.5
211	P	41.5	Very low	44.3	Very low	125 Å²	125	134 Å²	134	81%	0.812	74%	0.735	S	S	*	*				-139.8	142.2	101.9	34.7	-20.9	0	0	0	116.7
212	K	38.8	Very low	46.4	Very low	202 Å²	202	129.2 Å²	129.2	88%	0.878	72%	0.716	S	S	*	*			trans	23.2	137.8	150.7	-68.2	176.4	175.9	177.1	0	122.3
213	A	35.5	Very low	48.7	Very low	106 Å²	106	127.8 Å²	127.8	88%	0.876	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-74.3	151.3	174.8	0	0	0	0	0	114.4
214	A	41.5	Very low	50.7	Low	99 Å²	99	118.1 Å²	118.1	82%	0.818	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-97.1	140.1	171.9	0	0	0	0	0	111.9
215	S	41	Very low	53.3	Low	106 Å²	106	107.5 Å²	107.5	74%	0.741	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.9	-177.4	50.2	0	0	0	0	113.2
216	R	38.8	Very low	55.4	Low	246 Å²	246	105 Å²	105	93%	0.928	60%	0.597	S	S	*	*			trans	-86.5	113.8	168.1	-63.2	173.9	179.2	170.5	-2.3	109
217	T	49.7	Very low	57.7	Low	118 Å²	118	97.9 Å²	97.9	72%	0.724	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-97.1	127.9	179.2	45.3	0	0	0	0	111.8
218	T	59.6	Low	60.1	Low	122 Å²	122	90.9 Å²	90.9	75%	0.748	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-74.5	139.5	169.5	45.8	0	0	0	0	110.6
219	V	67.1	Low	62.4	Low	47 Å²	47	86 Å²	86	29%	0.285	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-78.3	143.6	179.9	-176.4	0	0	0	0	110.2	L224 L239 A255	V219-L224 HydrophobicContact CG1-CD1 4.36Å; V219-L224 HydrophobicContact CG1-CD2 4.31Å; V219-L224 HydrophobicContact CG1-CG 3.94Å; V219-L239 HydrophobicContact CG1-CD1 3.59Å; V219-L239 HydrophobicContact CG1-CD2 3.83Å; V219-L239 HydrophobicContact CG1-CG 4.37Å; V219-L239 HydrophobicContact CG2-CD2 3.95Å; V219-A255 HydrophobicContact CG2-CB 4.07Å
220	S	75.3	Confident	64.6	Low	48 Å²	48	85.5 Å²	85.5	34%	0.336	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-76.9	146.8	178.3	92.4	0	0	0	0	112.1	A222 D223 L224	S220-A222 VanDerWaalsContact C-N 3.28Å; S220-A222 PolarHBondContact O-N 3.22Å; S220-D223 PolarHBondContact O-N 3.41Å; S220-D223 PolarHBondContact OG-N 3.47Å; S220-D223 VanDerWaalsContact OG-N 3.11Å; S220-D223 PolarHBondContact OG-OD2 3.3Å; S220-L224 PolarHBondContact O-N 2.96Å
221	E	79.3	Confident	67	Low	71 Å²	71	77.9 Å²	77.9	33%	0.332	44%	0.438	S	S	.	.	H	α-helix	trans	-63.9	-34.7	174.7	177.8	162.1	-176.3	0	0	111.7	D223 L224 L225 T383 I384	E221-D223 VanDerWaalsContact C-N 3.34Å; E221-D223 PolarHBondContact O-N 3.5Å; E221-L224 PolarHBondContact O-N 3.09Å; E221-L225 HydrophobicContact CG-CD1 3.81Å; E221-L225 HydrophobicContact CG-CG 4.22Å; E221-L225 WeakPolarHBondContact O-CB 3.49Å; E221-L225 VanDerWaalsContact O-CG 3.27Å; E221-L225 WeakPolarHBondContact O-CG 3.44Å; E221-L225 PolarHBondContact O-N 3.07Å; E221-T383 VanDerWaalsContact OE1-CG2 3.3Å; E221-T383 WeakPolarHBondContact OE1-CG2 3.46Å; E221-I384 HydrophobicContact CG-CD1 3.78Å; E221-I384 HydrophobicContact CG-CG1 3.95Å; E221-I384 WeakPolarHBondContact OE1-CG1 3.18Å; E221-I384 PolarHBondContact OE1-N 2.97Å
222	A	78.4	Confident	69.1	Low	42 Å²	42	72 Å²	72	35%	0.347	40%	0.4	S	S	.	.	H	α-helix	trans	-64.5	-34.9	178.6	0	0	0	0	0	113.2	S220 R226	S220-A222 VanDerWaalsContact C-N 3.28Å; S220-A222 PolarHBondContact O-N 3.22Å; A222-R226 WeakPolarHBondContact O-CG 3.25Å; A222-R226 PolarHBondContact O-N 2.81Å
223	D	81.7	Confident	71.3	Confident	73 Å²	73	64.2 Å²	64.2	39%	0.39	37%	0.368	S	S	.	.	H	α-helix	trans	-77.2	-36.9	176.7	-58.6	-41.7	0	0	0	111.3	S220 E221 R226 E227 L239	S220-D223 PolarHBondContact O-N 3.41Å; S220-D223 PolarHBondContact OG-N 3.47Å; S220-D223 VanDerWaalsContact OG-N 3.11Å; S220-D223 PolarHBondContact OG-OD2 3.3Å; E221-D223 VanDerWaalsContact C-N 3.34Å; E221-D223 PolarHBondContact O-N 3.5Å; D223-R226 PolarHBondContact O-N 3.45Å; D223-R226 IonicContact OD1-NH1 3.06Å; D223-R226 PolarHBondContact OD1-NH1 3.05Å; D223-E227 PolarHBondContact O-N 2.78Å; D223-L239 HydrophobicContact CB-CD1 4.38Å
224	L	82.4	Confident	73.5	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-43.8	170.2	-73.4	167.8	0	0	0	111.6	V219 S220 E221 E227 L228 L239 L251 V257 I265	V219-L224 HydrophobicContact CG1-CD1 4.36Å; V219-L224 HydrophobicContact CG1-CD2 4.31Å; V219-L224 HydrophobicContact CG1-CG 3.94Å; S220-L224 PolarHBondContact O-N 2.96Å; E221-L224 PolarHBondContact O-N 3.09Å; L224-E227 PolarHBondContact O-N 3.48Å; L224-L228 WeakPolarHBondContact O-CB 3.4Å; L224-L228 WeakPolarHBondContact O-CD1 3.43Å; L224-L228 WeakPolarHBondContact O-CG 3.5Å; L224-L228 PolarHBondContact O-N 2.96Å; L224-L239 HydrophobicContact CD2-CB 4.46Å; L224-L239 HydrophobicContact CD2-CD1 3.98Å; L224-L239 HydrophobicContact CG-CD1 4.38Å; L224-L251 HydrophobicContact CD2-CD2 4.36Å; L224-V257 HydrophobicContact CD1-CG2 4.32Å; L224-V257 HydrophobicContact CD2-CG2 4.46Å; L224-I265 HydrophobicContact CD2-CD1 4.15Å
225	L	83.7	Confident	75.6	Confident	10 Å²	10	59.9 Å²	59.9	5%	0.052	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-41.7	178.2	-75	163	0	0	0	112.6	E221 L228 V229 L320 L382 I384 L387	E221-L225 HydrophobicContact CG-CD1 3.81Å; E221-L225 HydrophobicContact CG-CG 4.22Å; E221-L225 WeakPolarHBondContact O-CB 3.49Å; E221-L225 VanDerWaalsContact O-CG 3.27Å; E221-L225 WeakPolarHBondContact O-CG 3.44Å; E221-L225 PolarHBondContact O-N 3.07Å; L225-L228 PolarHBondContact O-N 2.9Å; L225-V229 WeakPolarHBondContact O-CG2 3.4Å; L225-V229 PolarHBondContact O-N 3.38Å; L225-L320 HydrophobicContact CB-CD1 3.92Å; L225-L320 HydrophobicContact CB-CD2 4.43Å; L225-L320 HydrophobicContact CD1-CD1 4.45Å; L225-L382 WeakPolarHBondContact CD1-O 3.44Å; L225-I384 HydrophobicContact CD2-CG1 3.82Å; L225-I384 HydrophobicContact CG-CG1 4.11Å; L225-L387 HydrophobicContact CD2-CD2 3.91Å
226	R	83.8	Confident	77.4	Confident	85 Å²	85	56.7 Å²	56.7	32%	0.321	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-46.5	174.6	-71.1	169.8	-166.1	135	4.6	111.5	A222 D223 L228 V229 F230 L320	A222-R226 WeakPolarHBondContact O-CG 3.25Å; A222-R226 PolarHBondContact O-N 2.81Å; D223-R226 PolarHBondContact O-N 3.45Å; D223-R226 IonicContact OD1-NH1 3.06Å; D223-R226 PolarHBondContact OD1-NH1 3.05Å; R226-L228 VanDerWaalsContact C-N 3.33Å; R226-L228 PolarHBondContact O-N 3.49Å; R226-V229 PolarHBondContact O-N 3.12Å; R226-F230 WeakPolarHBondContact O-CD2 3.38Å; R226-F230 PolarHBondContact O-N 2.83Å; R226-F230 VanDerWaalsContact O-N 3.13Å; R226-L320 HydrophobicContact CB-CD2 4.5Å; R226-L320 HydrophobicContact CG-CD2 3.86Å; R226-L320 HydrophobicContact CG-CG 4.46Å
227	E	84.7	Confident	79.3	Confident	21 Å²	21	45.9 Å²	45.9	10%	0.098	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-35.7	175.4	-72.7	-153	-167.9	0	0	113	D223 L224 V229 F230 V231 G237 N238 L239 I240	D223-E227 PolarHBondContact O-N 2.78Å; L224-E227 PolarHBondContact O-N 3.48Å; E227-V229 PolarHBondContact O-N 2.94Å; E227-F230 PolarHBondContact O-N 3.11Å; E227-V231 VanDerWaalsContact O-CG2 3.26Å; E227-V231 WeakPolarHBondContact O-CG2 3.32Å; E227-V231 PolarHBondContact O-N 3.47Å; E227-G237 WeakPolarHBondContact OE2-CA 3.36Å; E227-N238 VanDerWaalsContact CD-N 3.27Å; E227-N238 WeakPolarHBondContact OE1-CA 3.31Å; E227-N238 WeakPolarHBondContact OE1-CB 3.45Å; E227-N238 PolarHBondContact OE1-N 3.3Å; E227-N238 PolarHBondContact OE2-N 3.42Å; E227-N238 VanDerWaalsContact OE2-N 3.12Å; E227-L239 VanDerWaalsContact CD-N 3.27Å; E227-L239 HydrophobicContact CG-CD1 4.33Å; E227-L239 WeakPolarHBondContact OE1-CG 3.19Å; E227-L239 PolarHBondContact OE1-N 2.8Å; E227-L239 VanDerWaalsContact OE2-CA 3.32Å; E227-L239 WeakPolarHBondContact OE2-CA 3.46Å; E227-L239 VanDerWaalsContact OE2-CB 3.24Å; E227-L239 WeakPolarHBondContact OE2-CB 3.3Å; E227-L239 PolarHBondContact OE2-N 3.47Å; E227-I240 HydrophobicContact CB-CD1 4.47Å; E227-I240 PolarHBondContact OE2-N 3.13Å
228	L	85.4	Confident	80.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-37.7	174.9	-74.6	165	0	0	0	112.4	L224 L225 R226 V231 L232 I240 I265 I268 I384 L387	L224-L228 WeakPolarHBondContact O-CB 3.4Å; L224-L228 WeakPolarHBondContact O-CD1 3.43Å; L224-L228 WeakPolarHBondContact O-CG 3.5Å; L224-L228 PolarHBondContact O-N 2.96Å; L225-L228 PolarHBondContact O-N 2.9Å; R226-L228 VanDerWaalsContact C-N 3.33Å; R226-L228 PolarHBondContact O-N 3.49Å; L228-V231 PolarHBondContact O-N 3.36Å; L228-L232 WeakPolarHBondContact O-CG 3.32Å; L228-L232 PolarHBondContact O-N 3.44Å; L228-I240 HydrophobicContact CD2-CD1 3.68Å; L228-I240 HydrophobicContact CG-CD1 4Å; L228-I265 HydrophobicContact CD1-CG1 4.16Å; L228-I265 HydrophobicContact CD2-CB 4.37Å; L228-I265 HydrophobicContact CD2-CG1 4.15Å; L228-I265 HydrophobicContact CD2-CG2 4.14Å; L228-I268 HydrophobicContact CB-CG2 4.3Å; L228-I268 HydrophobicContact CD1-CD1 4.18Å; L228-I268 HydrophobicContact CD2-CB 3.97Å; L228-I268 HydrophobicContact CD2-CD1 4.32Å; L228-I268 HydrophobicContact CD2-CG2 3.72Å; L228-I384 HydrophobicContact CD1-CG1 4.38Å; L228-L387 HydrophobicContact CB-CD2 3.9Å; L228-L387 HydrophobicContact CD1-CD2 4.17Å
229	V	85.7	Confident	81.4	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-66.9	-37.4	173	173.8	0	0	0	0	111.6	L225 R226 E227 L232 N233 V313 E317 L320	L225-V229 WeakPolarHBondContact O-CG2 3.4Å; L225-V229 PolarHBondContact O-N 3.38Å; R226-V229 PolarHBondContact O-N 3.12Å; E227-V229 PolarHBondContact O-N 2.94Å; V229-L232 PolarHBondContact O-N 2.68Å; V229-N233 PolarHBondContact O-N 3.12Å; V229-N233 PolarHBondContact O-ND2 3.18Å; V229-V313 HydrophobicContact CG1-CG1 4.29Å; V229-E317 HydrophobicContact CG1-CB 4.23Å; V229-L320 HydrophobicContact CG2-CD2 3.87Å
230	F	85.3	Confident	82	Confident	105 Å²	105	39.9 Å²	39.9	46%	0.461	23%	0.225	S	C	.	.	H	α-helix	trans	-66	-39	171.4	-66.7	-54.8	0	0	0	112.6	R226 E227 N233 G234 I235	R226-F230 WeakPolarHBondContact O-CD2 3.38Å; R226-F230 PolarHBondContact O-N 2.83Å; R226-F230 VanDerWaalsContact O-N 3.13Å; E227-F230 PolarHBondContact O-N 3.11Å; F230-N233 CarbonylContact O-C 3.25Å; F230-N233 WeakPolarHBondContact O-CA 3.3Å; F230-N233 WeakPolarHBondContact O-CB 3.44Å; F230-N233 PolarHBondContact O-N 2.96Å; F230-N233 VanDerWaalsContact O-N 3.13Å; F230-G234 PolarHBondContact O-N 2.89Å; F230-I235 CarbonylContact C-O 3.53Å; F230-I235 VanDerWaalsContact C-O 3.25Å; F230-I235 HydrophobicContact CB-CB 4.41Å; F230-I235 WeakPolarHBondContact O-CB 3.36Å; F230-I235 PolarHBondContact O-N 3.25Å
231	V	87.1	Confident	82.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-37	175.9	169.6	0	0	0	0	111.6	E227 L228 N233 G234 I235 I240 F249 A269 G272	E227-V231 VanDerWaalsContact O-CG2 3.26Å; E227-V231 WeakPolarHBondContact O-CG2 3.32Å; E227-V231 PolarHBondContact O-N 3.47Å; L228-V231 PolarHBondContact O-N 3.36Å; V231-N233 VanDerWaalsContact C-N 3.27Å; V231-N233 PolarHBondContact O-N 3.31Å; V231-G234 WeakPolarHBondContact O-CA 3.41Å; V231-G234 PolarHBondContact O-N 3.36Å; V231-I235 WeakPolarHBondContact CA-O 3.15Å; V231-I235 PolarHBondContact N-O 2.61Å; V231-I240 HydrophobicContact CG2-CB 3.88Å; V231-I240 HydrophobicContact CG2-CD1 4.18Å; V231-I240 HydrophobicContact CG2-CG2 3.68Å; V231-F249 HydrophobicContact CG1-CB 4.29Å; V231-F249 HydrophobicContact CG1-CD1 4.07Å; V231-F249 HydrophobicContact CG1-CD2 4.16Å; V231-F249 HydrophobicContact CG1-CE1 4.41Å; V231-F249 HydrophobicContact CG1-CG 3.93Å; V231-F249 HydrophobicContact CG2-CD1 4.21Å; V231-F249 HydrophobicContact CG2-CE1 4.48Å; V231-A269 HydrophobicContact CG1-CB 4.27Å; V231-G272 WeakPolarHBondContact O-CA 3.26Å
232	L	86.5	Confident	82.3	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-37.5	171.5	-74	168.6	0	0	0	111.9	L228 V229 G234 I268 C271 Y309 V313 L316 L387 T391	L228-L232 WeakPolarHBondContact O-CG 3.32Å; L228-L232 PolarHBondContact O-N 3.44Å; V229-L232 PolarHBondContact O-N 2.68Å; L232-G234 PolarHBondContact O-N 3.14Å; L232-I268 HydrophobicContact CD1-CG2 4.34Å; L232-I268 HydrophobicContact CD2-CG2 3.99Å; L232-I268 HydrophobicContact CG-CG2 4.03Å; L232-C271 HydrophobicContact CD2-CB 3.71Å; L232-Y309 WeakPolarHBondContact CD2-OH 3.31Å; L232-Y309 PolarHBondContact O-OH 2.88Å; L232-Y309 VanDerWaalsContact O-OH 3.06Å; L232-V313 HydrophobicContact CB-CG2 4.18Å; L232-L316 HydrophobicContact CD1-CD1 4.37Å; L232-L387 HydrophobicContact CD1-CD1 4.21Å; L232-T391 HydrophobicContact CD1-CG2 4.22Å; L232-T391 HydrophobicContact CD2-CG2 3.91Å
233	N	85.7	Confident	82.2	Confident	39 Å²	39	43.1 Å²	43.1	21%	0.209	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	1.3	171.4	-76.6	-49.4	0	0	0	114.5	V229 F230 V231 I235	V229-N233 PolarHBondContact O-N 3.12Å; V229-N233 PolarHBondContact O-ND2 3.18Å; F230-N233 CarbonylContact O-C 3.25Å; F230-N233 WeakPolarHBondContact O-CA 3.3Å; F230-N233 WeakPolarHBondContact O-CB 3.44Å; F230-N233 PolarHBondContact O-N 2.96Å; F230-N233 VanDerWaalsContact O-N 3.13Å; V231-N233 VanDerWaalsContact C-N 3.27Å; V231-N233 PolarHBondContact O-N 3.31Å; N233-I235 HydrophobicContact CB-CD1 4.44Å
234	G	81.6	Confident	81.9	Confident	14 Å²	14	47.2 Å²	47.2	14%	0.144	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	11.9	-179.7	0	0	0	0	0	114.8	F230 V231 L232 N276	F230-G234 PolarHBondContact O-N 2.89Å; V231-G234 WeakPolarHBondContact O-CA 3.41Å; V231-G234 PolarHBondContact O-N 3.36Å; L232-G234 PolarHBondContact O-N 3.14Å; G234-N276 WeakPolarHBondContact CA-ND2 3.38Å; G234-N276 WeakPolarHBondContact CA-OD1 3.3Å; G234-N276 PolarHBondContact O-ND2 2.9Å
235	I	84.3	Confident	81.5	Confident	100 Å²	100	54.3 Å²	54.3	51%	0.513	28%	0.277	S	S	.	.			trans	-102.3	125.2	-175.6	-55.5	173.5	0	0	0	109.7	F230 V231 N233	F230-I235 CarbonylContact C-O 3.53Å; F230-I235 VanDerWaalsContact C-O 3.25Å; F230-I235 HydrophobicContact CB-CB 4.41Å; F230-I235 WeakPolarHBondContact O-CB 3.36Å; F230-I235 PolarHBondContact O-N 3.25Å; V231-I235 WeakPolarHBondContact CA-O 3.15Å; V231-I235 PolarHBondContact N-O 2.61Å; N233-I235 HydrophobicContact CB-CD1 4.44Å
236	G	79.6	Confident	80.7	Confident	39 Å²	39	58.7 Å²	58.7	40%	0.402	30%	0.297	S	S	.	.			trans	-76.4	136.9	174.3	0	0	0	0	0	112.4	I240	G236-I240 CarbonylContact C-O 3.6Å; G236-I240 WeakPolarHBondContact CA-O 3.22Å
237	G	79.2	Confident	80.3	Confident	20 Å²	20	57.9 Å²	57.9	21%	0.206	30%	0.299	C	S	.	.			trans	-97.4	-160.2	175.8	0	0	0	0	0	113.9	E227 I240 K241	E227-G237 WeakPolarHBondContact OE2-CA 3.36Å; G237-I240 PolarHBondContact N-O 3.07Å; G237-K241 WeakPolarHBondContact O-CG 3.44Å
238	N	77	Confident	80	Confident	132 Å²	132	58.4 Å²	58.4	71%	0.706	31%	0.305	S	S	*	.	S	Bend	trans	-84.2	-36.8	178.1	-69.5	-42.6	0	0	0	112.1	E227 V252	E227-N238 VanDerWaalsContact CD-N 3.27Å; E227-N238 WeakPolarHBondContact OE1-CA 3.31Å; E227-N238 WeakPolarHBondContact OE1-CB 3.45Å; E227-N238 PolarHBondContact OE1-N 3.3Å; E227-N238 PolarHBondContact OE2-N 3.42Å; E227-N238 VanDerWaalsContact OE2-N 3.12Å; N238-V252 WeakPolarHBondContact O-CG2 3.39Å
239	L	74.8	Confident	79.8	Confident	29 Å²	29	58.6 Å²	58.6	15%	0.152	31%	0.306	C	S	.	.	S	Bend	trans	-85.3	-38	177.9	-54.7	163.5	0	0	0	111.3	V219 D223 L224 E227 L251 V252 A255	V219-L239 HydrophobicContact CG1-CD1 3.59Å; V219-L239 HydrophobicContact CG1-CD2 3.83Å; V219-L239 HydrophobicContact CG1-CG 4.37Å; V219-L239 HydrophobicContact CG2-CD2 3.95Å; D223-L239 HydrophobicContact CB-CD1 4.38Å; L224-L239 HydrophobicContact CD2-CB 4.46Å; L224-L239 HydrophobicContact CD2-CD1 3.98Å; L224-L239 HydrophobicContact CG-CD1 4.38Å; E227-L239 VanDerWaalsContact CD-N 3.27Å; E227-L239 HydrophobicContact CG-CD1 4.33Å; E227-L239 WeakPolarHBondContact OE1-CG 3.19Å; E227-L239 PolarHBondContact OE1-N 2.8Å; E227-L239 VanDerWaalsContact OE2-CA 3.32Å; E227-L239 WeakPolarHBondContact OE2-CA 3.46Å; E227-L239 VanDerWaalsContact OE2-CB 3.24Å; E227-L239 WeakPolarHBondContact OE2-CB 3.3Å; E227-L239 PolarHBondContact OE2-N 3.47Å; L239-L251 CarbonylContact O-C 3.58Å; L239-L251 WeakPolarHBondContact O-CA 3.44Å; L239-V252 PolarHBondContact O-N 3Å; L239-A255 HydrophobicContact CD2-CB 4.24Å
240	I	80.3	Confident	79.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	107.3	179.9	-53.6	169.6	0	0	0	110.5	E227 L228 V231 G236 G237 F249 R250 L251 I265	E227-I240 HydrophobicContact CB-CD1 4.47Å; E227-I240 PolarHBondContact OE2-N 3.13Å; L228-I240 HydrophobicContact CD2-CD1 3.68Å; L228-I240 HydrophobicContact CG-CD1 4Å; V231-I240 HydrophobicContact CG2-CB 3.88Å; V231-I240 HydrophobicContact CG2-CD1 4.18Å; V231-I240 HydrophobicContact CG2-CG2 3.68Å; G236-I240 CarbonylContact C-O 3.6Å; G236-I240 WeakPolarHBondContact CA-O 3.22Å; G237-I240 PolarHBondContact N-O 3.07Å; I240-F249 HydrophobicContact CG2-CB 3.98Å; I240-F249 HydrophobicContact CG2-CD1 4.32Å; I240-R250 CarbonylContact C-O 3.29Å; I240-R250 WeakPolarHBondContact CA-O 3.42Å; I240-L251 HydrophobicContact CG1-CD2 3.86Å; I240-I265 HydrophobicContact CD1-CG2 3.89Å; I240-I265 HydrophobicContact CG1-CG2 4.4Å
241	K	80.4	Confident	78.8	Confident	112 Å²	112	59.1 Å²	59.1	49%	0.487	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	149.2	178.7	-68.4	-175.3	-177.1	-178	0	111.4	G237 D243 R250 V252	G237-K241 WeakPolarHBondContact O-CG 3.44Å; K241-D243 PolarHBondContact O-N 3.37Å; K241-R250 PolarHBondContact N-O 3.43Å; K241-R250 PolarHBondContact O-N 3.49Å; K241-V252 HydrophobicContact CB-CG2 4.15Å; K241-V252 HydrophobicContact CD-CG2 3.63Å; K241-V252 HydrophobicContact CG-CG2 3.66Å
242	Y	80.3	Confident	78.1	Confident	79 Å²	79	61 Å²	61	31%	0.31	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	118.7	173.3	-178.2	-112.4	0	0	0	110	H244 D247 F249	Y242-H244 AromaticContact CD1-CE1 3.63Å; Y242-H244 AromaticContact CD1-ND1 3.71Å; Y242-H244 AromaticContact CE1-CE1 3.67Å; Y242-H244 AromaticContact CE1-ND1 3.43Å; Y242-H244 WeakPolarHBondContact CE1-ND1 3.36Å; Y242-D247 PolarHBondContact OH-OD1 3.04Å; Y242-F249 HydrophobicContact CD2-CD1 4.32Å; Y242-F249 HydrophobicContact CD2-CD2 4.09Å; Y242-F249 HydrophobicContact CD2-CE1 4.26Å; Y242-F249 HydrophobicContact CD2-CE2 4.01Å; Y242-F249 HydrophobicContact CD2-CG 4.24Å; Y242-F249 HydrophobicContact CD2-CZ 4.1Å; Y242-F249 HydrophobicContact CG-CE1 4.44Å
243	D	77.3	Confident	77	Confident	37 Å²	37	67.1 Å²	67.1	20%	0.198	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	104.8	175.3	-180	5.6	0	0	0	109.6	K241 I245 Q246 D247 S248 R250	K241-D243 PolarHBondContact O-N 3.37Å; D243-I245 PolarHBondContact O-N 3.47Å; D243-I245 WeakPolarHBondContact OD1-CB 3.4Å; D243-I245 PolarHBondContact OD1-N 2.84Å; D243-Q246 PolarHBondContact O-N 3.12Å; D243-Q246 PolarHBondContact OD2-NE2 2.97Å; D243-D247 PolarHBondContact O-N 3.4Å; D243-S248 PolarHBondContact N-O 3.14Å; D243-S248 PolarHBondContact O-N 2.91Å; D243-R250 HydrophobicContact CB-CG 4.14Å; D243-R250 IonicContact OD2-CZ 2.9Å; D243-R250 IonicContact OD2-NE 2.98Å; D243-R250 IonicContact OD2-NH1 2.95Å
244	H	75	Confident	75.8	Confident	159 Å²	159	71.2 Å²	71.2	74%	0.736	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.6	177.7	-68	-75	0	0	0	114.1	Y242	Y242-H244 AromaticContact CD1-CE1 3.63Å; Y242-H244 AromaticContact CD1-ND1 3.71Å; Y242-H244 AromaticContact CE1-CE1 3.67Å; Y242-H244 AromaticContact CE1-ND1 3.43Å; Y242-H244 WeakPolarHBondContact CE1-ND1 3.36Å
245	I	74.3	Confident	74.8	Confident	151 Å²	151	71.2 Å²	71.2	77%	0.774	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-35.5	-176.6	-56	175.6	0	0	0	110.8	D243	D243-I245 PolarHBondContact O-N 3.47Å; D243-I245 WeakPolarHBondContact OD1-CB 3.4Å; D243-I245 PolarHBondContact OD1-N 2.84Å
246	Q	65.9	Low	73.9	Confident	103 Å²	103	72.7 Å²	72.7	48%	0.481	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	19.5	-175	-75.3	162.9	94.9	0	0	112.3	D243 S248	D243-Q246 PolarHBondContact O-N 3.12Å; D243-Q246 PolarHBondContact OD2-NE2 2.97Å; Q246-S248 WeakPolarHBondContact O-CB 3.3Å; Q246-S248 PolarHBondContact O-N 3.46Å; Q246-S248 PolarHBondContact O-OG 3.2Å
247	D	76.2	Confident	73.5	Confident	67 Å²	67	71.2 Å²	71.2	36%	0.358	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	36.8	49.1	177.6	-164.1	12	0	0	0	113.2	Y242 D243 W273	Y242-D247 PolarHBondContact OH-OD1 3.04Å; D243-D247 PolarHBondContact O-N 3.4Å; D247-W273 VanDerWaalsContact O-CD1 3.25Å; D247-W273 PolarHBondContact O-NE1 3.29Å; D247-W273 VanDerWaalsContact O-NE1 3.09Å; D247-W273 PolarHBondContact OD1-NE1 3.37Å; D247-W273 PolarHBondContact OD2-NE1 3.35Å; D247-W273 VanDerWaalsContact OD2-NE1 3.12Å
248	S	79.2	Confident	73.4	Confident	33 Å²	33	74.1 Å²	74.1	23%	0.231	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146.3	-172.7	46.9	0	0	0	0	111.8	D243 Q246 R250	D243-S248 PolarHBondContact N-O 3.14Å; D243-S248 PolarHBondContact O-N 2.91Å; Q246-S248 WeakPolarHBondContact O-CB 3.3Å; Q246-S248 PolarHBondContact O-N 3.46Å; Q246-S248 PolarHBondContact O-OG 3.2Å; S248-R250 PolarHBondContact OG-NE 2.97Å
249	F	81.2	Confident	73.3	Confident	4 Å²	4	73.3 Å²	73.3	2%	0.018	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.2	169.5	-76.2	-83.3	0	0	0	109.9	V231 I240 Y242 A269 W273	V231-F249 HydrophobicContact CG1-CB 4.29Å; V231-F249 HydrophobicContact CG1-CD1 4.07Å; V231-F249 HydrophobicContact CG1-CD2 4.16Å; V231-F249 HydrophobicContact CG1-CE1 4.41Å; V231-F249 HydrophobicContact CG1-CG 3.93Å; V231-F249 HydrophobicContact CG2-CD1 4.21Å; V231-F249 HydrophobicContact CG2-CE1 4.48Å; I240-F249 HydrophobicContact CG2-CB 3.98Å; I240-F249 HydrophobicContact CG2-CD1 4.32Å; Y242-F249 HydrophobicContact CD2-CD1 4.32Å; Y242-F249 HydrophobicContact CD2-CD2 4.09Å; Y242-F249 HydrophobicContact CD2-CE1 4.26Å; Y242-F249 HydrophobicContact CD2-CE2 4.01Å; Y242-F249 HydrophobicContact CD2-CG 4.24Å; Y242-F249 HydrophobicContact CD2-CZ 4.1Å; Y242-F249 HydrophobicContact CG-CE1 4.44Å; F249-A269 HydrophobicContact CB-CB 3.8Å; F249-W273 HydrophobicContact CD2-CB 4.22Å; F249-W273 HydrophobicContact CE2-CB 4.45Å
250	R	75.8	Confident	73.4	Confident	89 Å²	89	74.6 Å²	74.6	34%	0.336	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.5	-173.3	-67.2	-171.1	171.5	-147.6	-11.4	112.1	I240 K241 D243 S248	I240-R250 CarbonylContact C-O 3.29Å; I240-R250 WeakPolarHBondContact CA-O 3.42Å; K241-R250 PolarHBondContact N-O 3.43Å; K241-R250 PolarHBondContact O-N 3.49Å; D243-R250 HydrophobicContact CB-CG 4.14Å; D243-R250 IonicContact OD2-CZ 2.9Å; D243-R250 IonicContact OD2-NE 2.98Å; D243-R250 IonicContact OD2-NH1 2.95Å; S248-R250 PolarHBondContact OG-NE 2.97Å
251	L	73.6	Confident	73.4	Confident	34 Å²	34	77.3 Å²	77.3	18%	0.178	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	131.2	169.1	-74.3	159.1	0	0	0	109.9	L224 L239 I240 S253 V257 Q262 I265	L224-L251 HydrophobicContact CD2-CD2 4.36Å; L239-L251 CarbonylContact O-C 3.58Å; L239-L251 WeakPolarHBondContact O-CA 3.44Å; I240-L251 HydrophobicContact CG1-CD2 3.86Å; L251-S253 PolarHBondContact O-N 3.16Å; L251-V257 HydrophobicContact CD2-CG2 4.39Å; L251-Q262 HydrophobicContact CD1-CB 4.29Å; L251-Q262 HydrophobicContact CD1-CG 3.96Å; L251-I265 HydrophobicContact CD1-CB 4.36Å; L251-I265 HydrophobicContact CD1-CD1 4Å; L251-I265 HydrophobicContact CD1-CG2 3.95Å; L251-I265 HydrophobicContact CD2-CD1 4.21Å; L251-I265 HydrophobicContact CD2-CG2 4.26Å; L251-I265 HydrophobicContact CG-CG2 4.01Å
252	V	72.9	Confident	73.5	Confident	39 Å²	39	75 Å²	75	24%	0.236	42%	0.417	C	S	.	.			trans	-66.7	132.6	173.3	-177.6	0	0	0	0	108.6	N238 L239 K241 T254 A255	N238-V252 WeakPolarHBondContact O-CG2 3.39Å; L239-V252 PolarHBondContact O-N 3Å; K241-V252 HydrophobicContact CB-CG2 4.15Å; K241-V252 HydrophobicContact CD-CG2 3.63Å; K241-V252 HydrophobicContact CG-CG2 3.66Å; V252-T254 WeakPolarHBondContact CG1-OG1 3.46Å; V252-T254 PolarHBondContact O-N 3.28Å; V252-A255 PolarHBondContact O-N 2.97Å
253	S	62.1	Low	73.6	Confident	130 Å²	130	74.9 Å²	74.9	91%	0.909	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-1.6	-173.6	-168.2	0	0	0	0	115.8	L251	L251-S253 PolarHBondContact O-N 3.16Å
254	T	60.3	Low	74	Confident	125 Å²	125	74.2 Å²	74.2	77%	0.767	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-16.5	172.2	52.4	0	0	0	0	113.5	V252	V252-T254 WeakPolarHBondContact CG1-OG1 3.46Å; V252-T254 PolarHBondContact O-N 3.28Å
255	A	62	Low	74.5	Confident	13 Å²	13	66.7 Å²	66.7	11%	0.107	39%	0.385	C	S	.	.			trans	-91.1	105.2	179.3	0	0	0	0	0	110.9	V219 L239 V252 V257	V219-A255 HydrophobicContact CG2-CB 4.07Å; L239-A255 HydrophobicContact CD2-CB 4.24Å; V252-A255 PolarHBondContact O-N 2.97Å; A255-V257 HydrophobicContact CB-CG2 4.2Å; A255-V257 PolarHBondContact O-N 2.96Å
256	N	64.9	Low	75	Confident	132 Å²	132	63.6 Å²	63.6	71%	0.706	37%	0.367	S	S	*	.			trans	-83.6	79.4	-180	-161.8	32.9	0	0	0	111
257	V	71.6	Confident	75.9	Confident	8 Å²	8	63.9 Å²	63.9	5%	0.048	36%	0.364	C	S	.	.			trans	-94.6	139.7	-177.5	179.7	0	0	0	0	110.8	L224 L251 A255 Q261 Q262 I265	L224-V257 HydrophobicContact CD1-CG2 4.32Å; L224-V257 HydrophobicContact CD2-CG2 4.46Å; L251-V257 HydrophobicContact CD2-CG2 4.39Å; A255-V257 HydrophobicContact CB-CG2 4.2Å; A255-V257 PolarHBondContact O-N 2.96Å; V257-Q261 HydrophobicContact CG1-CB 3.57Å; V257-Q262 HydrophobicContact CB-CG 4.13Å; V257-Q262 HydrophobicContact CG1-CG 4.1Å; V257-Q262 PolarHBondContact O-NE2 3.38Å; V257-I265 HydrophobicContact CG1-CD1 3.97Å
258	P	77.4	Confident	76.4	Confident	81 Å²	81	60.7 Å²	60.7	53%	0.526	35%	0.347	S	S	.	.			trans	-57.5	141.3	173.9	-24.1	33.2	0	0	0	113.6	G260 Q261 Q262	P258-G260 VanDerWaalsContact C-N 3.27Å; P258-G260 PolarHBondContact O-N 3.21Å; P258-G260 VanDerWaalsContact O-N 3.13Å; P258-Q261 WeakPolarHBondContact O-CA 3.25Å; P258-Q261 WeakPolarHBondContact O-CB 3.38Å; P258-Q261 PolarHBondContact O-N 3.37Å; P258-Q262 PolarHBondContact O-N 3.17Å
259	V	74.9	Confident	76.8	Confident	114 Å²	114	59.3 Å²	59.3	69%	0.691	34%	0.337	S	S	*	.	H	α-helix	trans	-55.8	-35.9	-174.1	-171.6	0	0	0	0	113.6	Q262 D263	V259-Q262 WeakPolarHBondContact O-CB 3.1Å; V259-Q262 PolarHBondContact O-N 3.31Å; V259-D263 PolarHBondContact O-N 2.98Å; V259-D263 VanDerWaalsContact O-N 3.13Å
260	G	75.4	Confident	77	Confident	56 Å²	56	61.7 Å²	61.7	58%	0.577	35%	0.349	S	S	*	.	H	α-helix	trans	-69.2	-31	175.4	0	0	0	0	0	114.4	P258 S264	P258-G260 VanDerWaalsContact C-N 3.27Å; P258-G260 PolarHBondContact O-N 3.21Å; P258-G260 VanDerWaalsContact O-N 3.13Å; G260-S264 PolarHBondContact O-N 3.48Å; G260-S264 PolarHBondContact O-OG 2.96Å
261	Q	80.7	Confident	77.6	Confident	57 Å²	57	57.5 Å²	57.5	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-75.3	-32.6	170	-76.5	-178.5	-14.5	0	0	111	V257 P258 S264 I265 I384	V257-Q261 HydrophobicContact CG1-CB 3.57Å; P258-Q261 WeakPolarHBondContact O-CA 3.25Å; P258-Q261 WeakPolarHBondContact O-CB 3.38Å; P258-Q261 PolarHBondContact O-N 3.37Å; Q261-S264 WeakPolarHBondContact O-CB 3.1Å; Q261-S264 PolarHBondContact O-N 3.26Å; Q261-I265 WeakPolarHBondContact O-CB 3.34Å; Q261-I265 WeakPolarHBondContact O-CD1 3.45Å; Q261-I265 WeakPolarHBondContact O-CG1 3.4Å; Q261-I265 PolarHBondContact O-N 3.44Å; Q261-I384 HydrophobicContact CG-CD1 4.39Å
262	Q	82.1	Confident	78.3	Confident	65 Å²	65	55.9 Å²	55.9	30%	0.304	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-47.5	174.4	-62.7	179.2	8.9	0	0	112.1	L251 V257 P258 V259 S264 I265 H266	L251-Q262 HydrophobicContact CD1-CB 4.29Å; L251-Q262 HydrophobicContact CD1-CG 3.96Å; V257-Q262 HydrophobicContact CB-CG 4.13Å; V257-Q262 HydrophobicContact CG1-CG 4.1Å; V257-Q262 PolarHBondContact O-NE2 3.38Å; P258-Q262 PolarHBondContact O-N 3.17Å; V259-Q262 WeakPolarHBondContact O-CB 3.1Å; V259-Q262 PolarHBondContact O-N 3.31Å; Q262-S264 PolarHBondContact O-N 3.14Å; Q262-I265 PolarHBondContact O-N 2.72Å; Q262-H266 PolarHBondContact O-CD2 3.09Å; Q262-H266 PolarHBondContact O-N 3.4Å
263	D	83.8	Confident	79.1	Confident	76 Å²	76	57.1 Å²	57.1	41%	0.406	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-44.6	175.3	179.2	21.3	0	0	0	111.5	V259 I265 H266 R267	V259-D263 PolarHBondContact O-N 2.98Å; V259-D263 VanDerWaalsContact O-N 3.13Å; D263-I265 VanDerWaalsContact C-N 3.32Å; D263-I265 PolarHBondContact O-N 3.2Å; D263-H266 PolarHBondContact O-N 2.85Å; D263-H266 VanDerWaalsContact O-N 3.16Å; D263-R267 VanDerWaalsContact CG-NE 3.35Å; D263-R267 WeakPolarHBondContact O-CG 2.95Å; D263-R267 PolarHBondContact O-N 3.2Å; D263-R267 IonicContact OD1-CZ 3.52Å; D263-R267 IonicContact OD1-NE 3.67Å; D263-R267 PolarHBondContact OD1-NE 3.23Å; D263-R267 IonicContact OD1-NH2 3.46Å; D263-R267 IonicContact OD2-CZ 3.94Å; D263-R267 IonicContact OD2-NE 3.86Å; D263-R267 PolarHBondContact OD2-NE 3.17Å; D263-R267 IonicContact OD2-NH2 3.41Å; D263-R267 PolarHBondContact OD2-NH2 2.95Å
264	S	84.4	Confident	80.4	Confident	23 Å²	23	51.1 Å²	51.1	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-56.8	-44.6	174.5	-58.7	0	0	0	0	112.3	G260 Q261 Q262 R267 I268	G260-S264 PolarHBondContact O-N 3.48Å; G260-S264 PolarHBondContact O-OG 2.96Å; Q261-S264 WeakPolarHBondContact O-CB 3.1Å; Q261-S264 PolarHBondContact O-N 3.26Å; Q262-S264 PolarHBondContact O-N 3.14Å; S264-R267 PolarHBondContact O-N 3.35Å; S264-I268 WeakPolarHBondContact O-CD1 3.27Å; S264-I268 WeakPolarHBondContact O-CG1 3Å; S264-I268 PolarHBondContact O-N 3.33Å
265	I	85.7	Confident	81.9	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-45.9	175.4	-73.1	159.8	0	0	0	110.6	L224 L228 I240 L251 V257 Q261 Q262 D263 R267 I268 A269	L224-I265 HydrophobicContact CD2-CD1 4.15Å; L228-I265 HydrophobicContact CD1-CG1 4.16Å; L228-I265 HydrophobicContact CD2-CB 4.37Å; L228-I265 HydrophobicContact CD2-CG1 4.15Å; L228-I265 HydrophobicContact CD2-CG2 4.14Å; I240-I265 HydrophobicContact CD1-CG2 3.89Å; I240-I265 HydrophobicContact CG1-CG2 4.4Å; L251-I265 HydrophobicContact CD1-CB 4.36Å; L251-I265 HydrophobicContact CD1-CD1 4Å; L251-I265 HydrophobicContact CD1-CG2 3.95Å; L251-I265 HydrophobicContact CD2-CD1 4.21Å; L251-I265 HydrophobicContact CD2-CG2 4.26Å; L251-I265 HydrophobicContact CG-CG2 4.01Å; V257-I265 HydrophobicContact CG1-CD1 3.97Å; Q261-I265 WeakPolarHBondContact O-CB 3.34Å; Q261-I265 WeakPolarHBondContact O-CD1 3.45Å; Q261-I265 WeakPolarHBondContact O-CG1 3.4Å; Q261-I265 PolarHBondContact O-N 3.44Å; Q262-I265 PolarHBondContact O-N 2.72Å; D263-I265 VanDerWaalsContact C-N 3.32Å; D263-I265 PolarHBondContact O-N 3.2Å; I265-R267 VanDerWaalsContact C-N 3.33Å; I265-R267 PolarHBondContact O-N 2.72Å; I265-I268 PolarHBondContact O-N 3.05Å; I265-A269 WeakPolarHBondContact O-CB 3.41Å; I265-A269 PolarHBondContact O-N 2.99Å
266	H	84.9	Confident	83.2	Confident	86 Å²	86	46.8 Å²	46.8	40%	0.398	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-38.2	178.7	-76.7	-59.2	0	0	0	112.9	Q262 D263 A269 E270	Q262-H266 PolarHBondContact O-CD2 3.09Å; Q262-H266 PolarHBondContact O-N 3.4Å; D263-H266 PolarHBondContact O-N 2.85Å; D263-H266 VanDerWaalsContact O-N 3.16Å; H266-A269 PolarHBondContact O-N 3.28Å; H266-E270 PolarHBondContact O-N 3.44Å
267	R	84.9	Confident	84.3	Confident	109 Å²	109	41.7 Å²	41.7	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-66.3	-38	175.7	-66.8	169.8	-169.6	-149.3	6.3	113.1	D263 S264 I265 E270 R395	D263-R267 VanDerWaalsContact CG-NE 3.35Å; D263-R267 WeakPolarHBondContact O-CG 2.95Å; D263-R267 PolarHBondContact O-N 3.2Å; D263-R267 IonicContact OD1-CZ 3.52Å; D263-R267 IonicContact OD1-NE 3.67Å; D263-R267 PolarHBondContact OD1-NE 3.23Å; D263-R267 IonicContact OD1-NH2 3.46Å; D263-R267 IonicContact OD2-CZ 3.94Å; D263-R267 IonicContact OD2-NE 3.86Å; D263-R267 PolarHBondContact OD2-NE 3.17Å; D263-R267 IonicContact OD2-NH2 3.41Å; D263-R267 PolarHBondContact OD2-NH2 2.95Å; S264-R267 PolarHBondContact O-N 3.35Å; I265-R267 VanDerWaalsContact C-N 3.33Å; I265-R267 PolarHBondContact O-N 2.72Å; R267-E270 WeakPolarHBondContact O-CB 3.49Å; R267-R395 WeakPolarHBondContact O-CD 3.18Å
268	I	87	Confident	85.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-73.4	-37.7	175.4	-65.3	161.6	0	0	0	110.3	L228 L232 S264 I265 E270 C271 G272 L387 V388	L228-I268 HydrophobicContact CB-CG2 4.3Å; L228-I268 HydrophobicContact CD1-CD1 4.18Å; L228-I268 HydrophobicContact CD2-CB 3.97Å; L228-I268 HydrophobicContact CD2-CD1 4.32Å; L228-I268 HydrophobicContact CD2-CG2 3.72Å; L232-I268 HydrophobicContact CD1-CG2 4.34Å; L232-I268 HydrophobicContact CD2-CG2 3.99Å; L232-I268 HydrophobicContact CG-CG2 4.03Å; S264-I268 WeakPolarHBondContact O-CD1 3.27Å; S264-I268 WeakPolarHBondContact O-CG1 3Å; S264-I268 PolarHBondContact O-N 3.33Å; I265-I268 PolarHBondContact O-N 3.05Å; I268-E270 VanDerWaalsContact C-N 3.31Å; I268-E270 PolarHBondContact O-N 3.38Å; I268-C271 VanDerWaalsContact O-CB 3.28Å; I268-C271 WeakPolarHBondContact O-CB 3.49Å; I268-C271 PolarHBondContact O-N 3.32Å; I268-C271 VanDerWaalsContact O-N 3.12Å; I268-G272 PolarHBondContact O-N 2.96Å; I268-L387 HydrophobicContact CD1-CB 4.17Å; I268-L387 HydrophobicContact CD1-CD2 3.89Å; I268-L387 HydrophobicContact CD1-CG 3.81Å; I268-L387 HydrophobicContact CG1-CG 4.45Å; I268-V388 HydrophobicContact CD1-CG2 3.77Å; I268-V388 HydrophobicContact CG1-CG2 4.09Å
269	A	86.4	Confident	85.9	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.033	21%	0.214	C	C	.	.	H	α-helix	trans	-65.2	-31	177.2	0	0	0	0	0	113	V231 F249 I265 H266 C271 G272 W273	V231-A269 HydrophobicContact CG1-CB 4.27Å; F249-A269 HydrophobicContact CB-CB 3.8Å; I265-A269 WeakPolarHBondContact O-CB 3.41Å; I265-A269 PolarHBondContact O-N 2.99Å; H266-A269 PolarHBondContact O-N 3.28Å; A269-C271 VanDerWaalsContact C-N 3.31Å; A269-C271 PolarHBondContact O-N 3.34Å; A269-G272 PolarHBondContact O-N 3.42Å; A269-W273 PolarHBondContact O-N 2.97Å; A269-W273 VanDerWaalsContact O-N 3.09Å
270	E	87	Confident	86.6	Confident	54 Å²	54	39.8 Å²	39.8	25%	0.252	20%	0.2	S	C	.	.	H	α-helix	trans	-57	-42.5	169.4	-168.9	-172.1	172	0	0	111.4	H266 R267 I268 G272 W273 L274 R395	H266-E270 PolarHBondContact O-N 3.44Å; R267-E270 WeakPolarHBondContact O-CB 3.49Å; I268-E270 VanDerWaalsContact C-N 3.31Å; I268-E270 PolarHBondContact O-N 3.38Å; E270-G272 PolarHBondContact O-N 3.42Å; E270-W273 PolarHBondContact O-N 3.13Å; E270-L274 HydrophobicContact CG-CD1 4.11Å; E270-L274 HydrophobicContact CG-CG 4.47Å; E270-L274 VanDerWaalsContact O-CG 3.3Å; E270-L274 WeakPolarHBondContact O-CG 3.46Å; E270-L274 PolarHBondContact O-N 3.23Å; E270-R395 IonicContact OE1-NH1 3.32Å; E270-R395 WeakPolarHBondContact OE2-CD 3.41Å; E270-R395 IonicContact OE2-CZ 3.3Å; E270-R395 IonicContact OE2-NE 3.54Å; E270-R395 IonicContact OE2-NH1 2.71Å; E270-R395 PolarHBondContact OE2-NH1 3.48Å
271	C	88.2	Confident	87.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-43.9	177.1	-58.2	0	0	0	0	112.1	L232 I268 A269 W273 L274 H275 R395 L398	L232-C271 HydrophobicContact CD2-CB 3.71Å; I268-C271 VanDerWaalsContact O-CB 3.28Å; I268-C271 WeakPolarHBondContact O-CB 3.49Å; I268-C271 PolarHBondContact O-N 3.32Å; I268-C271 VanDerWaalsContact O-N 3.12Å; A269-C271 VanDerWaalsContact C-N 3.31Å; A269-C271 PolarHBondContact O-N 3.34Å; C271-W273 VanDerWaalsContact C-N 3.31Å; C271-W273 PolarHBondContact O-N 3.48Å; C271-L274 PolarHBondContact O-N 3.22Å; C271-H275 VanDerWaalsContact O-CB 3.27Å; C271-H275 WeakPolarHBondContact O-CB 3.29Å; C271-H275 PolarHBondContact O-N 2.96Å; C271-R395 VanDerWaalsContact SG-CB 3.51Å; C271-R395 VanDerWaalsContact SG-CG 3.59Å; C271-L398 HydrophobicContact CB-CD1 4.45Å
272	G	87.3	Confident	87.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.9	-35.4	176.4	0	0	0	0	0	113.4	V231 I268 A269 E270 N276	V231-G272 WeakPolarHBondContact O-CA 3.26Å; I268-G272 PolarHBondContact O-N 2.96Å; A269-G272 PolarHBondContact O-N 3.42Å; E270-G272 PolarHBondContact O-N 3.42Å; G272-N276 PolarHBondContact O-N 3.1Å; G272-N276 VanDerWaalsContact O-N 3.09Å
273	W	89.5	Confident	87.9	Confident	65 Å²	65	35.9 Å²	35.9	25%	0.246	17%	0.173	C	C	.	.	H	α-helix	trans	-69.5	-48.9	173.9	172.7	69.5	0	0	0	112.4	D247 F249 A269 E270 C271 H275 N276 Q277	D247-W273 VanDerWaalsContact O-CD1 3.25Å; D247-W273 PolarHBondContact O-NE1 3.29Å; D247-W273 VanDerWaalsContact O-NE1 3.09Å; D247-W273 PolarHBondContact OD1-NE1 3.37Å; D247-W273 PolarHBondContact OD2-NE1 3.35Å; D247-W273 VanDerWaalsContact OD2-NE1 3.12Å; F249-W273 HydrophobicContact CD2-CB 4.22Å; F249-W273 HydrophobicContact CE2-CB 4.45Å; A269-W273 PolarHBondContact O-N 2.97Å; A269-W273 VanDerWaalsContact O-N 3.09Å; E270-W273 PolarHBondContact O-N 3.13Å; C271-W273 VanDerWaalsContact C-N 3.31Å; C271-W273 PolarHBondContact O-N 3.48Å; W273-H275 VanDerWaalsContact C-N 3.28Å; W273-H275 PolarHBondContact O-N 2.92Å; W273-N276 PolarHBondContact O-N 3.24Å; W273-N276 VanDerWaalsContact O-N 3.1Å; W273-Q277 HydrophobicContact CZ2-CG 4.42Å; W273-Q277 PolarHBondContact O-N 3.48Å
274	L	91	Very high	88.1	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-41.1	176	-67.2	168.1	0	0	0	111.4	E270 C271 Q277 I278 R395 L398 R399 A402	E270-L274 HydrophobicContact CG-CD1 4.11Å; E270-L274 HydrophobicContact CG-CG 4.47Å; E270-L274 VanDerWaalsContact O-CG 3.3Å; E270-L274 WeakPolarHBondContact O-CG 3.46Å; E270-L274 PolarHBondContact O-N 3.23Å; C271-L274 PolarHBondContact O-N 3.22Å; L274-Q277 PolarHBondContact O-N 3.43Å; L274-I278 WeakPolarHBondContact O-CG1 3.35Å; L274-I278 PolarHBondContact O-N 3.43Å; L274-I278 VanDerWaalsContact O-N 3.09Å; L274-R395 HydrophobicContact CD1-CG 4.47Å; L274-L398 HydrophobicContact CB-CB 3.91Å; L274-L398 HydrophobicContact CD1-CB 4.1Å; L274-R399 HydrophobicContact CD1-CB 3.99Å; L274-A402 HydrophobicContact CD2-CB 3.68Å
275	H	91	Very high	88.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.6	-49.9	172.6	178.5	74.3	0	0	0	111.6	C271 W273 Q277 I278 K279 Y309 Y310	C271-H275 VanDerWaalsContact O-CB 3.27Å; C271-H275 WeakPolarHBondContact O-CB 3.29Å; C271-H275 PolarHBondContact O-N 2.96Å; W273-H275 VanDerWaalsContact C-N 3.28Å; W273-H275 PolarHBondContact O-N 2.92Å; H275-Q277 VanDerWaalsContact C-N 3.33Å; H275-Q277 PolarHBondContact O-N 3.18Å; H275-I278 PolarHBondContact O-N 3.24Å; H275-K279 WeakPolarHBondContact NE2-CD 3.3Å; H275-K279 PolarHBondContact NE2-NZ 3.35Å; H275-K279 WeakPolarHBondContact O-CB 3.34Å; H275-K279 PolarHBondContact O-N 3.36Å; H275-Y309 HydrophobicContact CB-CE1 4.14Å; H275-Y309 AromaticContact CG-CE1 3.84Å; H275-Y309 AromaticContact ND1-CD1 3.49Å; H275-Y309 WeakPolarHBondContact ND1-CD1 3.04Å; H275-Y309 AromaticContact ND1-CE1 3.43Å; H275-Y309 WeakPolarHBondContact ND1-CE1 3.37Å; H275-Y310 AromaticContact CE1-CE1 3.24Å; H275-Y310 WeakPolarHBondContact CE1-CE1 3.36Å; H275-Y310 AromaticContact CE1-CZ 3.44Å; H275-Y310 VanDerWaalsContact CE1-CZ 3.44Å; H275-Y310 PolarHBondContact CE1-OH 3.23Å; H275-Y310 VanDerWaalsContact CE1-OH 3.27Å; H275-Y310 AromaticContact NE2-CE1 3.6Å; H275-Y310 AromaticContact NE2-CZ 3.86Å; H275-Y310 PolarHBondContact NE2-OH 3.32Å
276	N	89.3	Confident	88.1	Confident	47 Å²	47	46.6 Å²	46.6	25%	0.251	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-36.5	177.9	-85.9	-16	0	0	0	112.9	G234 G272 W273 Q280	G234-N276 WeakPolarHBondContact CA-ND2 3.38Å; G234-N276 WeakPolarHBondContact CA-OD1 3.3Å; G234-N276 PolarHBondContact O-ND2 2.9Å; G272-N276 PolarHBondContact O-N 3.1Å; G272-N276 VanDerWaalsContact O-N 3.09Å; W273-N276 PolarHBondContact O-N 3.24Å; W273-N276 VanDerWaalsContact O-N 3.1Å; N276-Q280 VanDerWaalsContact O-CB 3.23Å; N276-Q280 WeakPolarHBondContact O-CB 3.46Å; N276-Q280 PolarHBondContact O-N 3.05Å
277	Q	88.2	Confident	88.2	Confident	25 Å²	25	48.6 Å²	48.6	12%	0.117	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-49.6	174.7	-72.7	-151.8	82.6	0	0	112.8	W273 L274 H275 K279 Q280 F281	W273-Q277 HydrophobicContact CZ2-CG 4.42Å; W273-Q277 PolarHBondContact O-N 3.48Å; L274-Q277 PolarHBondContact O-N 3.43Å; H275-Q277 VanDerWaalsContact C-N 3.33Å; H275-Q277 PolarHBondContact O-N 3.18Å; Q277-K279 VanDerWaalsContact C-N 3.34Å; Q277-K279 PolarHBondContact O-N 2.84Å; Q277-Q280 WeakPolarHBondContact O-CB 3.32Å; Q277-Q280 PolarHBondContact O-N 2.89Å; Q277-F281 PolarHBondContact O-N 3.27Å
278	I	91.3	Very high	88.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-40.8	-179.9	-59.6	162.1	0	0	0	110.1	L274 H275 Q280 F281 V282 L302 L306 L398 L401 A402	L274-I278 WeakPolarHBondContact O-CG1 3.35Å; L274-I278 PolarHBondContact O-N 3.43Å; L274-I278 VanDerWaalsContact O-N 3.09Å; H275-I278 PolarHBondContact O-N 3.24Å; I278-Q280 VanDerWaalsContact C-N 3.32Å; I278-Q280 PolarHBondContact O-N 3.3Å; I278-F281 WeakPolarHBondContact O-CB 3.46Å; I278-F281 PolarHBondContact O-N 3.47Å; I278-F281 VanDerWaalsContact O-N 3.14Å; I278-V282 HydrophobicContact CG2-CG2 4.37Å; I278-V282 WeakPolarHBondContact O-CG2 3.48Å; I278-V282 PolarHBondContact O-N 3.48Å; I278-L302 HydrophobicContact CG2-CB 4.42Å; I278-L306 HydrophobicContact CB-CD2 4.35Å; I278-L306 HydrophobicContact CG2-CD1 3.92Å; I278-L306 HydrophobicContact CG2-CD2 4.13Å; I278-L306 HydrophobicContact CG2-CG 4.05Å; I278-L398 HydrophobicContact CD1-CB 4.4Å; I278-L398 HydrophobicContact CD1-CD2 3.65Å; I278-L401 HydrophobicContact CD1-CB 3.64Å; I278-L401 HydrophobicContact CG1-CB 4.4Å; I278-A402 HydrophobicContact CG1-CB 4.31Å
279	K	91.4	Very high	87.7	Confident	80 Å²	80	56.9 Å²	56.9	35%	0.348	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-36	174	-173	169.2	-177.7	170.1	0	112.5	H275 Q277 S283	H275-K279 WeakPolarHBondContact NE2-CD 3.3Å; H275-K279 PolarHBondContact NE2-NZ 3.35Å; H275-K279 WeakPolarHBondContact O-CB 3.34Å; H275-K279 PolarHBondContact O-N 3.36Å; Q277-K279 VanDerWaalsContact C-N 3.34Å; Q277-K279 PolarHBondContact O-N 2.84Å; K279-S283 VanDerWaalsContact O-CB 3.3Å; K279-S283 WeakPolarHBondContact O-CB 3.37Å; K279-S283 PolarHBondContact O-N 2.87Å; K279-S283 PolarHBondContact O-OG 2.94Å
280	Q	89.1	Confident	87.4	Confident	84 Å²	84	59 Å²	59	39%	0.393	27%	0.27	S	S	.	.	H	α-helix	trans	-67.1	-39.3	172.1	-172.4	-176.6	85.9	0	0	111.6	N276 Q277 I278 S283 R284	N276-Q280 VanDerWaalsContact O-CB 3.23Å; N276-Q280 WeakPolarHBondContact O-CB 3.46Å; N276-Q280 PolarHBondContact O-N 3.05Å; Q277-Q280 WeakPolarHBondContact O-CB 3.32Å; Q277-Q280 PolarHBondContact O-N 2.89Å; I278-Q280 VanDerWaalsContact C-N 3.32Å; I278-Q280 PolarHBondContact O-N 3.3Å; Q280-S283 WeakPolarHBondContact CA-OG 3.44Å; Q280-S283 PolarHBondContact O-OG 2.95Å; Q280-R284 VanDerWaalsContact CD-CZ 3.44Å; Q280-R284 WeakPolarHBondContact O-CB 3.48Å; Q280-R284 VanDerWaalsContact O-CG 3.25Å; Q280-R284 WeakPolarHBondContact O-CG 3.49Å; Q280-R284 PolarHBondContact O-N 3.24Å
281	F	88.1	Confident	86.8	Confident	25 Å²	25	56.7 Å²	56.7	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-50.9	174.3	-175.5	-87.6	0	0	0	111.8	Q277 I278 S283 R284 A285 F298 L302 C405 C408	Q277-F281 PolarHBondContact O-N 3.27Å; I278-F281 WeakPolarHBondContact O-CB 3.46Å; I278-F281 PolarHBondContact O-N 3.47Å; I278-F281 VanDerWaalsContact O-N 3.14Å; F281-S283 PolarHBondContact O-N 3.48Å; F281-R284 PolarHBondContact O-N 3.23Å; F281-A285 WeakPolarHBondContact O-CB 3.23Å; F281-A285 PolarHBondContact O-N 3.2Å; F281-F298 AromaticContact CE1-CD1 3.76Å; F281-F298 HydrophobicContact CE1-CD1 3.76Å; F281-F298 AromaticContact CE1-CE1 3.58Å; F281-F298 HydrophobicContact CE1-CE1 3.58Å; F281-F298 HydrophobicContact CZ-CD1 4.08Å; F281-F298 AromaticContact CZ-CE1 3.8Å; F281-F298 HydrophobicContact CZ-CE1 3.8Å; F281-L302 HydrophobicContact CD1-CD1 3.66Å; F281-L302 HydrophobicContact CE1-CD1 3.83Å; F281-C405 HydrophobicContact CB-CB 4.23Å; F281-C405 HydrophobicContact CD2-CB 4.07Å; F281-C405 HydrophobicContact CG-CB 4.03Å; F281-C408 HydrophobicContact CE2-CB 4.4Å; F281-C408 HydrophobicContact CZ-CB 4.21Å
282	V	89.7	Confident	86.6	Confident	19 Å²	19	56.8 Å²	56.8	12%	0.115	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-40.9	179.6	172.5	0	0	0	0	111.6	I278 A285 R286 L302 H303 L306	I278-V282 HydrophobicContact CG2-CG2 4.37Å; I278-V282 WeakPolarHBondContact O-CG2 3.48Å; I278-V282 PolarHBondContact O-N 3.48Å; V282-A285 PolarHBondContact O-N 2.74Å; V282-R286 VanDerWaalsContact O-CB 3.31Å; V282-R286 WeakPolarHBondContact O-CB 3.26Å; V282-R286 PolarHBondContact O-N 3.04Å; V282-L302 HydrophobicContact CG2-CB 3.77Å; V282-L302 HydrophobicContact CG2-CD1 4.26Å; V282-H303 HydrophobicContact CG1-CB 4.35Å; V282-L306 HydrophobicContact CG2-CD1 4.46Å
283	S	88.4	Confident	86.5	Confident	52 Å²	52	59.2 Å²	59.2	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-69.9	-37.1	176.1	55.1	0	0	0	0	113.1	K279 Q280 F281 N287	K279-S283 VanDerWaalsContact O-CB 3.3Å; K279-S283 WeakPolarHBondContact O-CB 3.37Å; K279-S283 PolarHBondContact O-N 2.87Å; K279-S283 PolarHBondContact O-OG 2.94Å; Q280-S283 WeakPolarHBondContact CA-OG 3.44Å; Q280-S283 PolarHBondContact O-OG 2.95Å; F281-S283 PolarHBondContact O-N 3.48Å; S283-N287 VanDerWaalsContact O-CB 3.25Å; S283-N287 WeakPolarHBondContact O-CB 3.2Å; S283-N287 PolarHBondContact O-N 2.75Å; S283-N287 PolarHBondContact O-ND2 2.72Å
284	R	87.9	Confident	86.5	Confident	133 Å²	133	56.1 Å²	56.1	50%	0.502	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-49.9	170.3	-79	174.5	178.3	143.4	5.1	111.4	Q280 F281 R286 N287 D288	Q280-R284 VanDerWaalsContact CD-CZ 3.44Å; Q280-R284 WeakPolarHBondContact O-CB 3.48Å; Q280-R284 VanDerWaalsContact O-CG 3.25Å; Q280-R284 WeakPolarHBondContact O-CG 3.49Å; Q280-R284 PolarHBondContact O-N 3.24Å; F281-R284 PolarHBondContact O-N 3.23Å; R284-R286 PolarHBondContact O-N 2.8Å; R284-N287 PolarHBondContact O-N 2.75Å; R284-D288 WeakPolarHBondContact O-CB 3.3Å; R284-D288 PolarHBondContact O-N 2.79Å
285	A	85.5	Confident	86.4	Confident	6 Å²	6	56.5 Å²	56.5	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-48.3	178.2	0	0	0	0	0	111.7	F281 V282 N287 D288 V295 Q296 A299	F281-A285 WeakPolarHBondContact O-CB 3.23Å; F281-A285 PolarHBondContact O-N 3.2Å; V282-A285 PolarHBondContact O-N 2.74Å; A285-N287 VanDerWaalsContact C-N 3.32Å; A285-N287 PolarHBondContact O-N 3.39Å; A285-D288 PolarHBondContact O-N 2.65Å; A285-V295 HydrophobicContact CB-CG1 3.98Å; A285-Q296 PolarHBondContact O-NE2 3.12Å; A285-A299 HydrophobicContact CB-CB 3.72Å
286	R	84.9	Confident	86.4	Confident	186 Å²	186	59.7 Å²	59.7	70%	0.702	28%	0.281	S	S	*	.	H	α-helix	trans	-65.7	-30.9	179.7	-173.4	173.7	178.3	172.3	0.4	113.7	V282 R284	V282-R286 VanDerWaalsContact O-CB 3.31Å; V282-R286 WeakPolarHBondContact O-CB 3.26Å; V282-R286 PolarHBondContact O-N 3.04Å; R284-R286 PolarHBondContact O-N 2.8Å
287	N	85.7	Confident	86.3	Confident	128 Å²	128	58.2 Å²	58.2	68%	0.684	28%	0.275	S	S	*	.	H	α-helix	trans	-84.4	-31.8	179.3	-69.7	-17.6	0	0	0	112.8	S283 R284 A285 R289	S283-N287 VanDerWaalsContact O-CB 3.25Å; S283-N287 WeakPolarHBondContact O-CB 3.2Å; S283-N287 PolarHBondContact O-N 2.75Å; S283-N287 PolarHBondContact O-ND2 2.72Å; R284-N287 PolarHBondContact O-N 2.75Å; A285-N287 VanDerWaalsContact C-N 3.32Å; A285-N287 PolarHBondContact O-N 3.39Å; N287-R289 PolarHBondContact O-N 3.04Å; N287-R289 VanDerWaalsContact O-N 3.13Å
288	D	83.7	Confident	86.5	Confident	62 Å²	62	57 Å²	57	33%	0.332	27%	0.269	S	S	.	.			trans	-76.9	97	176.1	-178.8	14.8	0	0	0	110.8	R284 A285 S290 A291 R412	R284-D288 WeakPolarHBondContact O-CB 3.3Å; R284-D288 PolarHBondContact O-N 2.79Å; A285-D288 PolarHBondContact O-N 2.65Å; D288-S290 VanDerWaalsContact CG-OG 3.31Å; D288-S290 PolarHBondContact O-N 3.03Å; D288-S290 VanDerWaalsContact O-N 3.12Å; D288-S290 WeakPolarHBondContact OD1-CA 3.36Å; D288-S290 VanDerWaalsContact OD1-CB 3.3Å; D288-S290 WeakPolarHBondContact OD1-CB 3.43Å; D288-S290 PolarHBondContact OD1-N 2.91Å; D288-S290 PolarHBondContact OD1-OG 3.36Å; D288-S290 PolarHBondContact OD2-OG 3.46Å; D288-A291 HydrophobicContact CB-CB 4.05Å; D288-A291 VanDerWaalsContact O-CB 3.22Å; D288-A291 WeakPolarHBondContact O-CB 3.34Å; D288-A291 PolarHBondContact O-N 3.36Å; D288-A291 PolarHBondContact OD2-N 3.4Å; D288-R412 IonicContact OD2-NH2 3.87Å; D288-R412 PolarHBondContact OD2-NH2 3.22Å; D288-R412 VanDerWaalsContact OD2-NH2 3.07Å
289	R	78.3	Confident	86.5	Confident	220 Å²	220	57.2 Å²	57.2	83%	0.83	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.3	172.8	-63.8	-176.4	-177.9	-178.1	0.2	113	N287 Y463	N287-R289 PolarHBondContact O-N 3.04Å; N287-R289 VanDerWaalsContact O-N 3.13Å; R289-Y463 WeakPolarHBondContact O-CE1 3.38Å; R289-Y463 PolarHBondContact O-OH 3.39Å
290	S	79.7	Confident	86.4	Confident	50 Å²	50	57 Å²	57	35%	0.35	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.1	178.7	80.5	0	0	0	0	114.1	D288 G292 R412	D288-S290 VanDerWaalsContact CG-OG 3.31Å; D288-S290 PolarHBondContact O-N 3.03Å; D288-S290 VanDerWaalsContact O-N 3.12Å; D288-S290 WeakPolarHBondContact OD1-CA 3.36Å; D288-S290 VanDerWaalsContact OD1-CB 3.3Å; D288-S290 WeakPolarHBondContact OD1-CB 3.43Å; D288-S290 PolarHBondContact OD1-N 2.91Å; D288-S290 PolarHBondContact OD1-OG 3.36Å; D288-S290 PolarHBondContact OD2-OG 3.46Å; S290-G292 PolarHBondContact O-N 3.48Å; S290-R412 PolarHBondContact O-NH1 2.86Å; S290-R412 PolarHBondContact O-NH2 3.37Å; S290-R412 PolarHBondContact OG-NH2 3.23Å
291	A	75.2	Confident	86.5	Confident	5 Å²	5	53 Å²	53	4%	0.041	26%	0.26	C	S	.	.	S	Bend	trans	-64	-25.4	-175.5	0	0	0	0	0	113.4	D288 V295	D288-A291 HydrophobicContact CB-CB 4.05Å; D288-A291 VanDerWaalsContact O-CB 3.22Å; D288-A291 WeakPolarHBondContact O-CB 3.34Å; D288-A291 PolarHBondContact O-N 3.36Å; D288-A291 PolarHBondContact OD2-N 3.4Å; A291-V295 HydrophobicContact CB-CB 4.06Å; A291-V295 HydrophobicContact CB-CG1 3.95Å; A291-V295 WeakPolarHBondContact O-CB 3.26Å; A291-V295 WeakPolarHBondContact O-CG2 3.5Å
292	G	82.7	Confident	86.7	Confident	2 Å²	2	51.8 Å²	51.8	2%	0.021	26%	0.255	C	S	.	.			trans	92.2	156.4	-177	0	0	0	0	0	113.9	S290 I294 V295 Q296 E465	S290-G292 PolarHBondContact O-N 3.48Å; G292-I294 VanDerWaalsContact C-N 3.29Å; G292-I294 PolarHBondContact O-N 3.29Å; G292-V295 PolarHBondContact O-N 2.88Å; G292-Q296 WeakPolarHBondContact O-CG 3.17Å; G292-Q296 PolarHBondContact O-N 2.82Å; G292-Q296 VanDerWaalsContact O-N 3.1Å; G292-E465 VanDerWaalsContact C-OE1 3.25Å; G292-E465 VanDerWaalsContact C-OE2 3.32Å; G292-E465 VanDerWaalsContact CA-OE1 3.27Å; G292-E465 WeakPolarHBondContact CA-OE1 3.24Å; G292-E465 WeakPolarHBondContact CA-OE2 3.39Å
293	T	86.1	Confident	86.8	Confident	51 Å²	51	54.7 Å²	54.7	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-65.6	-32.4	-177.5	70.1	0	0	0	0	112.2	Q296 S297 F449 E465	T293-Q296 PolarHBondContact O-N 3.49Å; T293-S297 PolarHBondContact O-N 2.97Å; T293-S297 PolarHBondContact O-OG 3.38Å; T293-F449 HydrophobicContact CG2-CZ 4.14Å; T293-F449 VanDerWaalsContact OG1-CE2 3.23Å; T293-F449 WeakPolarHBondContact OG1-CE2 3.4Å; T293-F449 WeakPolarHBondContact OG1-CZ 3.37Å; T293-E465 VanDerWaalsContact N-CD 3.32Å; T293-E465 PolarHBondContact N-OE1 2.95Å; T293-E465 PolarHBondContact N-OE2 2.77Å; T293-E465 PolarHBondContact OG1-OE2 2.76Å
294	I	89.3	Confident	87	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-71.1	-40.8	-178.1	-55.7	-174.3	0	0	0	109.4	G292 Q296 S297 F298 L416 I442 L446 F449 E465	G292-I294 VanDerWaalsContact C-N 3.29Å; G292-I294 PolarHBondContact O-N 3.29Å; I294-Q296 VanDerWaalsContact C-N 3.33Å; I294-Q296 PolarHBondContact O-N 3.1Å; I294-S297 WeakPolarHBondContact CA-OG 3.15Å; I294-S297 PolarHBondContact O-N 2.9Å; I294-S297 PolarHBondContact O-OG 2.86Å; I294-F298 WeakPolarHBondContact O-CB 3.23Å; I294-F298 PolarHBondContact O-N 3.38Å; I294-L416 HydrophobicContact CG2-CD2 4.34Å; I294-I442 HydrophobicContact CG2-CB 4.49Å; I294-I442 HydrophobicContact CG2-CG1 4.3Å; I294-I442 HydrophobicContact CG2-CG2 3.88Å; I294-L446 HydrophobicContact CD1-CD2 3.44Å; I294-L446 VanDerWaalsContact CD1-CD2 3.44Å; I294-L446 HydrophobicContact CD1-CG 3.81Å; I294-F449 HydrophobicContact CD1-CE2 4.37Å; I294-F449 HydrophobicContact CG1-CE2 4.18Å; I294-E465 VanDerWaalsContact CB-OE1 3.27Å; I294-E465 WeakPolarHBondContact CB-OE1 3.47Å; I294-E465 HydrophobicContact CD1-CB 4.17Å; I294-E465 WeakPolarHBondContact CG1-OE1 3.33Å; I294-E465 PolarHBondContact N-OE1 3.47Å
295	V	89.7	Confident	87	Confident	12 Å²	12	52.2 Å²	52.2	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-36.9	171.9	-177.4	0	0	0	0	111.2	A285 A291 G292 F298 A299 L416	A285-V295 HydrophobicContact CB-CG1 3.98Å; A291-V295 HydrophobicContact CB-CB 4.06Å; A291-V295 HydrophobicContact CB-CG1 3.95Å; A291-V295 WeakPolarHBondContact O-CB 3.26Å; A291-V295 WeakPolarHBondContact O-CG2 3.5Å; G292-V295 PolarHBondContact O-N 2.88Å; V295-F298 PolarHBondContact O-N 3.36Å; V295-A299 VanDerWaalsContact O-CB 3.3Å; V295-A299 WeakPolarHBondContact O-CB 3.45Å; V295-A299 PolarHBondContact O-N 2.95Å; V295-L416 HydrophobicContact CG2-CD2 3.9Å
296	Q	89.3	Confident	87.3	Confident	67 Å²	67	52 Å²	52	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-43.5	173.3	-63.5	-57.7	-26.1	0	0	112.4	A285 G292 T293 I294 F298 A299 S300	A285-Q296 PolarHBondContact O-NE2 3.12Å; G292-Q296 WeakPolarHBondContact O-CG 3.17Å; G292-Q296 PolarHBondContact O-N 2.82Å; G292-Q296 VanDerWaalsContact O-N 3.1Å; T293-Q296 PolarHBondContact O-N 3.49Å; I294-Q296 VanDerWaalsContact C-N 3.33Å; I294-Q296 PolarHBondContact O-N 3.1Å; Q296-F298 VanDerWaalsContact C-N 3.34Å; Q296-F298 PolarHBondContact O-N 2.93Å; Q296-A299 PolarHBondContact O-N 2.81Å; Q296-S300 WeakPolarHBondContact O-CB 3.4Å; Q296-S300 PolarHBondContact O-N 3.11Å
297	S	89	Confident	87.6	Confident	16 Å²	16	46.3 Å²	46.3	11%	0.112	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-37.5	176.8	54.3	0	0	0	0	112.6	T293 I294 S300 G301 S445	T293-S297 PolarHBondContact O-N 2.97Å; T293-S297 PolarHBondContact O-OG 3.38Å; I294-S297 WeakPolarHBondContact CA-OG 3.15Å; I294-S297 PolarHBondContact O-N 2.9Å; I294-S297 PolarHBondContact O-OG 2.86Å; S297-S300 WeakPolarHBondContact O-CB 3.18Å; S297-S300 PolarHBondContact O-N 3.48Å; S297-G301 PolarHBondContact O-N 3.47Å; S297-S445 WeakPolarHBondContact CB-OG 3.42Å; S297-S445 PolarHBondContact OG-OG 2.81Å
298	F	91	Very high	87.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-47.1	171.5	179.1	-122.2	0	0	0	111.8	F281 I294 V295 Q296 S300 G301 L302 L404 C408 L416 V420 L438 I442	F281-F298 AromaticContact CE1-CD1 3.76Å; F281-F298 HydrophobicContact CE1-CD1 3.76Å; F281-F298 AromaticContact CE1-CE1 3.58Å; F281-F298 HydrophobicContact CE1-CE1 3.58Å; F281-F298 HydrophobicContact CZ-CD1 4.08Å; F281-F298 AromaticContact CZ-CE1 3.8Å; F281-F298 HydrophobicContact CZ-CE1 3.8Å; I294-F298 WeakPolarHBondContact O-CB 3.23Å; I294-F298 PolarHBondContact O-N 3.38Å; V295-F298 PolarHBondContact O-N 3.36Å; Q296-F298 VanDerWaalsContact C-N 3.34Å; Q296-F298 PolarHBondContact O-N 2.93Å; F298-S300 VanDerWaalsContact C-N 3.27Å; F298-S300 PolarHBondContact O-N 3.17Å; F298-G301 PolarHBondContact O-N 2.86Å; F298-L302 HydrophobicContact CD1-CD1 4.07Å; F298-L302 HydrophobicContact CE1-CD1 3.63Å; F298-L302 HydrophobicContact CE1-CG 4.38Å; F298-L302 HydrophobicContact CE2-CD1 4.3Å; F298-L302 HydrophobicContact CE2-CD2 4.31Å; F298-L302 HydrophobicContact CE2-CG 4.18Å; F298-L302 HydrophobicContact CZ-CD1 3.75Å; F298-L302 HydrophobicContact CZ-CD2 4.22Å; F298-L302 HydrophobicContact CZ-CG 4.1Å; F298-L302 WeakPolarHBondContact O-CG 3.27Å; F298-L302 PolarHBondContact O-N 2.95Å; F298-L404 HydrophobicContact CE2-CD2 3.63Å; F298-L404 HydrophobicContact CE2-CG 4.32Å; F298-L404 HydrophobicContact CZ-CD2 3.7Å; F298-L404 HydrophobicContact CZ-CG 3.95Å; F298-C408 HydrophobicContact CE1-CB 3.94Å; F298-C408 HydrophobicContact CZ-CB 4.43Å; F298-L416 HydrophobicContact CB-CD2 4.11Å; F298-L416 HydrophobicContact CD1-CD1 4.47Å; F298-L416 HydrophobicContact CD1-CD2 4.21Å; F298-L416 HydrophobicContact CG-CD2 4.3Å; F298-V420 HydrophobicContact CD2-CG2 4.39Å; F298-V420 HydrophobicContact CE2-CG2 4.08Å; F298-L438 HydrophobicContact CE2-CD1 4.28Å; F298-I442 HydrophobicContact CB-CD1 4.02Å; F298-I442 HydrophobicContact CB-CG1 4.01Å; F298-I442 HydrophobicContact CD2-CD1 3.8Å; F298-I442 HydrophobicContact CD2-CG1 4.5Å; F298-I442 HydrophobicContact CG-CD1 4.19Å
299	A	91	Very high	88.1	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-31.9	176.3	0	0	0	0	0	112.8	A285 V295 Q296 H303	A285-A299 HydrophobicContact CB-CB 3.72Å; V295-A299 VanDerWaalsContact O-CB 3.3Å; V295-A299 WeakPolarHBondContact O-CB 3.45Å; V295-A299 PolarHBondContact O-N 2.95Å; Q296-A299 PolarHBondContact O-N 2.81Å; A299-H303 WeakPolarHBondContact O-CB 3.46Å; A299-H303 PolarHBondContact O-N 3.27Å
300	S	90.7	Very high	88.8	Confident	74 Å²	74	35.1 Å²	35.1	52%	0.517	19%	0.188	S	C	.	.	H	α-helix	trans	-66.4	-46.1	172.7	-165.9	0	0	0	0	111.7	Q296 S297 F298 L302 H303 E304	Q296-S300 WeakPolarHBondContact O-CB 3.4Å; Q296-S300 PolarHBondContact O-N 3.11Å; S297-S300 WeakPolarHBondContact O-CB 3.18Å; S297-S300 PolarHBondContact O-N 3.48Å; F298-S300 VanDerWaalsContact C-N 3.27Å; F298-S300 PolarHBondContact O-N 3.17Å; S300-L302 PolarHBondContact O-N 2.97Å; S300-H303 WeakPolarHBondContact O-CB 3.4Å; S300-H303 PolarHBondContact O-N 2.79Å; S300-H303 VanDerWaalsContact O-N 3.11Å; S300-E304 PolarHBondContact O-N 3.36Å
301	G	91	Very high	89.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-38.9	174.7	0	0	0	0	0	113	S297 F298 H303 E304 H305	S297-G301 PolarHBondContact O-N 3.47Å; F298-G301 PolarHBondContact O-N 2.86Å; G301-H303 VanDerWaalsContact C-N 3.32Å; G301-H303 PolarHBondContact O-N 2.9Å; G301-E304 WeakPolarHBondContact O-CB 3.09Å; G301-E304 PolarHBondContact O-N 3.21Å; G301-H305 PolarHBondContact O-CD2 3.41Å; G301-H305 VanDerWaalsContact O-CD2 3.24Å; G301-H305 PolarHBondContact O-N 3.31Å
302	L	92	Very high	90	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-38.1	171.2	-69.4	176.2	0	0	0	112	I278 F281 V282 F298 S300 H305 L306 L401 C405 L438	I278-L302 HydrophobicContact CG2-CB 4.42Å; F281-L302 HydrophobicContact CD1-CD1 3.66Å; F281-L302 HydrophobicContact CE1-CD1 3.83Å; V282-L302 HydrophobicContact CG2-CB 3.77Å; V282-L302 HydrophobicContact CG2-CD1 4.26Å; F298-L302 HydrophobicContact CD1-CD1 4.07Å; F298-L302 HydrophobicContact CE1-CD1 3.63Å; F298-L302 HydrophobicContact CE1-CG 4.38Å; F298-L302 HydrophobicContact CE2-CD1 4.3Å; F298-L302 HydrophobicContact CE2-CD2 4.31Å; F298-L302 HydrophobicContact CE2-CG 4.18Å; F298-L302 HydrophobicContact CZ-CD1 3.75Å; F298-L302 HydrophobicContact CZ-CD2 4.22Å; F298-L302 HydrophobicContact CZ-CG 4.1Å; F298-L302 WeakPolarHBondContact O-CG 3.27Å; F298-L302 PolarHBondContact O-N 2.95Å; S300-L302 PolarHBondContact O-N 2.97Å; L302-H305 PolarHBondContact O-N 3.27Å; L302-L306 WeakPolarHBondContact O-CG 3.44Å; L302-L306 PolarHBondContact O-N 2.95Å; L302-L401 HydrophobicContact CD2-CD2 3.91Å; L302-C405 VanDerWaalsContact CD1-SG 3.58Å; L302-L438 HydrophobicContact CD2-CD1 4.24Å; L302-L438 HydrophobicContact CD2-CD2 4.31Å; L302-L438 HydrophobicContact CG-CD2 4.46Å
303	H	92	Very high	90.3	Very high	81 Å²	81	41.3 Å²	41.3	38%	0.375	20%	0.204	S	C	.	.	H	α-helix	trans	-68.7	-33.4	177.9	-172.5	43.8	0	0	0	112.8	V282 A299 S300 G301 L306 T307	V282-H303 HydrophobicContact CG1-CB 4.35Å; A299-H303 WeakPolarHBondContact O-CB 3.46Å; A299-H303 PolarHBondContact O-N 3.27Å; S300-H303 WeakPolarHBondContact O-CB 3.4Å; S300-H303 PolarHBondContact O-N 2.79Å; S300-H303 VanDerWaalsContact O-N 3.11Å; G301-H303 VanDerWaalsContact C-N 3.32Å; G301-H303 PolarHBondContact O-N 2.9Å; H303-L306 CarbonylContact O-C 3.37Å; H303-L306 PolarHBondContact O-N 2.71Å; H303-T307 PolarHBondContact O-N 2.85Å; H303-T307 PolarHBondContact O-OG1 3.47Å
304	E	91.5	Very high	90.4	Very high	92 Å²	92	41.5 Å²	41.5	43%	0.43	21%	0.211	S	C	.	.	H	α-helix	trans	-63	-47.9	173.2	-168	176.2	-176.1	0	0	111.2	S300 G301 L306 T307 E308 H437	S300-E304 PolarHBondContact O-N 3.36Å; G301-E304 WeakPolarHBondContact O-CB 3.09Å; G301-E304 PolarHBondContact O-N 3.21Å; E304-L306 VanDerWaalsContact C-N 3.32Å; E304-L306 PolarHBondContact O-N 2.91Å; E304-T307 WeakPolarHBondContact O-CA 3.45Å; E304-T307 VanDerWaalsContact O-CB 3.31Å; E304-T307 WeakPolarHBondContact O-CB 3.37Å; E304-T307 PolarHBondContact O-N 2.82Å; E304-E308 PolarHBondContact O-N 2.9Å; E304-E308 VanDerWaalsContact O-N 3.12Å; E304-H437 VanDerWaalsContact CD-NE2 3.27Å; E304-H437 IonicContact OE1-CE1 2.68Å; E304-H437 IonicContact OE1-NE2 3.19Å; E304-H437 IonicContact OE2-CD2 3.77Å; E304-H437 IonicContact OE2-CE1 2.8Å; E304-H437 IonicContact OE2-NE2 3.69Å; E304-H437 PolarHBondContact OE2-NE2 3.32Å
305	H	89.5	Confident	90.4	Very high	40 Å²	40	44.6 Å²	44.6	19%	0.185	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-33.6	173.1	-65.2	-52.3	0	0	0	113.3	G301 L302 T307 Y309 L401 H437	G301-H305 PolarHBondContact O-CD2 3.41Å; G301-H305 VanDerWaalsContact O-CD2 3.24Å; G301-H305 PolarHBondContact O-N 3.31Å; L302-H305 PolarHBondContact O-N 3.27Å; H305-T307 VanDerWaalsContact C-N 3.28Å; H305-T307 PolarHBondContact O-N 3.38Å; H305-Y309 PolarHBondContact O-N 2.73Å; H305-Y309 VanDerWaalsContact O-N 3.13Å; H305-L401 HydrophobicContact CB-CD1 3.85Å; H305-H437 AromaticContact CE1-CD2 3.7Å; H305-H437 AromaticContact NE2-CD2 3.64Å
306	L	91.4	Very high	90.2	Very high	2 Å²	2	44 Å²	44	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-66.7	-28.8	170	-73.9	-179	0	0	0	112.6	I278 V282 L302 H303 E304 Y309 Y310 L398	I278-L306 HydrophobicContact CB-CD2 4.35Å; I278-L306 HydrophobicContact CG2-CD1 3.92Å; I278-L306 HydrophobicContact CG2-CD2 4.13Å; I278-L306 HydrophobicContact CG2-CG 4.05Å; V282-L306 HydrophobicContact CG2-CD1 4.46Å; L302-L306 WeakPolarHBondContact O-CG 3.44Å; L302-L306 PolarHBondContact O-N 2.95Å; H303-L306 CarbonylContact O-C 3.37Å; H303-L306 PolarHBondContact O-N 2.71Å; E304-L306 VanDerWaalsContact C-N 3.32Å; E304-L306 PolarHBondContact O-N 2.91Å; L306-Y309 WeakPolarHBondContact O-CB 3.29Å; L306-Y309 PolarHBondContact O-N 3.36Å; L306-Y310 HydrophobicContact CB-CE2 4.38Å; L306-Y310 WeakPolarHBondContact O-CD2 3.25Å; L306-Y310 VanDerWaalsContact O-CG 3.31Å; L306-Y310 PolarHBondContact O-N 3.47Å; L306-L398 HydrophobicContact CD2-CD2 4.28Å
307	T	92	Very high	90	Very high	67 Å²	67	44.9 Å²	44.9	41%	0.411	23%	0.231	S	C	.	.	H	α-helix	trans	-71.5	-41.2	177.9	-57.2	0	0	0	0	111.1	H303 E304 H305 Y309 Y310 R311	H303-T307 PolarHBondContact O-N 2.85Å; H303-T307 PolarHBondContact O-OG1 3.47Å; E304-T307 WeakPolarHBondContact O-CA 3.45Å; E304-T307 VanDerWaalsContact O-CB 3.31Å; E304-T307 WeakPolarHBondContact O-CB 3.37Å; E304-T307 PolarHBondContact O-N 2.82Å; H305-T307 VanDerWaalsContact C-N 3.28Å; H305-T307 PolarHBondContact O-N 3.38Å; T307-Y309 VanDerWaalsContact C-N 3.3Å; T307-Y309 PolarHBondContact O-N 2.98Å; T307-Y310 PolarHBondContact O-N 3.09Å; T307-R311 PolarHBondContact O-N 3.34Å
308	E	88.4	Confident	89.8	Confident	94 Å²	94	47 Å²	47	44%	0.439	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-36.1	169.7	-78.1	-59.4	112.8	0	0	112.6	E304 R311 L312	E304-E308 PolarHBondContact O-N 2.9Å; E304-E308 VanDerWaalsContact O-N 3.12Å; E308-R311 WeakPolarHBondContact O-CB 3.17Å; E308-R311 PolarHBondContact O-N 2.82Å; E308-R311 IonicContact OE1-NE 3.32Å; E308-R311 PolarHBondContact OE1-NE 3.16Å; E308-R311 IonicContact OE2-CZ 3.7Å; E308-R311 IonicContact OE2-NE 3.35Å; E308-R311 PolarHBondContact OE2-NE 3.27Å; E308-R311 IonicContact OE2-NH2 2.7Å; E308-R311 PolarHBondContact OE2-NH2 2.95Å; E308-L312 PolarHBondContact O-N 3.46Å; E308-L312 VanDerWaalsContact O-N 3.15Å
309	Y	91.2	Very high	89.5	Confident	13 Å²	13	49.5 Å²	49.5	5%	0.051	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-46	171.4	177.7	-105.8	0	0	0	112.3	L232 H275 H305 L306 T307 R311 L312 V313 P394 L398	L232-Y309 WeakPolarHBondContact CD2-OH 3.31Å; L232-Y309 PolarHBondContact O-OH 2.88Å; L232-Y309 VanDerWaalsContact O-OH 3.06Å; H275-Y309 HydrophobicContact CB-CE1 4.14Å; H275-Y309 AromaticContact CG-CE1 3.84Å; H275-Y309 AromaticContact ND1-CD1 3.49Å; H275-Y309 WeakPolarHBondContact ND1-CD1 3.04Å; H275-Y309 AromaticContact ND1-CE1 3.43Å; H275-Y309 WeakPolarHBondContact ND1-CE1 3.37Å; H305-Y309 PolarHBondContact O-N 2.73Å; H305-Y309 VanDerWaalsContact O-N 3.13Å; L306-Y309 WeakPolarHBondContact O-CB 3.29Å; L306-Y309 PolarHBondContact O-N 3.36Å; T307-Y309 VanDerWaalsContact C-N 3.3Å; T307-Y309 PolarHBondContact O-N 2.98Å; Y309-R311 VanDerWaalsContact C-N 3.29Å; Y309-R311 PolarHBondContact O-N 3Å; Y309-L312 PolarHBondContact O-N 3.03Å; Y309-L312 VanDerWaalsContact O-N 3.15Å; Y309-V313 HydrophobicContact CD1-CG2 4.28Å; Y309-V313 HydrophobicContact CE1-CG2 3.86Å; Y309-V313 HydrophobicContact CE2-CG2 4.19Å; Y309-V313 WeakPolarHBondContact O-CG2 3.4Å; Y309-V313 PolarHBondContact O-N 3.37Å; Y309-P394 HydrophobicContact CD2-CB 4.15Å; Y309-P394 HydrophobicContact CE2-CB 4.2Å; Y309-L398 HydrophobicContact CD2-CD1 3.91Å; Y309-L398 HydrophobicContact CE2-CD1 3.67Å; Y309-L398 HydrophobicContact CG-CD1 4.48Å
310	Y	92.5	Very high	88.9	Confident	68 Å²	68	49.9 Å²	49.9	27%	0.267	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-36	175.4	-64.9	-48.2	0	0	0	112.4	H275 L306 T307 L312 V313 A314	H275-Y310 AromaticContact CE1-CE1 3.24Å; H275-Y310 WeakPolarHBondContact CE1-CE1 3.36Å; H275-Y310 AromaticContact CE1-CZ 3.44Å; H275-Y310 VanDerWaalsContact CE1-CZ 3.44Å; H275-Y310 PolarHBondContact CE1-OH 3.23Å; H275-Y310 VanDerWaalsContact CE1-OH 3.27Å; H275-Y310 AromaticContact NE2-CE1 3.6Å; H275-Y310 AromaticContact NE2-CZ 3.86Å; H275-Y310 PolarHBondContact NE2-OH 3.32Å; L306-Y310 HydrophobicContact CB-CE2 4.38Å; L306-Y310 WeakPolarHBondContact O-CD2 3.25Å; L306-Y310 VanDerWaalsContact O-CG 3.31Å; L306-Y310 PolarHBondContact O-N 3.47Å; T307-Y310 PolarHBondContact O-N 3.09Å; Y310-L312 VanDerWaalsContact C-N 3.32Å; Y310-L312 PolarHBondContact O-N 3.21Å; Y310-V313 PolarHBondContact O-N 3.47Å; Y310-A314 WeakPolarHBondContact O-CB 3.48Å; Y310-A314 PolarHBondContact O-N 3.17Å
311	R	92.4	Very high	88.3	Confident	145 Å²	145	49.3 Å²	49.3	55%	0.547	25%	0.25	S	C	.	.	H	α-helix	trans	-59.1	-43.1	173.7	-171.8	-179.6	66.5	75.6	0.4	111.5	T307 E308 Y309 A314 T315	T307-R311 PolarHBondContact O-N 3.34Å; E308-R311 WeakPolarHBondContact O-CB 3.17Å; E308-R311 PolarHBondContact O-N 2.82Å; E308-R311 IonicContact OE1-NE 3.32Å; E308-R311 PolarHBondContact OE1-NE 3.16Å; E308-R311 IonicContact OE2-CZ 3.7Å; E308-R311 IonicContact OE2-NE 3.35Å; E308-R311 PolarHBondContact OE2-NE 3.27Å; E308-R311 IonicContact OE2-NH2 2.7Å; E308-R311 PolarHBondContact OE2-NH2 2.95Å; Y309-R311 VanDerWaalsContact C-N 3.29Å; Y309-R311 PolarHBondContact O-N 3Å; R311-A314 PolarHBondContact O-N 3.41Å; R311-T315 PolarHBondContact O-N 2.79Å
312	L	88.4	Confident	87.2	Confident	39 Å²	39	53.8 Å²	53.8	20%	0.204	27%	0.271	C	S	.	.	H	α-helix	trans	-68.1	-38.7	174.8	178.8	142.9	0	0	0	112.6	E308 Y309 Y310 A314 T315 L316 P394	E308-L312 PolarHBondContact O-N 3.46Å; E308-L312 VanDerWaalsContact O-N 3.15Å; Y309-L312 PolarHBondContact O-N 3.03Å; Y309-L312 VanDerWaalsContact O-N 3.15Å; Y310-L312 VanDerWaalsContact C-N 3.32Å; Y310-L312 PolarHBondContact O-N 3.21Å; L312-A314 VanDerWaalsContact C-N 3.33Å; L312-A314 PolarHBondContact O-N 2.77Å; L312-T315 PolarHBondContact O-N 3.44Å; L312-T315 PolarHBondContact O-OG1 3.07Å; L312-L316 HydrophobicContact CD2-CD1 3.71Å; L312-L316 WeakPolarHBondContact O-CG 3.39Å; L312-L316 PolarHBondContact O-N 3.17Å; L312-P394 HydrophobicContact CD1-CG 3.72Å; L312-P394 HydrophobicContact CD2-CG 4.02Å
313	V	88.5	Confident	85.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-39.5	175	177.4	0	0	0	0	111.1	V229 L232 Y309 Y310 T315 L316 E317	V229-V313 HydrophobicContact CG1-CG1 4.29Å; L232-V313 HydrophobicContact CB-CG2 4.18Å; Y309-V313 HydrophobicContact CD1-CG2 4.28Å; Y309-V313 HydrophobicContact CE1-CG2 3.86Å; Y309-V313 HydrophobicContact CE2-CG2 4.19Å; Y309-V313 WeakPolarHBondContact O-CG2 3.4Å; Y309-V313 PolarHBondContact O-N 3.37Å; Y310-V313 PolarHBondContact O-N 3.47Å; V313-T315 PolarHBondContact O-N 3.49Å; V313-L316 PolarHBondContact O-N 3.04Å; V313-E317 PolarHBondContact O-N 3.21Å
314	A	88.6	Confident	83.9	Confident	55 Å²	55	57.5 Å²	57.5	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-64.8	-35.5	176.5	0	0	0	0	0	113.2	Y310 R311 L312 E317 S318	Y310-A314 WeakPolarHBondContact O-CB 3.48Å; Y310-A314 PolarHBondContact O-N 3.17Å; R311-A314 PolarHBondContact O-N 3.41Å; L312-A314 VanDerWaalsContact C-N 3.33Å; L312-A314 PolarHBondContact O-N 2.77Å; A314-E317 PolarHBondContact O-N 3.44Å; A314-S318 WeakPolarHBondContact O-CB 3.26Å; A314-S318 PolarHBondContact O-N 3.17Å
315	T	88.8	Confident	82.1	Confident	65 Å²	65	60.3 Å²	60.3	40%	0.399	30%	0.302	S	S	.	.	H	α-helix	trans	-69.6	-35.2	174.4	58	0	0	0	0	112.2	R311 L312 V313 S318 Q319	R311-T315 PolarHBondContact O-N 2.79Å; L312-T315 PolarHBondContact O-N 3.44Å; L312-T315 PolarHBondContact O-OG1 3.07Å; V313-T315 PolarHBondContact O-N 3.49Å; T315-S318 PolarHBondContact O-N 3.14Å; T315-Q319 WeakPolarHBondContact O-CG 3.49Å; T315-Q319 PolarHBondContact O-N 3.47Å; T315-Q319 VanDerWaalsContact O-N 3.12Å
316	L	85.2	Confident	80.3	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-40.1	173.4	-66.6	169.7	0	0	0	112.1	L232 L312 V313 Q319 L320 L382 L387 W390	L232-L316 HydrophobicContact CD1-CD1 4.37Å; L312-L316 HydrophobicContact CD2-CD1 3.71Å; L312-L316 WeakPolarHBondContact O-CG 3.39Å; L312-L316 PolarHBondContact O-N 3.17Å; V313-L316 PolarHBondContact O-N 3.04Å; L316-Q319 PolarHBondContact O-N 3.3Å; L316-L320 WeakPolarHBondContact O-CB 3.36Å; L316-L320 PolarHBondContact O-N 2.84Å; L316-L382 HydrophobicContact CD2-CD1 4.3Å; L316-L387 HydrophobicContact CD1-CD1 3.8Å; L316-L387 HydrophobicContact CD2-CD1 4.09Å; L316-L387 HydrophobicContact CG-CD1 4.44Å; L316-W390 HydrophobicContact CD2-CB 3.94Å; L316-W390 HydrophobicContact CD2-CD2 4.5Å; L316-W390 HydrophobicContact CD2-CG 3.84Å
317	E	85.7	Confident	78.2	Confident	84 Å²	84	74.5 Å²	74.5	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-64.4	-38.8	174.1	-176	173.6	-171.9	0	0	112.1	V229 V313 A314 L320 N321	V229-E317 HydrophobicContact CG1-CB 4.23Å; V313-E317 PolarHBondContact O-N 3.21Å; A314-E317 PolarHBondContact O-N 3.44Å; E317-L320 PolarHBondContact O-N 3.44Å; E317-N321 WeakPolarHBondContact O-CB 3.44Å; E317-N321 PolarHBondContact O-N 2.87Å; E317-N321 PolarHBondContact O-ND2 3.46Å; E317-N321 VanDerWaalsContact O-ND2 3.09Å
318	S	85.1	Confident	76.1	Confident	62 Å²	62	75.9 Å²	75.9	43%	0.434	38%	0.383	S	S	.	.	H	α-helix	trans	-61.1	-47	174.2	-173.5	0	0	0	0	111.9	A314 T315 L320 N321 Q322	A314-S318 WeakPolarHBondContact O-CB 3.26Å; A314-S318 PolarHBondContact O-N 3.17Å; T315-S318 PolarHBondContact O-N 3.14Å; S318-L320 PolarHBondContact O-N 2.95Å; S318-N321 PolarHBondContact O-N 3.07Å; S318-Q322 WeakPolarHBondContact O-CG 3.36Å; S318-Q322 PolarHBondContact O-N 2.9Å
319	Q	83.2	Confident	73.6	Confident	51 Å²	51	74.8 Å²	74.8	24%	0.238	40%	0.396	C	S	.	.	H	α-helix	trans	-60.6	-43.6	176	-70.5	172.9	17.8	0	0	111.7	T315 L316 N321 Q322 D323	T315-Q319 WeakPolarHBondContact O-CG 3.49Å; T315-Q319 PolarHBondContact O-N 3.47Å; T315-Q319 VanDerWaalsContact O-N 3.12Å; L316-Q319 PolarHBondContact O-N 3.3Å; Q319-N321 VanDerWaalsContact C-N 3.25Å; Q319-N321 PolarHBondContact O-N 3.25Å; Q319-Q322 PolarHBondContact O-N 3.35Å; Q319-D323 PolarHBondContact O-N 3.11Å
320	L	79.9	Confident	71	Confident	13 Å²	13	81.1 Å²	81.1	7%	0.068	43%	0.431	C	S	.	.	H	α-helix	trans	-66.6	-23.2	178.1	-175.6	60.5	0	0	0	113.9	L225 R226 V229 L316 E317 S318 L382	L225-L320 HydrophobicContact CB-CD1 3.92Å; L225-L320 HydrophobicContact CB-CD2 4.43Å; L225-L320 HydrophobicContact CD1-CD1 4.45Å; R226-L320 HydrophobicContact CB-CD2 4.5Å; R226-L320 HydrophobicContact CG-CD2 3.86Å; R226-L320 HydrophobicContact CG-CG 4.46Å; V229-L320 HydrophobicContact CG2-CD2 3.87Å; L316-L320 WeakPolarHBondContact O-CB 3.36Å; L316-L320 PolarHBondContact O-N 2.84Å; E317-L320 PolarHBondContact O-N 3.44Å; S318-L320 PolarHBondContact O-N 2.95Å; L320-L382 HydrophobicContact CB-CD2 4.06Å; L320-L382 HydrophobicContact CD1-CD2 4.44Å
321	N	77.4	Confident	68.4	Low	61 Å²	61	85 Å²	85	33%	0.326	45%	0.451	S	S	.	.	H	α-helix	trans	-88.2	-28	176.1	-77.3	-44.4	0	0	0	113	E317 S318 Q319 K324	E317-N321 WeakPolarHBondContact O-CB 3.44Å; E317-N321 PolarHBondContact O-N 2.87Å; E317-N321 PolarHBondContact O-ND2 3.46Å; E317-N321 VanDerWaalsContact O-ND2 3.09Å; S318-N321 PolarHBondContact O-N 3.07Å; Q319-N321 VanDerWaalsContact C-N 3.25Å; Q319-N321 PolarHBondContact O-N 3.25Å; N321-K324 WeakPolarHBondContact O-CB 3.11Å; N321-K324 PolarHBondContact O-N 3.13Å; N321-K324 WeakPolarHBondContact OD1-CE 3.44Å; N321-K324 PolarHBondContact OD1-NZ 3.34Å
322	Q	68.5	Low	65.9	Low	95 Å²	95	85.7 Å²	85.7	44%	0.444	46%	0.46	S	S	.	.	H	α-helix	trans	-62.1	-43.7	172.6	-73.5	171.4	-3.9	0	0	111.2	S318 Q319 K324 H325	S318-Q322 WeakPolarHBondContact O-CG 3.36Å; S318-Q322 PolarHBondContact O-N 2.9Å; Q319-Q322 PolarHBondContact O-N 3.35Å; Q322-K324 PolarHBondContact O-N 2.8Å; Q322-H325 PolarHBondContact O-N 3.45Å
323	D	58	Low	63.4	Low	62 Å²	62	88.9 Å²	88.9	33%	0.332	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-12.7	175.8	-76.7	-15.4	0	0	0	114.4	Q319 L382	Q319-D323 PolarHBondContact O-N 3.11Å; D323-L382 PolarHBondContact OD2-N 2.96Å
324	K	56.4	Low	61	Low	97 Å²	97	95.3 Å²	95.3	42%	0.422	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-27.6	175.1	-67.1	174.9	-178.9	162.2	0	114.1	N321 Q322	N321-K324 WeakPolarHBondContact O-CB 3.11Å; N321-K324 PolarHBondContact O-N 3.13Å; N321-K324 WeakPolarHBondContact OD1-CE 3.44Å; N321-K324 PolarHBondContact OD1-NZ 3.34Å; Q322-K324 PolarHBondContact O-N 2.8Å
325	H	53.1	Low	58.8	Low	150 Å²	150	100.7 Å²	100.7	69%	0.694	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-30.4	-170.5	-82.9	-75.8	0	0	0	113.2	Q322 F327	Q322-H325 PolarHBondContact O-N 3.45Å; H325-F327 VanDerWaalsContact C-N 3.31Å; H325-F327 PolarHBondContact O-N 3.17Å
326	D	50.8	Low	56.2	Low	143 Å²	143	102.6 Å²	102.6	77%	0.765	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-4.8	-173.4	-64.9	-19.3	0	0	0	114.8
327	F	47.2	Very low	53.9	Low	198 Å²	198	108.9 Å²	108.9	87%	0.868	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	5.8	-174.7	-110.7	-81.6	0	0	0	115.6	H325	H325-F327 VanDerWaalsContact C-N 3.31Å; H325-F327 PolarHBondContact O-N 3.17Å
328	S	47.9	Very low	51.6	Low	96 Å²	96	113.5 Å²	113.5	67%	0.671	60%	0.603	S	S	*	*			trans	-119.7	19.5	-173.3	62	0	0	0	0	115.2
329	G	35.8	Very low	49.1	Very low	70 Å²	70	113.9 Å²	113.9	72%	0.722	62%	0.616	S	S	*	*			trans	-108.2	79.3	179.9	0	0	0	0	0	114
330	D	36.9	Very low	47.1	Very low	146 Å²	146	117.9 Å²	117.9	78%	0.781	64%	0.644	S	S	*	*			trans	-160.2	148.6	148.8	-125.9	-26.1	0	0	0	115.3
331	H	39	Very low	44.8	Very low	151 Å²	151	123.6 Å²	123.6	70%	0.699	68%	0.675	S	S	*	*			trans	73.5	125.5	166.2	-74.3	-64.9	0	0	0	123.9
332	H	39.9	Very low	42.9	Very low	158 Å²	158	131.8 Å²	131.8	73%	0.731	70%	0.703	S	S	*	*			trans	96.4	79.4	151.1	-67.6	-56.2	0	0	0	122.7
333	T	35.2	Very low	41.3	Very low	106 Å²	106	130.9 Å²	130.9	65%	0.65	72%	0.719	S	S	*	*				32.4	106.9	115.6	57.8	0	0	0	0	119.6
334	N	38.3	Very low	40.2	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	75%	0.746	S	S	*	*				173.2	131.1	103.6	-89.6	-28.8	0	0	0	115.1
335	Q	41.7	Very low	39.2	Very low	168 Å²	168	139.8 Å²	139.8	79%	0.785	76%	0.762	S	S	*	*			trans	54.3	124.1	141.9	-61	178.1	0.8	0	0	122
336	S	35.3	Very low	38.5	Very low	104 Å²	104	139.3 Å²	139.3	73%	0.727	76%	0.764	S	S	*	*			trans	58	136.7	148.9	51.4	0	0	0	0	119
337	D	36.1	Very low	37.9	Very low	133 Å²	133	141.7 Å²	141.7	71%	0.711	77%	0.77	S	S	*	*			cis	-153.9	175.8	17.4	-131.6	-36	0	0	0	113.5
338	Q	37.2	Very low	37.7	Very low	182 Å²	182	139 Å²	139	85%	0.85	77%	0.765	S	S	*	*			trans	-47.3	142.1	-173.2	-62.9	147.9	61.9	0	0	116.9
339	G	33.4	Very low	37.2	Very low	69 Å²	69	140 Å²	140	71%	0.711	76%	0.761	S	S	*	*			trans	-165.9	33	-177.5	0	0	0	0	0	118.9
340	T	40.6	Very low	37.2	Very low	136 Å²	136	141.5 Å²	141.5	83%	0.834	77%	0.767	S	S	*	*			trans	52.2	124.7	159.9	49	0	0	0	0	122.1
341	D	32.2	Very low	37.3	Very low	132 Å²	132	139 Å²	139	71%	0.706	76%	0.762	S	S	*	*			trans	-53.1	134.2	168.6	-78.9	-71.9	0	0	0	115.8
342	Y	36.6	Very low	37.1	Very low	234 Å²	234	138.4 Å²	138.4	92%	0.918	76%	0.762	S	S	*	*			trans	-149.6	129	142.3	-79.3	-76	0	0	0	109.3
343	G	36	Very low	36.8	Very low	76 Å²	76	139.6 Å²	139.6	78%	0.784	77%	0.771	S	S	*	*			trans	127.9	2	161.6	0	0	0	0	0	119.6	S345	G343-S345 VanDerWaalsContact C-N 3.27Å; G343-S345 PolarHBondContact O-N 2.65Å
344	R	33.7	Very low	36.6	Very low	237 Å²	237	144.3 Å²	144.3	89%	0.894	79%	0.785	S	S	*	*			trans	-70.2	77.8	168.5	-93.1	-177.5	166.4	149.3	-5.9	111.5
345	S	36.7	Very low	36.3	Very low	108 Å²	108	140.4 Å²	140.4	76%	0.755	78%	0.778	S	S	*	*			trans	-166.5	73.6	172.6	-78.6	0	0	0	0	112.7	G343	G343-S345 VanDerWaalsContact C-N 3.27Å; G343-S345 PolarHBondContact O-N 2.65Å
346	L	37.7	Very low	35.9	Very low	141 Å²	141	140.2 Å²	140.2	74%	0.738	78%	0.782	S	S	*	*			trans	-157.7	10.3	153.1	-135.6	96.7	0	0	0	116.9	N348 I349	L346-N348 PolarHBondContact O-N 3.34Å; L346-I349 HydrophobicContact CD1-CD1 3.89Å; L346-I349 HydrophobicContact CD2-CD1 4.04Å; L346-I349 HydrophobicContact CG-CD1 3.74Å; L346-I349 HydrophobicContact CG-CG1 4.34Å
347	E	39.4	Very low	35.9	Very low	192 Å²	192	142.6 Å²	142.6	90%	0.897	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	0.3	174.6	-69	-179.9	142.1	0	0	113.7
348	N	41.3	Very low	35.8	Very low	143 Å²	143	139.9 Å²	139.9	77%	0.765	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	16.4	-173	-74.4	-13.7	0	0	0	115.2	L346 S351	L346-N348 PolarHBondContact O-N 3.34Å; N348-S351 PolarHBondContact O-OG 3.04Å
349	I	38	Very low	35.6	Very low	115 Å²	115	134.5 Å²	134.5	59%	0.59	79%	0.788	S	S	*	*	S	Bend	trans	-101.7	-16.8	-178.4	-59.3	-172.7	0	0	0	113.1	L346 S351	L346-I349 HydrophobicContact CD1-CD1 3.89Å; L346-I349 HydrophobicContact CD2-CD1 4.04Å; L346-I349 HydrophobicContact CG-CD1 3.74Å; L346-I349 HydrophobicContact CG-CG1 4.34Å; I349-S351 PolarHBondContact O-N 3.47Å
350	A	36.7	Very low	35.6	Very low	102 Å²	102	138.1 Å²	138.1	84%	0.843	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-1.5	178.9	0	0	0	0	0	114.9
351	S	37.6	Very low	35.4	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	2	-176.9	52.8	0	0	0	0	114.7	N348 I349	N348-S351 PolarHBondContact O-OG 3.04Å; I349-S351 PolarHBondContact O-N 3.47Å
352	L	36.5	Very low	35.6	Very low	137 Å²	137	136.2 Å²	136.2	72%	0.717	78%	0.782	S	S	*	*	S	Bend	trans	-111.6	143	171.9	-92.7	74.5	0	0	0	111
353	M	33.7	Very low	35.6	Very low	183 Å²	183	133.7 Å²	133.7	90%	0.901	78%	0.779	S	S	*	*			trans	86.9	17.6	178.4	-49.2	-155.8	-59.5	0	0	118.3
354	H	30.7	Very low	35.6	Very low	205 Å²	205	134.2 Å²	134.2	95%	0.949	78%	0.776	S	S	*	*			trans	-84	99.1	140.8	-91.2	-60.4	0	0	0	109
355	G	31.1	Very low	35.5	Very low	57 Å²	57	128.6 Å²	128.6	59%	0.588	76%	0.764	S	S	*	*			trans	179.6	143.4	173.2	0	0	0	0	0	108.4
356	D	33.6	Very low	35.6	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	76%	0.763	S	S	*	*			cis	-141.4	143.4	-2.1	-83.7	-45.7	0	0	0	109.4
357	V	35	Very low	35.6	Very low	154 Å²	154	132.9 Å²	132.9	93%	0.933	77%	0.769	S	S	*	*			trans	-128.7	101.2	158.5	-179.6	0	0	0	0	106.6
358	G	33.7	Very low	35.3	Very low	76 Å²	76	127.2 Å²	127.2	78%	0.784	76%	0.762	S	S	*	*			trans	-105.5	139	-172.9	0	0	0	0	0	113.8
359	G	34.4	Very low	34.9	Very low	69 Å²	69	128.4 Å²	128.4	71%	0.711	77%	0.768	S	S	*	*			trans	94.2	135.6	167.7	0	0	0	0	0	114.7
360	L	33.6	Very low	34.7	Very low	146 Å²	146	131.6 Å²	131.6	76%	0.764	78%	0.781	S	S	*	*			cis	-161.9	150.7	-2.2	-155.4	73.1	0	0	0	109.1
361	D	36.3	Very low	34.6	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	78%	0.78	S	S	*	*			trans	62	149.5	162.5	-58.3	-30.6	0	0	0	120.1
362	S	35.3	Very low	34.3	Very low	91 Å²	91	136 Å²	136	64%	0.636	79%	0.786	S	S	*	*			cis	-167.4	161.1	-23.8	58.8	0	0	0	0	109.7
363	H	36	Very low	34.1	Very low	181 Å²	181	135.9 Å²	135.9	84%	0.838	79%	0.791	S	S	*	*			trans	52.2	109.5	161.3	-70.5	-67.2	0	0	0	119.8
364	A	37	Very low	34.1	Very low	87 Å²	87	131.9 Å²	131.9	72%	0.719	78%	0.781	S	S	*	*				92.1	150.3	91.1	0	0	0	0	0	112.3
365	D	31.9	Very low	34.1	Very low	120 Å²	120	127.6 Å²	127.6	64%	0.642	77%	0.774	S	S	*	*			cis	-150.8	155.4	1.6	-153	4.6	0	0	0	110.2
366	R	37.9	Very low	34.3	Very low	197 Å²	197	131.7 Å²	131.7	74%	0.743	78%	0.782	S	S	*	*			trans	43.5	129	148.4	-78.5	160.8	-143.1	-149.2	-2.6	124.5
367	T	38	Very low	34.5	Very low	141 Å²	141	128 Å²	128	87%	0.865	77%	0.769	S	S	*	*			trans	72	110.2	133.8	58	0	0	0	0	120.1
368	G	33.7	Very low	34.4	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	76%	0.763	S	S	*	*			trans	-178.2	98.7	165.4	0	0	0	0	0	112.1
369	D	33.4	Very low	35.1	Very low	168 Å²	168	133.8 Å²	133.8	90%	0.898	76%	0.76	S	S	*	*			trans	54.3	121.1	160	-59.4	-24.4	0	0	0	122.9
370	H	32.8	Very low	36.2	Very low	182 Å²	182	136.3 Å²	136.3	84%	0.843	75%	0.754	S	S	*	*			trans	-77.2	127.8	160.9	-67	-84.9	0	0	0	111.5
371	Q	35.3	Very low	37.7	Very low	177 Å²	177	133 Å²	133	83%	0.827	74%	0.741	S	S	*	*			trans	-164.5	100.1	136.5	-111.1	152.9	95	0	0	112.7	T373	Q371-T373 PolarHBondContact O-N 3.08Å; Q371-T373 VanDerWaalsContact O-N 3.14Å
372	S	30.3	Very low	39.4	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	71%	0.708	S	S	*	*			trans	18	81.3	144.2	56	0	0	0	0	118.2	S374	S372-S374 PolarHBondContact O-N 3.17Å
373	T	32.4	Very low	41.5	Very low	133 Å²	133	125.2 Å²	125.2	82%	0.816	69%	0.694	S	S	*	*			trans	-85.4	91.5	156.1	42.4	0	0	0	0	109.2	Q371 S375	Q371-T373 PolarHBondContact O-N 3.08Å; Q371-T373 VanDerWaalsContact O-N 3.14Å; T373-S375 VanDerWaalsContact C-N 3.31Å; T373-S375 PolarHBondContact O-N 3.43Å
374	S	33.1	Very low	43.7	Very low	99 Å²	99	116.8 Å²	116.8	69%	0.692	66%	0.656	S	S	*	*			trans	-68.9	83.8	173.7	54.6	0	0	0	0	111	S372 L376	S372-S374 PolarHBondContact O-N 3.17Å; S374-L376 PolarHBondContact O-N 3.49Å
375	S	32.2	Very low	45.8	Very low	116 Å²	116	117.4 Å²	117.4	81%	0.811	65%	0.65	S	S	*	*			trans	-74.8	60	168.8	51.1	0	0	0	0	111.2	T373 S377	T373-S375 VanDerWaalsContact C-N 3.31Å; T373-S375 PolarHBondContact O-N 3.43Å; S375-S377 PolarHBondContact O-N 3.3Å; S375-S377 VanDerWaalsContact O-N 3.12Å
376	L	35.4	Very low	48.3	Very low	142 Å²	142	114.8 Å²	114.8	74%	0.743	63%	0.632	S	S	*	*			trans	-59.9	113.4	166.1	-83	158.7	0	0	0	108.4	S374 F378	S374-L376 PolarHBondContact O-N 3.49Å; L376-F378 PolarHBondContact O-N 2.85Å; L376-F378 VanDerWaalsContact O-N 3.12Å
377	S	36.2	Very low	50.6	Low	85 Å²	85	105.4 Å²	105.4	59%	0.594	60%	0.596	S	S	*	*			trans	-60.6	112.3	177.6	49.2	0	0	0	0	110.2	S375 F379	S375-S377 PolarHBondContact O-N 3.3Å; S375-S377 VanDerWaalsContact O-N 3.12Å; S377-F379 VanDerWaalsContact C-N 3.3Å; S377-F379 WeakPolarHBondContact O-CD2 3.31Å; S377-F379 PolarHBondContact O-N 3.03Å; S377-F379 VanDerWaalsContact OG-CE2 3.3Å; S377-F379 WeakPolarHBondContact OG-CE2 3.48Å
378	F	34.1	Very low	52.9	Low	186 Å²	186	100.1 Å²	100.1	82%	0.816	56%	0.564	S	S	*	*			trans	-64.8	85.5	173.4	-90.5	-99	0	0	0	110.8	L376 Q380	L376-F378 PolarHBondContact O-N 2.85Å; L376-F378 VanDerWaalsContact O-N 3.12Å; F378-Q380 VanDerWaalsContact C-N 3.26Å; F378-Q380 PolarHBondContact O-N 3.34Å
379	F	47.2	Very low	55.4	Low	166 Å²	166	102.3 Å²	102.3	73%	0.728	56%	0.557	S	S	*	*			trans	-71.2	86.7	161.5	-74.5	-80.7	0	0	0	108.5	S377	S377-F379 VanDerWaalsContact C-N 3.3Å; S377-F379 WeakPolarHBondContact O-CD2 3.31Å; S377-F379 PolarHBondContact O-N 3.03Å; S377-F379 VanDerWaalsContact OG-CE2 3.3Å; S377-F379 WeakPolarHBondContact OG-CE2 3.48Å
380	Q	57.6	Low	58	Low	122 Å²	122	99.4 Å²	99.4	57%	0.57	53%	0.534	S	S	*	.			trans	-74.6	145.9	167.6	-72.9	178	-29.6	0	0	109.8	F378 R386	F378-Q380 VanDerWaalsContact C-N 3.26Å; F378-Q380 PolarHBondContact O-N 3.34Å; Q380-R386 PolarHBondContact O-NH1 3.34Å
381	P	64.7	Low	60.5	Low	77 Å²	77	90.9 Å²	90.9	50%	0.5	50%	0.495	S	S	.	.			trans	-66.6	165.1	176.2	27.8	-35.3	0	0	0	112.4	T383 R386	P381-T383 PolarHBondContact O-N 3.07Å; P381-R386 PolarHBondContact O-NH1 2.81Å
382	L	72.6	Confident	63	Low	6 Å²	6	87.6 Å²	87.6	3%	0.031	48%	0.479	C	S	.	.			trans	-86.5	87.4	-178.4	-171.8	72	0	0	0	111.9	L225 L316 L320 D323	L225-L382 WeakPolarHBondContact CD1-O 3.44Å; L316-L382 HydrophobicContact CD2-CD1 4.3Å; L320-L382 HydrophobicContact CB-CD2 4.06Å; L320-L382 HydrophobicContact CD1-CD2 4.44Å; D323-L382 PolarHBondContact OD2-N 2.96Å
383	T	80.4	Confident	65.7	Low	58 Å²	58	87.4 Å²	87.4	36%	0.356	47%	0.466	S	S	.	.			trans	-75.9	153.2	172.3	-42.9	0	0	0	0	112.2	E221 P381 T385 R386 L387	E221-T383 VanDerWaalsContact OE1-CG2 3.3Å; E221-T383 WeakPolarHBondContact OE1-CG2 3.46Å; P381-T383 PolarHBondContact O-N 3.07Å; T383-T385 PolarHBondContact O-N 3.47Å; T383-T385 VanDerWaalsContact O-N 3.16Å; T383-R386 WeakPolarHBondContact O-CA 3.28Å; T383-R386 WeakPolarHBondContact O-CB 3.28Å; T383-R386 PolarHBondContact O-N 3.1Å; T383-L387 PolarHBondContact O-N 3.1Å
384	I	81.1	Confident	68.4	Low	4 Å²	4	81.7 Å²	81.7	2%	0.021	43%	0.431	C	S	.	.	H	α-helix	trans	-51.2	-40.2	174.6	-71.7	168.7	0	0	0	112.1	E221 L225 L228 Q261 R386 L387 V388	E221-I384 HydrophobicContact CG-CD1 3.78Å; E221-I384 HydrophobicContact CG-CG1 3.95Å; E221-I384 WeakPolarHBondContact OE1-CG1 3.18Å; E221-I384 PolarHBondContact OE1-N 2.97Å; L225-I384 HydrophobicContact CD2-CG1 3.82Å; L225-I384 HydrophobicContact CG-CG1 4.11Å; L228-I384 HydrophobicContact CD1-CG1 4.38Å; Q261-I384 HydrophobicContact CG-CD1 4.39Å; I384-R386 VanDerWaalsContact C-N 3.31Å; I384-R386 PolarHBondContact O-N 3.23Å; I384-L387 WeakPolarHBondContact O-CB 3.29Å; I384-L387 PolarHBondContact O-N 3.49Å; I384-V388 WeakPolarHBondContact O-CG2 3.26Å; I384-V388 PolarHBondContact O-N 2.8Å
385	T	82.3	Confident	71.1	Confident	99 Å²	99	80.2 Å²	80.2	61%	0.607	41%	0.41	S	S	*	.	H	α-helix	trans	-61.5	-37	177.5	50.5	0	0	0	0	112.9	T383 V388 L389	T383-T385 PolarHBondContact O-N 3.47Å; T383-T385 VanDerWaalsContact O-N 3.16Å; T385-V388 PolarHBondContact O-N 3.15Å; T385-L389 PolarHBondContact O-N 2.6Å
386	R	84.1	Confident	73.7	Confident	66 Å²	66	78.2 Å²	78.2	25%	0.249	39%	0.39	C	S	.	.	H	α-helix	trans	-72	-36.4	176.1	-166	177.7	-177.5	-169.9	1.6	111.2	Q380 P381 T383 I384 L389 W390	Q380-R386 PolarHBondContact O-NH1 3.34Å; P381-R386 PolarHBondContact O-NH1 2.81Å; T383-R386 WeakPolarHBondContact O-CA 3.28Å; T383-R386 WeakPolarHBondContact O-CB 3.28Å; T383-R386 PolarHBondContact O-N 3.1Å; I384-R386 VanDerWaalsContact C-N 3.31Å; I384-R386 PolarHBondContact O-N 3.23Å; R386-L389 WeakPolarHBondContact O-CB 3.31Å; R386-L389 PolarHBondContact O-N 2.95Å; R386-W390 PolarHBondContact O-N 3.47Å
387	L	85.2	Confident	76.3	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-37.2	172.8	-172.9	60	0	0	0	112.1	L225 L228 L232 I268 L316 T383 I384 L389 T391	L225-L387 HydrophobicContact CD2-CD2 3.91Å; L228-L387 HydrophobicContact CB-CD2 3.9Å; L228-L387 HydrophobicContact CD1-CD2 4.17Å; L232-L387 HydrophobicContact CD1-CD1 4.21Å; I268-L387 HydrophobicContact CD1-CB 4.17Å; I268-L387 HydrophobicContact CD1-CD2 3.89Å; I268-L387 HydrophobicContact CD1-CG 3.81Å; I268-L387 HydrophobicContact CG1-CG 4.45Å; L316-L387 HydrophobicContact CD1-CD1 3.8Å; L316-L387 HydrophobicContact CD2-CD1 4.09Å; L316-L387 HydrophobicContact CG-CD1 4.44Å; T383-L387 PolarHBondContact O-N 3.1Å; I384-L387 WeakPolarHBondContact O-CB 3.29Å; I384-L387 PolarHBondContact O-N 3.49Å; L387-L389 VanDerWaalsContact C-N 3.34Å; L387-T391 HydrophobicContact CD1-CG2 4.31Å; L387-T391 WeakPolarHBondContact O-CB 3.37Å; L387-T391 VanDerWaalsContact O-CG2 3.31Å; L387-T391 WeakPolarHBondContact O-CG2 3.36Å; L387-T391 PolarHBondContact O-N 2.94Å; L387-T391 PolarHBondContact O-OG1 2.83Å
388	V	86.2	Confident	78.8	Confident	30 Å²	30	71.8 Å²	71.8	18%	0.182	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-40.4	170.9	174.8	0	0	0	0	111.5	I268 I384 T385 T391 Q392	I268-V388 HydrophobicContact CD1-CG2 3.77Å; I268-V388 HydrophobicContact CG1-CG2 4.09Å; I384-V388 WeakPolarHBondContact O-CG2 3.26Å; I384-V388 PolarHBondContact O-N 2.8Å; T385-V388 PolarHBondContact O-N 3.15Å; V388-T391 WeakPolarHBondContact CA-OG1 3.48Å; V388-T391 PolarHBondContact O-N 3.36Å; V388-T391 PolarHBondContact O-OG1 3.37Å; V388-Q392 PolarHBondContact O-N 3.07Å
389	L	87.2	Confident	81.5	Confident	119 Å²	119	68.9 Å²	68.9	62%	0.623	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-51	176.7	-176.1	66.6	0	0	0	111.7	T385 R386 L387 T391 Q392	T385-L389 PolarHBondContact O-N 2.6Å; R386-L389 WeakPolarHBondContact O-CB 3.31Å; R386-L389 PolarHBondContact O-N 2.95Å; L387-L389 VanDerWaalsContact C-N 3.34Å; L389-T391 PolarHBondContact O-N 3.04Å; L389-Q392 WeakPolarHBondContact O-CB 3.49Å; L389-Q392 PolarHBondContact O-N 2.96Å
390	W	87.1	Confident	83.5	Confident	107 Å²	107	63.3 Å²	63.3	41%	0.405	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-27.7	177.8	-73.3	121.2	0	0	0	113.7	L316 R386 P394	L316-W390 HydrophobicContact CD2-CB 3.94Å; L316-W390 HydrophobicContact CD2-CD2 4.5Å; L316-W390 HydrophobicContact CD2-CG 3.84Å; R386-W390 PolarHBondContact O-N 3.47Å; W390-P394 WeakPolarHBondContact O-CD 3.34Å
391	T	86.7	Confident	85.1	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-87.5	-10.1	178.9	51.6	0	0	0	0	113.9	L232 L387 V388 L389 R395	L232-T391 HydrophobicContact CD1-CG2 4.22Å; L232-T391 HydrophobicContact CD2-CG2 3.91Å; L387-T391 HydrophobicContact CD1-CG2 4.31Å; L387-T391 WeakPolarHBondContact O-CB 3.37Å; L387-T391 VanDerWaalsContact O-CG2 3.31Å; L387-T391 WeakPolarHBondContact O-CG2 3.36Å; L387-T391 PolarHBondContact O-N 2.94Å; L387-T391 PolarHBondContact O-OG1 2.83Å; V388-T391 WeakPolarHBondContact CA-OG1 3.48Å; V388-T391 PolarHBondContact O-N 3.36Å; V388-T391 PolarHBondContact O-OG1 3.37Å; L389-T391 PolarHBondContact O-N 3.04Å; T391-R395 WeakPolarHBondContact O-CB 3.24Å; T391-R395 PolarHBondContact O-N 3.3Å
392	Q	87.6	Confident	86.3	Confident	107 Å²	107	54.2 Å²	54.2	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-49.1	-175.4	-179.2	172.8	-20.3	0	0	113.6	V388 L389 L396	V388-Q392 PolarHBondContact O-N 3.07Å; L389-Q392 WeakPolarHBondContact O-CB 3.49Å; L389-Q392 PolarHBondContact O-N 2.96Å; Q392-L396 PolarHBondContact O-N 2.84Å
393	E	87	Confident	87.1	Confident	111 Å²	111	56.1 Å²	56.1	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-70	-48.8	179.3	171.3	-171.5	167.5	0	0	112.1	R395 L396 R397	E393-R395 VanDerWaalsContact C-N 3.28Å; E393-R395 PolarHBondContact O-N 2.99Å; E393-L396 PolarHBondContact O-N 3.46Å; E393-R397 PolarHBondContact O-N 2.9Å; E393-R397 VanDerWaalsContact O-N 3.14Å; E393-R397 IonicContact OE1-CZ 3.94Å; E393-R397 IonicContact OE1-NH1 3.86Å; E393-R397 PolarHBondContact OE1-NH1 2.63Å; E393-R397 IonicContact OE1-NH2 3.58Å; E393-R397 PolarHBondContact OE1-NH2 2.81Å
394	P	88.6	Confident	87.5	Confident	13 Å²	13	53.4 Å²	53.4	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-54.3	-39.3	171.1	-29.3	35.8	0	0	0	114	Y309 L312 W390 L396 R397 L398	Y309-P394 HydrophobicContact CD2-CB 4.15Å; Y309-P394 HydrophobicContact CE2-CB 4.2Å; L312-P394 HydrophobicContact CD1-CG 3.72Å; L312-P394 HydrophobicContact CD2-CG 4.02Å; W390-P394 WeakPolarHBondContact O-CD 3.34Å; P394-L396 PolarHBondContact O-N 3.45Å; P394-R397 PolarHBondContact O-N 3.44Å; P394-L398 VanDerWaalsContact O-CB 3.32Å; P394-L398 WeakPolarHBondContact O-CB 3.32Å; P394-L398 VanDerWaalsContact O-CG 3.25Å; P394-L398 WeakPolarHBondContact O-CG 3.33Å; P394-L398 PolarHBondContact O-N 3.42Å
395	R	88.9	Confident	87.9	Confident	68 Å²	68	53.3 Å²	53.3	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-42.6	178.9	-166	173.2	67.9	102.6	5.2	112	R267 E270 C271 L274 T391 E393 R399	R267-R395 WeakPolarHBondContact O-CD 3.18Å; E270-R395 IonicContact OE1-NH1 3.32Å; E270-R395 WeakPolarHBondContact OE2-CD 3.41Å; E270-R395 IonicContact OE2-CZ 3.3Å; E270-R395 IonicContact OE2-NE 3.54Å; E270-R395 IonicContact OE2-NH1 2.71Å; E270-R395 PolarHBondContact OE2-NH1 3.48Å; C271-R395 VanDerWaalsContact SG-CB 3.51Å; C271-R395 VanDerWaalsContact SG-CG 3.59Å; L274-R395 HydrophobicContact CD1-CG 4.47Å; T391-R395 WeakPolarHBondContact O-CB 3.24Å; T391-R395 PolarHBondContact O-N 3.3Å; E393-R395 VanDerWaalsContact C-N 3.28Å; E393-R395 PolarHBondContact O-N 2.99Å; R395-R399 VanDerWaalsContact O-CB 3.26Å; R395-R399 WeakPolarHBondContact O-CB 3.07Å; R395-R399 PolarHBondContact O-N 3.47Å
396	L	87.4	Confident	88.2	Confident	73 Å²	73	51.7 Å²	51.7	38%	0.382	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-51	176	-70	173.2	0	0	0	110.8	Q392 E393 P394 L398 R399 F400	Q392-L396 PolarHBondContact O-N 2.84Å; E393-L396 PolarHBondContact O-N 3.46Å; P394-L396 PolarHBondContact O-N 3.45Å; L396-L398 PolarHBondContact O-N 3.27Å; L396-R399 PolarHBondContact O-N 3.09Å; L396-F400 WeakPolarHBondContact O-CD2 3.48Å; L396-F400 PolarHBondContact O-N 3.15Å; L396-F400 VanDerWaalsContact O-N 3.09Å
397	R	89.1	Confident	88.4	Confident	86 Å²	86	51.9 Å²	51.9	33%	0.325	25%	0.247	S	C	.	.	H	α-helix	trans	-57.8	-49.5	178.2	-68.2	-167.3	177.7	121.5	7.1	112	E393 P394 R399 F400 L401 E430 I434	E393-R397 PolarHBondContact O-N 2.9Å; E393-R397 VanDerWaalsContact O-N 3.14Å; E393-R397 IonicContact OE1-CZ 3.94Å; E393-R397 IonicContact OE1-NH1 3.86Å; E393-R397 PolarHBondContact OE1-NH1 2.63Å; E393-R397 IonicContact OE1-NH2 3.58Å; E393-R397 PolarHBondContact OE1-NH2 2.81Å; P394-R397 PolarHBondContact O-N 3.44Å; R397-R399 VanDerWaalsContact C-N 3.31Å; R397-R399 PolarHBondContact O-N 3.24Å; R397-F400 PolarHBondContact O-N 3.24Å; R397-L401 WeakPolarHBondContact O-CG 3.24Å; R397-L401 PolarHBondContact O-N 3.43Å; R397-E430 IonicContact CZ-OE2 3.3Å; R397-E430 IonicContact NE-OE2 2.96Å; R397-E430 IonicContact NH2-OE2 2.84Å; R397-E430 PolarHBondContact NH2-OE2 3.43Å; R397-I434 HydrophobicContact CB-CD1 4.38Å; R397-I434 HydrophobicContact CG-CD1 3.75Å
398	L	90.7	Very high	88.4	Confident	6 Å²	6	52 Å²	52	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-35.5	177.9	-70.4	172.6	0	0	0	112.5	C271 L274 I278 L306 Y309 P394 L396 L401 A402	C271-L398 HydrophobicContact CB-CD1 4.45Å; L274-L398 HydrophobicContact CB-CB 3.91Å; L274-L398 HydrophobicContact CD1-CB 4.1Å; I278-L398 HydrophobicContact CD1-CB 4.4Å; I278-L398 HydrophobicContact CD1-CD2 3.65Å; L306-L398 HydrophobicContact CD2-CD2 4.28Å; Y309-L398 HydrophobicContact CD2-CD1 3.91Å; Y309-L398 HydrophobicContact CE2-CD1 3.67Å; Y309-L398 HydrophobicContact CG-CD1 4.48Å; P394-L398 VanDerWaalsContact O-CB 3.32Å; P394-L398 WeakPolarHBondContact O-CB 3.32Å; P394-L398 VanDerWaalsContact O-CG 3.25Å; P394-L398 WeakPolarHBondContact O-CG 3.33Å; P394-L398 PolarHBondContact O-N 3.42Å; L396-L398 PolarHBondContact O-N 3.27Å; L398-L401 PolarHBondContact O-N 3.23Å; L398-A402 VanDerWaalsContact O-CB 3.3Å; L398-A402 WeakPolarHBondContact O-CB 3.41Å; L398-A402 PolarHBondContact O-N 2.95Å
399	R	90.6	Very high	88.2	Confident	126 Å²	126	56.6 Å²	56.6	48%	0.475	26%	0.262	S	S	.	.	H	α-helix	trans	-67.4	-41.2	177.6	-166.4	-179.5	69.4	128.1	5.6	111.9	L274 R395 L396 R397 S403	L274-R399 HydrophobicContact CD1-CB 3.99Å; R395-R399 VanDerWaalsContact O-CB 3.26Å; R395-R399 WeakPolarHBondContact O-CB 3.07Å; R395-R399 PolarHBondContact O-N 3.47Å; L396-R399 PolarHBondContact O-N 3.09Å; R397-R399 VanDerWaalsContact C-N 3.31Å; R397-R399 PolarHBondContact O-N 3.24Å; R399-S403 PolarHBondContact O-N 2.99Å
400	F	87.8	Confident	87.9	Confident	48 Å²	48	54.5 Å²	54.5	21%	0.211	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-47.8	172.5	-71.5	-64.7	0	0	0	111.5	L396 R397 A402 S403 L404 V431 M435	L396-F400 WeakPolarHBondContact O-CD2 3.48Å; L396-F400 PolarHBondContact O-N 3.15Å; L396-F400 VanDerWaalsContact O-N 3.09Å; R397-F400 PolarHBondContact O-N 3.24Å; F400-A402 VanDerWaalsContact C-N 3.34Å; F400-A402 PolarHBondContact O-N 3.46Å; F400-S403 PolarHBondContact O-N 2.68Å; F400-S403 PolarHBondContact O-OG 3.13Å; F400-L404 PolarHBondContact O-N 2.67Å; F400-V431 HydrophobicContact CD1-CG2 4.36Å; F400-V431 HydrophobicContact CD2-CG2 3.7Å; F400-V431 HydrophobicContact CE1-CG2 4.2Å; F400-V431 HydrophobicContact CE2-CG2 3.52Å; F400-V431 HydrophobicContact CG-CG2 4.13Å; F400-V431 HydrophobicContact CZ-CG2 3.78Å; F400-M435 HydrophobicContact CB-CE 4.32Å
401	L	90.9	Very high	87.8	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-61.1	-39.1	178	-68.3	178	0	0	0	112.9	I278 L302 H305 R397 L398 L404 C405 I434 L438	I278-L401 HydrophobicContact CD1-CB 3.64Å; I278-L401 HydrophobicContact CG1-CB 4.4Å; L302-L401 HydrophobicContact CD2-CD2 3.91Å; H305-L401 HydrophobicContact CB-CD1 3.85Å; R397-L401 WeakPolarHBondContact O-CG 3.24Å; R397-L401 PolarHBondContact O-N 3.43Å; L398-L401 PolarHBondContact O-N 3.23Å; L401-L404 PolarHBondContact O-N 3.37Å; L401-C405 PolarHBondContact O-N 3.22Å; L401-C405 PolarHBondContact O-SG 2.88Å; L401-I434 HydrophobicContact CD2-CG2 3.9Å; L401-L438 HydrophobicContact CD2-CD1 3.69Å
402	A	90	Very high	87.7	Confident	3 Å²	3	57 Å²	57	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-64.4	-45.3	174.1	0	0	0	0	0	111.6	L274 I278 L398 F400 L404 C405 D406	L274-A402 HydrophobicContact CD2-CB 3.68Å; I278-A402 HydrophobicContact CG1-CB 4.31Å; L398-A402 VanDerWaalsContact O-CB 3.3Å; L398-A402 WeakPolarHBondContact O-CB 3.41Å; L398-A402 PolarHBondContact O-N 2.95Å; F400-A402 VanDerWaalsContact C-N 3.34Å; F400-A402 PolarHBondContact O-N 3.46Å; A402-L404 VanDerWaalsContact C-N 3.27Å; A402-L404 PolarHBondContact O-N 2.9Å; A402-C405 WeakPolarHBondContact O-CB 3.5Å; A402-C405 PolarHBondContact O-N 3.22Å; A402-C405 VanDerWaalsContact O-N 3.14Å; A402-D406 VanDerWaalsContact O-CG 3.3Å; A402-D406 PolarHBondContact O-N 3.28Å
403	S	90	Very high	87.5	Confident	47 Å²	47	52 Å²	52	33%	0.329	26%	0.259	S	S	.	.	H	α-helix	trans	-61	-35.9	176.2	73.2	0	0	0	0	112.9	R399 F400 D406 V407	R399-S403 PolarHBondContact O-N 2.99Å; F400-S403 PolarHBondContact O-N 2.68Å; F400-S403 PolarHBondContact O-OG 3.13Å; S403-D406 PolarHBondContact O-N 2.72Å; S403-V407 PolarHBondContact O-N 3.38Å; S403-V407 VanDerWaalsContact O-N 3.17Å
404	L	90	Very high	87.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.8	-45.9	173.5	-173.8	71.1	0	0	0	111.1	F298 F400 L401 A402 D406 V407 C408 V420 Y423 M435 L438	F298-L404 HydrophobicContact CE2-CD2 3.63Å; F298-L404 HydrophobicContact CE2-CG 4.32Å; F298-L404 HydrophobicContact CZ-CD2 3.7Å; F298-L404 HydrophobicContact CZ-CG 3.95Å; F400-L404 PolarHBondContact O-N 2.67Å; L401-L404 PolarHBondContact O-N 3.37Å; A402-L404 VanDerWaalsContact C-N 3.27Å; A402-L404 PolarHBondContact O-N 2.9Å; L404-D406 PolarHBondContact O-N 2.79Å; L404-V407 PolarHBondContact O-N 3.26Å; L404-C408 VanDerWaalsContact O-CB 3.3Å; L404-C408 WeakPolarHBondContact O-CB 3.44Å; L404-C408 PolarHBondContact O-N 3.28Å; L404-C408 PolarHBondContact O-SG 2.9Å; L404-V420 HydrophobicContact CD1-CG2 4.25Å; L404-V420 HydrophobicContact CD2-CG1 4.46Å; L404-Y423 HydrophobicContact CD1-CD2 3.37Å; L404-Y423 HydrophobicContact CD1-CE2 3.76Å; L404-Y423 HydrophobicContact CD1-CG 3.87Å; L404-M435 HydrophobicContact CD2-CE 4.28Å; L404-M435 HydrophobicContact CD2-SD 3.7Å; L404-L438 HydrophobicContact CD2-CD1 3.79Å
405	C	89.3	Confident	87.3	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-55.7	-35.8	174.7	-68.8	0	0	0	0	111.7	F281 L302 L401 A402 C408 R409	F281-C405 HydrophobicContact CB-CB 4.23Å; F281-C405 HydrophobicContact CD2-CB 4.07Å; F281-C405 HydrophobicContact CG-CB 4.03Å; L302-C405 VanDerWaalsContact CD1-SG 3.58Å; L401-C405 PolarHBondContact O-N 3.22Å; L401-C405 PolarHBondContact O-SG 2.88Å; A402-C405 WeakPolarHBondContact O-CB 3.5Å; A402-C405 PolarHBondContact O-N 3.22Å; A402-C405 VanDerWaalsContact O-N 3.14Å; C405-C408 PolarHBondContact O-N 3.39Å; C405-R409 VanDerWaalsContact O-CG 3.25Å; C405-R409 WeakPolarHBondContact O-CG 3.05Å; C405-R409 PolarHBondContact O-N 3.19Å
406	D	88	Confident	87.3	Confident	66 Å²	66	44.2 Å²	44.2	35%	0.353	23%	0.229	S	C	.	.	H	α-helix	trans	-69.8	-46.4	179.5	-70.2	-7.5	0	0	0	113	A402 S403 L404 C408 R409	A402-D406 VanDerWaalsContact O-CG 3.3Å; A402-D406 PolarHBondContact O-N 3.28Å; S403-D406 PolarHBondContact O-N 2.72Å; L404-D406 PolarHBondContact O-N 2.79Å; D406-C408 VanDerWaalsContact C-N 3.27Å; D406-C408 PolarHBondContact O-N 2.95Å; D406-R409 WeakPolarHBondContact O-CB 3.22Å; D406-R409 WeakPolarHBondContact O-CG 3.5Å; D406-R409 PolarHBondContact O-N 3.28Å; D406-R409 IonicContact OD1-CZ 3.66Å; D406-R409 IonicContact OD1-NE 2.84Å; D406-R409 PolarHBondContact OD1-NE 2.92Å; D406-R409 IonicContact OD1-NH2 3.62Å; D406-R409 PolarHBondContact OD1-NH2 3.5Å
407	V	88.8	Confident	87.3	Confident	69 Å²	69	40.7 Å²	40.7	42%	0.418	21%	0.211	S	C	.	.	H	α-helix	trans	-66.6	-31.1	173.7	173.8	0	0	0	0	111.7	S403 L404 R409 L411 A419 Y423	S403-V407 PolarHBondContact O-N 3.38Å; S403-V407 VanDerWaalsContact O-N 3.17Å; L404-V407 PolarHBondContact O-N 3.26Å; V407-R409 VanDerWaalsContact C-N 3.26Å; V407-R409 PolarHBondContact O-N 2.94Å; V407-L411 WeakPolarHBondContact O-CD1 3.39Å; V407-A419 HydrophobicContact CG1-CB 4.49Å; V407-Y423 HydrophobicContact CB-CE2 4.45Å; V407-Y423 HydrophobicContact CG1-CE2 4.35Å; V407-Y423 WeakPolarHBondContact CG2-OH 3.25Å
408	C	85.3	Confident	87.3	Confident	4 Å²	4	37.7 Å²	37.7	3%	0.027	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-3.5	176.5	-62.3	0	0	0	0	113.9	F281 F298 L404 C405 D406 G410 L411 L416	F281-C408 HydrophobicContact CE2-CB 4.4Å; F281-C408 HydrophobicContact CZ-CB 4.21Å; F298-C408 HydrophobicContact CE1-CB 3.94Å; F298-C408 HydrophobicContact CZ-CB 4.43Å; L404-C408 VanDerWaalsContact O-CB 3.3Å; L404-C408 WeakPolarHBondContact O-CB 3.44Å; L404-C408 PolarHBondContact O-N 3.28Å; L404-C408 PolarHBondContact O-SG 2.9Å; C405-C408 PolarHBondContact O-N 3.39Å; D406-C408 VanDerWaalsContact C-N 3.27Å; D406-C408 PolarHBondContact O-N 2.95Å; C408-G410 PolarHBondContact O-N 3.48Å; C408-L411 PolarHBondContact O-N 3.09Å; C408-L416 HydrophobicContact CB-CD1 3.56Å; C408-L416 WeakPolarHBondContact SG-CD1 3.34Å
409	R	81.8	Confident	87.1	Confident	125 Å²	125	38.1 Å²	38.1	47%	0.472	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	108.1	179.1	-66	-178	-171.1	-167.2	0.8	110.7	C405 D406 V407	C405-R409 VanDerWaalsContact O-CG 3.25Å; C405-R409 WeakPolarHBondContact O-CG 3.05Å; C405-R409 PolarHBondContact O-N 3.19Å; D406-R409 WeakPolarHBondContact O-CB 3.22Å; D406-R409 WeakPolarHBondContact O-CG 3.5Å; D406-R409 PolarHBondContact O-N 3.28Å; D406-R409 IonicContact OD1-CZ 3.66Å; D406-R409 IonicContact OD1-NE 2.84Å; D406-R409 PolarHBondContact OD1-NE 2.92Å; D406-R409 IonicContact OD1-NH2 3.62Å; D406-R409 PolarHBondContact OD1-NH2 3.5Å; V407-R409 VanDerWaalsContact C-N 3.26Å; V407-R409 PolarHBondContact O-N 2.94Å
410	G	81.5	Confident	87.1	Confident	76 Å²	76	32.1 Å²	32.1	78%	0.784	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.2	-6.9	175.1	0	0	0	0	0	115.2	C408	C408-G410 PolarHBondContact O-N 3.48Å
411	L	84.8	Confident	87.1	Confident	62 Å²	62	31.3 Å²	31.3	33%	0.325	18%	0.181	S	C	.	.			trans	-75.9	143.4	170.3	-60	-178	0	0	0	110.3	V407 C408 L416 A419	V407-L411 WeakPolarHBondContact O-CD1 3.39Å; C408-L411 PolarHBondContact O-N 3.09Å; L411-L416 HydrophobicContact CB-CB 4.32Å; L411-L416 HydrophobicContact CB-CD1 4.43Å; L411-A419 HydrophobicContact CD1-CB 3.58Å
412	R	83.6	Confident	86.8	Confident	101 Å²	101	34.5 Å²	34.5	38%	0.381	20%	0.204	S	C	.	.			trans	-137.1	158.1	179.4	-68.2	-176.1	171.7	-162.3	-9.7	110	D288 S290 A415	D288-R412 IonicContact OD2-NH2 3.87Å; D288-R412 PolarHBondContact OD2-NH2 3.22Å; D288-R412 VanDerWaalsContact OD2-NH2 3.07Å; S290-R412 PolarHBondContact O-NH1 2.86Å; S290-R412 PolarHBondContact O-NH2 3.37Å; S290-R412 PolarHBondContact OG-NH2 3.23Å; R412-A415 PolarHBondContact O-N 3.07Å
413	G	84.1	Confident	86.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	-146.7	173.3	0	0	0	0	0	114.6	A415 L416	G413-A415 PolarHBondContact O-N 3.17Å; G413-L416 WeakPolarHBondContact O-CB 3.35Å; G413-L416 PolarHBondContact O-N 2.8Å
414	G	83.7	Confident	86.3	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-22.2	178.5	0	0	0	0	0	115.3	L416 A417 S418 E465 M490	G414-L416 VanDerWaalsContact C-N 3.32Å; G414-L416 PolarHBondContact O-N 3.29Å; G414-A417 WeakPolarHBondContact O-CB 3.45Å; G414-A417 PolarHBondContact O-N 2.98Å; G414-S418 PolarHBondContact O-N 2.73Å; G414-S418 PolarHBondContact O-OG 3.25Å; G414-E465 PolarHBondContact N-O 3.07Å; G414-M490 WeakPolarHBondContact CA-O 3.03Å
415	A	86.5	Confident	86	Confident	27 Å²	27	42.5 Å²	42.5	22%	0.223	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-33.9	173.7	0	0	0	0	0	112.4	R412 G413 A419 M490	R412-A415 PolarHBondContact O-N 3.07Å; G413-A415 PolarHBondContact O-N 3.17Å; A415-A419 PolarHBondContact O-N 3Å; A415-A419 VanDerWaalsContact O-N 3.11Å; A415-M490 HydrophobicContact CB-SD 4.37Å
416	L	89.6	Confident	85.7	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-65	-44.4	171	177.2	65.8	0	0	0	110.8	I294 V295 F298 C408 L411 G413 G414 S418 A419 V420	I294-L416 HydrophobicContact CG2-CD2 4.34Å; V295-L416 HydrophobicContact CG2-CD2 3.9Å; F298-L416 HydrophobicContact CB-CD2 4.11Å; F298-L416 HydrophobicContact CD1-CD1 4.47Å; F298-L416 HydrophobicContact CD1-CD2 4.21Å; F298-L416 HydrophobicContact CG-CD2 4.3Å; C408-L416 HydrophobicContact CB-CD1 3.56Å; C408-L416 WeakPolarHBondContact SG-CD1 3.34Å; L411-L416 HydrophobicContact CB-CB 4.32Å; L411-L416 HydrophobicContact CB-CD1 4.43Å; G413-L416 WeakPolarHBondContact O-CB 3.35Å; G413-L416 PolarHBondContact O-N 2.8Å; G414-L416 VanDerWaalsContact C-N 3.32Å; G414-L416 PolarHBondContact O-N 3.29Å; L416-S418 VanDerWaalsContact C-N 3.33Å; L416-S418 PolarHBondContact O-N 3.21Å; L416-A419 PolarHBondContact O-N 3.21Å; L416-A419 VanDerWaalsContact O-N 3.14Å; L416-V420 HydrophobicContact CD1-CG2 4.22Å; L416-V420 HydrophobicContact CG-CG2 4.47Å; L416-V420 WeakPolarHBondContact O-CG2 3.33Å; L416-V420 PolarHBondContact O-N 2.64Å
417	A	88	Confident	85.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-40.8	178	0	0	0	0	0	111.9	G414 A419 V420 F421 M439 I442 L446 P492 F494	G414-A417 WeakPolarHBondContact O-CB 3.45Å; G414-A417 PolarHBondContact O-N 2.98Å; A417-A419 PolarHBondContact O-N 3.42Å; A417-V420 PolarHBondContact O-N 3.45Å; A417-F421 VanDerWaalsContact O-CB 3.25Å; A417-F421 WeakPolarHBondContact O-CB 3.33Å; A417-F421 PolarHBondContact O-N 3.46Å; A417-M439 WeakPolarHBondContact O-CE 3.46Å; A417-I442 HydrophobicContact CB-CG2 3.71Å; A417-L446 HydrophobicContact CB-CD1 3.69Å; A417-P492 HydrophobicContact CB-CB 4.27Å; A417-P492 HydrophobicContact CB-CG 4.48Å; A417-F494 HydrophobicContact CB-CE1 4.26Å
418	S	88.3	Confident	85.5	Confident	23 Å²	23	47 Å²	47	16%	0.161	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-43	171.6	-66.7	0	0	0	0	112.9	G414 L416 F421 S422 P492 V493	G414-S418 PolarHBondContact O-N 2.73Å; G414-S418 PolarHBondContact O-OG 3.25Å; L416-S418 VanDerWaalsContact C-N 3.33Å; L416-S418 PolarHBondContact O-N 3.21Å; S418-F421 PolarHBondContact O-N 3.31Å; S418-S422 PolarHBondContact O-N 3.25Å; S418-P492 WeakPolarHBondContact OG-CA 3.37Å; S418-V493 PolarHBondContact OG-N 3.24Å; S418-V493 VanDerWaalsContact OG-N 3.07Å
419	A	87.8	Confident	85.5	Confident	15 Å²	15	51.5 Å²	51.5	12%	0.124	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-50.5	178.1	0	0	0	0	0	111.7	V407 L411 A415 L416 A417 F421 S422 Y423	V407-A419 HydrophobicContact CG1-CB 4.49Å; L411-A419 HydrophobicContact CD1-CB 3.58Å; A415-A419 PolarHBondContact O-N 3Å; A415-A419 VanDerWaalsContact O-N 3.11Å; L416-A419 PolarHBondContact O-N 3.21Å; L416-A419 VanDerWaalsContact O-N 3.14Å; A417-A419 PolarHBondContact O-N 3.42Å; A419-F421 VanDerWaalsContact C-N 3.27Å; A419-F421 PolarHBondContact O-N 2.98Å; A419-S422 PolarHBondContact O-N 3.45Å; A419-S422 PolarHBondContact O-OG 2.88Å; A419-Y423 WeakPolarHBondContact O-CD2 3.33Å
420	V	89	Confident	85.6	Confident	0 Å²	0	50 Å²	50	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-33.6	178.6	-174.8	0	0	0	0	111.3	F298 L404 L416 A417 S422 Y423 T424 M439 I442	F298-V420 HydrophobicContact CD2-CG2 4.39Å; F298-V420 HydrophobicContact CE2-CG2 4.08Å; L404-V420 HydrophobicContact CD1-CG2 4.25Å; L404-V420 HydrophobicContact CD2-CG1 4.46Å; L416-V420 HydrophobicContact CD1-CG2 4.22Å; L416-V420 HydrophobicContact CG-CG2 4.47Å; L416-V420 WeakPolarHBondContact O-CG2 3.33Å; L416-V420 PolarHBondContact O-N 2.64Å; A417-V420 PolarHBondContact O-N 3.45Å; V420-S422 VanDerWaalsContact C-N 3.33Å; V420-S422 PolarHBondContact O-N 3.42Å; V420-Y423 WeakPolarHBondContact O-CB 3.16Å; V420-Y423 PolarHBondContact O-N 2.91Å; V420-Y423 VanDerWaalsContact O-N 3.08Å; V420-T424 PolarHBondContact O-N 3.49Å; V420-M439 VanDerWaalsContact C-CE 3.46Å; V420-M439 HydrophobicContact CB-CE 3.66Å; V420-M439 HydrophobicContact CG1-CE 3.76Å; V420-I442 HydrophobicContact CB-CD1 4.1Å; V420-I442 HydrophobicContact CG1-CD1 4.25Å; V420-I442 HydrophobicContact CG2-CD1 3.78Å
421	F	87.4	Confident	85.8	Confident	30 Å²	30	46.7 Å²	46.7	13%	0.132	27%	0.27	C	S	.	.	H	α-helix	trans	-65.4	-34.5	176.7	-173.6	-110.1	0	0	0	112.4	A417 S418 A419 Y423 T424 M439 V493 F494 F541	A417-F421 VanDerWaalsContact O-CB 3.25Å; A417-F421 WeakPolarHBondContact O-CB 3.33Å; A417-F421 PolarHBondContact O-N 3.46Å; S418-F421 PolarHBondContact O-N 3.31Å; A419-F421 VanDerWaalsContact C-N 3.27Å; A419-F421 PolarHBondContact O-N 2.98Å; F421-Y423 PolarHBondContact O-N 3.43Å; F421-T424 WeakPolarHBondContact CD2-OG1 3.5Å; F421-T424 PolarHBondContact O-N 2.87Å; F421-T424 PolarHBondContact O-OG1 3.21Å; F421-M439 VanDerWaalsContact CA-CE 3.41Å; F421-M439 HydrophobicContact CB-CE 3.65Å; F421-M439 HydrophobicContact CD2-CE 4.41Å; F421-V493 HydrophobicContact CD1-CB 4.22Å; F421-V493 HydrophobicContact CD1-CG1 4.1Å; F421-V493 HydrophobicContact CE1-CG1 4.25Å; F421-F494 HydrophobicContact CB-CD1 4.37Å; F421-F494 HydrophobicContact CD1-CB 4.43Å; F421-F494 HydrophobicContact CD1-CD1 4.47Å; F421-F494 HydrophobicContact CD2-CB 4.43Å; F421-F494 HydrophobicContact CD2-CD1 4.16Å; F421-F494 HydrophobicContact CE1-CB 4.09Å; F421-F494 HydrophobicContact CE2-CB 4.08Å; F421-F494 HydrophobicContact CG-CD1 4.08Å; F421-F494 HydrophobicContact CZ-CB 3.91Å; F421-F541 AromaticContact CD2-CD1 3.95Å; F421-F541 HydrophobicContact CD2-CD1 3.95Å; F421-F541 HydrophobicContact CE2-CB 4.28Å; F421-F541 HydrophobicContact CE2-CD1 4.27Å
422	S	86.1	Confident	85.8	Confident	72 Å²	72	44.1 Å²	44.1	50%	0.503	26%	0.257	S	S	.	.	H	α-helix	trans	-60.5	-27.1	173.5	74.8	0	0	0	0	113.1	S418 A419 V420	S418-S422 PolarHBondContact O-N 3.25Å; A419-S422 PolarHBondContact O-N 3.45Å; A419-S422 PolarHBondContact O-OG 2.88Å; V420-S422 VanDerWaalsContact C-N 3.33Å; V420-S422 PolarHBondContact O-N 3.42Å
423	Y	85.1	Confident	85.9	Confident	62 Å²	62	44.6 Å²	44.6	24%	0.243	27%	0.267	C	S	.	.	H	α-helix	trans	-84.9	-14.5	174.8	-73.2	-84	0	0	0	114.4	L404 V407 A419 V420 F421 L425 H426	L404-Y423 HydrophobicContact CD1-CD2 3.37Å; L404-Y423 HydrophobicContact CD1-CE2 3.76Å; L404-Y423 HydrophobicContact CD1-CG 3.87Å; V407-Y423 HydrophobicContact CB-CE2 4.45Å; V407-Y423 HydrophobicContact CG1-CE2 4.35Å; V407-Y423 WeakPolarHBondContact CG2-OH 3.25Å; A419-Y423 WeakPolarHBondContact O-CD2 3.33Å; V420-Y423 WeakPolarHBondContact O-CB 3.16Å; V420-Y423 PolarHBondContact O-N 2.91Å; V420-Y423 VanDerWaalsContact O-N 3.08Å; F421-Y423 PolarHBondContact O-N 3.43Å; Y423-L425 PolarHBondContact O-N 3.03Å; Y423-H426 WeakPolarHBondContact O-CB 3.41Å
424	T	84.9	Confident	86.1	Confident	21 Å²	21	45.3 Å²	45.3	13%	0.129	27%	0.27	C	S	.	.	H	α-helix	trans	-73.3	-19.9	173.1	60.4	0	0	0	0	112.3	V420 F421 H426 M435 M439	V420-T424 PolarHBondContact O-N 3.49Å; F421-T424 WeakPolarHBondContact CD2-OG1 3.5Å; F421-T424 PolarHBondContact O-N 2.87Å; F421-T424 PolarHBondContact O-OG1 3.21Å; T424-H426 PolarHBondContact O-N 3.26Å; T424-M435 HydrophobicContact CG2-CB 3.83Å; T424-M439 HydrophobicContact CG2-CB 4.09Å; T424-M439 HydrophobicContact CG2-CE 4.44Å
425	L	81.9	Confident	86.3	Confident	136 Å²	136	45.5 Å²	45.5	71%	0.712	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	15.8	177.1	-58.5	174.8	0	0	0	113.4	Y423	Y423-L425 PolarHBondContact O-N 3.03Å
426	H	84.4	Confident	86.3	Confident	83 Å²	83	50.3 Å²	50.3	38%	0.384	28%	0.284	S	S	.	.			trans	-75.6	136.7	179.9	-156.1	-89.9	0	0	0	111.3	Y423 T424 D428 V431	Y423-H426 WeakPolarHBondContact O-CB 3.41Å; T424-H426 PolarHBondContact O-N 3.26Å; H426-D428 PolarHBondContact O-N 3.35Å; H426-D428 VanDerWaalsContact O-N 3.15Å; H426-V431 HydrophobicContact CB-CG1 4.15Å
427	G	85.8	Confident	86.2	Confident	86 Å²	86	53.2 Å²	53.2	89%	0.887	30%	0.297	S	S	*	.	S	Bend	trans	-74.3	1.5	-176.6	0	0	0	0	0	116.2
428	D	87.2	Confident	86.3	Confident	62 Å²	62	53.2 Å²	53.2	33%	0.332	30%	0.297	S	S	.	.			trans	-97.8	119	176.9	179.9	-19.4	0	0	0	108.6	H426 E430 V431 A432	H426-D428 PolarHBondContact O-N 3.35Å; H426-D428 VanDerWaalsContact O-N 3.15Å; D428-E430 VanDerWaalsContact C-N 3.31Å; D428-E430 PolarHBondContact O-N 2.97Å; D428-E430 PolarHBondContact OD1-N 2.68Å; D428-V431 HydrophobicContact CB-CB 4.12Å; D428-V431 HydrophobicContact CB-CG2 3.98Å; D428-V431 PolarHBondContact O-N 2.99Å; D428-A432 WeakPolarHBondContact O-CB 3.26Å; D428-A432 PolarHBondContact O-N 3.22Å
429	P	85	Confident	86.3	Confident	99 Å²	99	52.4 Å²	52.4	64%	0.643	29%	0.291	S	S	*	.	H	α-helix	trans	-63.5	-32	-174.9	26.5	-35.3	0	0	0	113.5	A432 L433	P429-A432 PolarHBondContact O-N 3.39Å; P429-L433 VanDerWaalsContact O-CB 3.31Å; P429-L433 WeakPolarHBondContact O-CB 3.28Å; P429-L433 PolarHBondContact O-N 3.1Å
430	E	83	Confident	86.4	Confident	94 Å²	94	53.2 Å²	53.2	44%	0.439	30%	0.295	S	S	.	.	H	α-helix	trans	-68.4	-44.7	178.2	-76	-69.4	127.1	0	0	110.7	R397 D428 L433 I434	R397-E430 IonicContact CZ-OE2 3.3Å; R397-E430 IonicContact NE-OE2 2.96Å; R397-E430 IonicContact NH2-OE2 2.84Å; R397-E430 PolarHBondContact NH2-OE2 3.43Å; D428-E430 VanDerWaalsContact C-N 3.31Å; D428-E430 PolarHBondContact O-N 2.97Å; D428-E430 PolarHBondContact OD1-N 2.68Å; E430-L433 PolarHBondContact O-N 2.95Å; E430-I434 WeakPolarHBondContact O-CD1 3.27Å; E430-I434 VanDerWaalsContact O-CG1 3.32Å; E430-I434 WeakPolarHBondContact O-CG1 3.35Å; E430-I434 PolarHBondContact O-N 3.37Å; E430-I434 VanDerWaalsContact O-N 3.13Å
431	V	85.8	Confident	86.2	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.036	31%	0.306	C	S	.	.	H	α-helix	trans	-64.9	-46.4	174.9	-178.9	0	0	0	0	109.9	F400 H426 D428 L433 I434 M435	F400-V431 HydrophobicContact CD1-CG2 4.36Å; F400-V431 HydrophobicContact CD2-CG2 3.7Å; F400-V431 HydrophobicContact CE1-CG2 4.2Å; F400-V431 HydrophobicContact CE2-CG2 3.52Å; F400-V431 HydrophobicContact CG-CG2 4.13Å; F400-V431 HydrophobicContact CZ-CG2 3.78Å; H426-V431 HydrophobicContact CB-CG1 4.15Å; D428-V431 HydrophobicContact CB-CB 4.12Å; D428-V431 HydrophobicContact CB-CG2 3.98Å; D428-V431 PolarHBondContact O-N 2.99Å; V431-L433 VanDerWaalsContact C-N 3.3Å; V431-L433 PolarHBondContact O-N 2.8Å; V431-I434 PolarHBondContact O-N 2.94Å; V431-M435 HydrophobicContact CG1-CE 4.07Å; V431-M435 HydrophobicContact CG1-CG 4.11Å; V431-M435 VanDerWaalsContact O-CG 3.26Å; V431-M435 WeakPolarHBondContact O-CG 3.37Å; V431-M435 PolarHBondContact O-N 3Å
432	A	85.1	Confident	86.3	Confident	7 Å²	7	53.7 Å²	53.7	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-37.7	179	0	0	0	0	0	112.4	D428 P429 R436	D428-A432 WeakPolarHBondContact O-CB 3.26Å; D428-A432 PolarHBondContact O-N 3.22Å; P429-A432 PolarHBondContact O-N 3.39Å; A432-R436 VanDerWaalsContact O-CB 3.28Å; A432-R436 WeakPolarHBondContact O-CB 3.46Å; A432-R436 VanDerWaalsContact O-CG 3.26Å; A432-R436 WeakPolarHBondContact O-CG 3.34Å; A432-R436 PolarHBondContact O-N 3.35Å
433	L	85.9	Confident	86.3	Confident	112 Å²	112	50.2 Å²	50.2	59%	0.586	28%	0.275	S	S	*	.	H	α-helix	trans	-65.5	-47.7	175.6	-165.5	164.4	0	0	0	111.2	P429 E430 V431 M435 R436 H437	P429-L433 VanDerWaalsContact O-CB 3.31Å; P429-L433 WeakPolarHBondContact O-CB 3.28Å; P429-L433 PolarHBondContact O-N 3.1Å; E430-L433 PolarHBondContact O-N 2.95Å; V431-L433 VanDerWaalsContact C-N 3.3Å; V431-L433 PolarHBondContact O-N 2.8Å; L433-M435 VanDerWaalsContact C-N 3.35Å; L433-M435 PolarHBondContact O-N 3.33Å; L433-R436 PolarHBondContact O-N 3.18Å; L433-H437 PolarHBondContact O-N 2.93Å
434	I	87.2	Confident	86.3	Confident	15 Å²	15	49.9 Å²	49.9	8%	0.077	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-46.2	175.6	-67.6	163.5	0	0	0	110.8	R397 L401 E430 V431 H437 L438	R397-I434 HydrophobicContact CB-CD1 4.38Å; R397-I434 HydrophobicContact CG-CD1 3.75Å; L401-I434 HydrophobicContact CD2-CG2 3.9Å; E430-I434 WeakPolarHBondContact O-CD1 3.27Å; E430-I434 VanDerWaalsContact O-CG1 3.32Å; E430-I434 WeakPolarHBondContact O-CG1 3.35Å; E430-I434 PolarHBondContact O-N 3.37Å; E430-I434 VanDerWaalsContact O-N 3.13Å; V431-I434 PolarHBondContact O-N 2.94Å; I434-H437 PolarHBondContact O-N 3.03Å; I434-L438 HydrophobicContact CG2-CD1 4.28Å; I434-L438 WeakPolarHBondContact O-CG 3.38Å; I434-L438 PolarHBondContact O-N 2.94Å
435	M	88.9	Confident	86.5	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.015	28%	0.282	C	S	.	.	H	α-helix	trans	-70.6	-33.6	-179.4	-59.4	-51	163.8	0	0	112.2	F400 L404 T424 V431 L433 L438 M439	F400-M435 HydrophobicContact CB-CE 4.32Å; L404-M435 HydrophobicContact CD2-CE 4.28Å; L404-M435 HydrophobicContact CD2-SD 3.7Å; T424-M435 HydrophobicContact CG2-CB 3.83Å; V431-M435 HydrophobicContact CG1-CE 4.07Å; V431-M435 HydrophobicContact CG1-CG 4.11Å; V431-M435 VanDerWaalsContact O-CG 3.26Å; V431-M435 WeakPolarHBondContact O-CG 3.37Å; V431-M435 PolarHBondContact O-N 3Å; L433-M435 VanDerWaalsContact C-N 3.35Å; L433-M435 PolarHBondContact O-N 3.33Å; M435-L438 HydrophobicContact SD-CD1 4.04Å; M435-M439 WeakPolarHBondContact O-CB 3.45Å; M435-M439 PolarHBondContact O-N 2.87Å
436	R	87	Confident	86.7	Confident	129 Å²	129	43.4 Å²	43.4	49%	0.487	25%	0.249	S	C	.	.	H	α-helix	trans	-62.4	-41.3	169.8	-83.1	178.8	171.8	118.8	-5.4	112	A432 L433 M439 S440 E542	A432-R436 VanDerWaalsContact O-CB 3.28Å; A432-R436 WeakPolarHBondContact O-CB 3.46Å; A432-R436 VanDerWaalsContact O-CG 3.26Å; A432-R436 WeakPolarHBondContact O-CG 3.34Å; A432-R436 PolarHBondContact O-N 3.35Å; L433-R436 PolarHBondContact O-N 3.18Å; R436-M439 PolarHBondContact O-N 3.42Å; R436-S440 WeakPolarHBondContact O-CB 3.28Å; R436-S440 PolarHBondContact O-N 2.82Å; R436-E542 IonicContact CZ-OE1 3.55Å; R436-E542 IonicContact NE-OE1 3.54Å; R436-E542 PolarHBondContact NE-OE1 3.38Å; R436-E542 IonicContact NH2-OE1 2.64Å; R436-E542 PolarHBondContact NH2-OE1 2.9Å
437	H	87.6	Confident	86.7	Confident	63 Å²	63	40.8 Å²	40.8	29%	0.292	24%	0.238	S	C	.	.	H	α-helix	trans	-63.8	-50.7	176.5	-175.5	71.4	0	0	0	111.8	E304 H305 L433 I434 M439 S440 N441	E304-H437 VanDerWaalsContact CD-NE2 3.27Å; E304-H437 IonicContact OE1-CE1 2.68Å; E304-H437 IonicContact OE1-NE2 3.19Å; E304-H437 IonicContact OE2-CD2 3.77Å; E304-H437 IonicContact OE2-CE1 2.8Å; E304-H437 IonicContact OE2-NE2 3.69Å; E304-H437 PolarHBondContact OE2-NE2 3.32Å; H305-H437 AromaticContact CE1-CD2 3.7Å; H305-H437 AromaticContact NE2-CD2 3.64Å; L433-H437 PolarHBondContact O-N 2.93Å; I434-H437 PolarHBondContact O-N 3.03Å; H437-M439 PolarHBondContact O-N 3.41Å; H437-S440 WeakPolarHBondContact O-CB 3.22Å; H437-S440 PolarHBondContact O-N 2.73Å; H437-S440 VanDerWaalsContact O-N 3.16Å; H437-N441 PolarHBondContact O-N 3.23Å
438	L	89.6	Confident	86.8	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-38.8	173.7	-71.3	176.4	0	0	0	112.1	F298 L302 L401 L404 I434 M435 N441 I442	F298-L438 HydrophobicContact CE2-CD1 4.28Å; L302-L438 HydrophobicContact CD2-CD1 4.24Å; L302-L438 HydrophobicContact CD2-CD2 4.31Å; L302-L438 HydrophobicContact CG-CD2 4.46Å; L401-L438 HydrophobicContact CD2-CD1 3.69Å; L404-L438 HydrophobicContact CD2-CD1 3.79Å; I434-L438 HydrophobicContact CG2-CD1 4.28Å; I434-L438 WeakPolarHBondContact O-CG 3.38Å; I434-L438 PolarHBondContact O-N 2.94Å; M435-L438 HydrophobicContact SD-CD1 4.04Å; L438-N441 PolarHBondContact O-N 3.41Å; L438-I442 PolarHBondContact O-N 3.01Å
439	M	88.8	Confident	86.8	Confident	5 Å²	5	40 Å²	40	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-43.5	175.8	-172.4	53.9	73.9	0	0	111.9	A417 V420 F421 T424 M435 R436 H437 N441 I442 A443 F541	A417-M439 WeakPolarHBondContact O-CE 3.46Å; V420-M439 VanDerWaalsContact C-CE 3.46Å; V420-M439 HydrophobicContact CB-CE 3.66Å; V420-M439 HydrophobicContact CG1-CE 3.76Å; F421-M439 VanDerWaalsContact CA-CE 3.41Å; F421-M439 HydrophobicContact CB-CE 3.65Å; F421-M439 HydrophobicContact CD2-CE 4.41Å; T424-M439 HydrophobicContact CG2-CB 4.09Å; T424-M439 HydrophobicContact CG2-CE 4.44Å; M435-M439 WeakPolarHBondContact O-CB 3.45Å; M435-M439 PolarHBondContact O-N 2.87Å; R436-M439 PolarHBondContact O-N 3.42Å; H437-M439 PolarHBondContact O-N 3.41Å; M439-N441 PolarHBondContact O-N 2.78Å; M439-I442 CarbonylContact O-C 3.59Å; M439-I442 PolarHBondContact O-N 2.89Å; M439-I442 VanDerWaalsContact O-N 3.09Å; M439-I442 HydrophobicContact SD-CB 4.15Å; M439-I442 HydrophobicContact SD-CG2 3.94Å; M439-A443 WeakPolarHBondContact O-CA 3.48Å; M439-A443 WeakPolarHBondContact O-CB 3.42Å; M439-A443 PolarHBondContact O-N 3.14Å; M439-F541 HydrophobicContact CE-CD1 4.49Å; M439-F541 HydrophobicContact CE-CE1 4.24Å; M439-F541 HydrophobicContact CG-CD1 3.39Å; M439-F541 HydrophobicContact CG-CE1 3.41Å; M439-F541 VanDerWaalsContact CG-CE1 3.41Å; M439-F541 HydrophobicContact CG-CG 4Å; M439-F541 HydrophobicContact CG-CZ 4.14Å; M439-F541 HydrophobicContact SD-CD1 3.74Å; M439-F541 HydrophobicContact SD-CE1 3.16Å; M439-F541 WeakPolarHBondContact SD-CE1 3.4Å; M439-F541 HydrophobicContact SD-CZ 3.91Å
440	S	87.9	Confident	86.9	Confident	32 Å²	32	35.3 Å²	35.3	22%	0.224	18%	0.178	C	C	.	.	H	α-helix	trans	-56.8	-35.9	177.4	-166	0	0	0	0	112	R436 H437 A443 S444	R436-S440 WeakPolarHBondContact O-CB 3.28Å; R436-S440 PolarHBondContact O-N 2.82Å; H437-S440 WeakPolarHBondContact O-CB 3.22Å; H437-S440 PolarHBondContact O-N 2.73Å; H437-S440 VanDerWaalsContact O-N 3.16Å; S440-A443 WeakPolarHBondContact O-CB 3.45Å; S440-S444 WeakPolarHBondContact O-CB 3.19Å; S440-S444 PolarHBondContact O-N 3.03Å
441	N	86.2	Confident	87	Confident	40 Å²	40	32.5 Å²	32.5	21%	0.214	17%	0.168	C	C	.	.	H	α-helix	trans	-68.3	-47.9	173.5	-73.7	-24.2	0	0	0	112.5	H437 L438 M439 A443 S444	H437-N441 PolarHBondContact O-N 3.23Å; L438-N441 PolarHBondContact O-N 3.41Å; M439-N441 PolarHBondContact O-N 2.78Å; N441-A443 VanDerWaalsContact C-N 3.33Å; N441-A443 PolarHBondContact O-N 2.84Å; N441-S444 PolarHBondContact O-N 3.28Å; N441-S444 PolarHBondContact O-OG 3.02Å
442	I	88.9	Confident	87	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-43.9	173.7	-75.9	170.5	0	0	0	111.7	I294 F298 A417 V420 L438 M439 S444 S445 L446	I294-I442 HydrophobicContact CG2-CB 4.49Å; I294-I442 HydrophobicContact CG2-CG1 4.3Å; I294-I442 HydrophobicContact CG2-CG2 3.88Å; F298-I442 HydrophobicContact CB-CD1 4.02Å; F298-I442 HydrophobicContact CB-CG1 4.01Å; F298-I442 HydrophobicContact CD2-CD1 3.8Å; F298-I442 HydrophobicContact CD2-CG1 4.5Å; F298-I442 HydrophobicContact CG-CD1 4.19Å; A417-I442 HydrophobicContact CB-CG2 3.71Å; V420-I442 HydrophobicContact CB-CD1 4.1Å; V420-I442 HydrophobicContact CG1-CD1 4.25Å; V420-I442 HydrophobicContact CG2-CD1 3.78Å; L438-I442 PolarHBondContact O-N 3.01Å; M439-I442 CarbonylContact O-C 3.59Å; M439-I442 PolarHBondContact O-N 2.89Å; M439-I442 VanDerWaalsContact O-N 3.09Å; M439-I442 HydrophobicContact SD-CB 4.15Å; M439-I442 HydrophobicContact SD-CG2 3.94Å; I442-S444 VanDerWaalsContact C-N 3.33Å; I442-S444 PolarHBondContact O-N 3.07Å; I442-S445 WeakPolarHBondContact O-CB 3.47Å; I442-S445 PolarHBondContact O-N 3.16Å; I442-L446 HydrophobicContact CG2-CD1 4.17Å; I442-L446 PolarHBondContact O-N 2.91Å; I442-L446 VanDerWaalsContact O-N 3.09Å
443	A	86.7	Confident	87.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.6	-42.1	178.5	0	0	0	0	0	112.3	M439 S440 N441 S445 L446 L447 V537 F541	M439-A443 WeakPolarHBondContact O-CA 3.48Å; M439-A443 WeakPolarHBondContact O-CB 3.42Å; M439-A443 PolarHBondContact O-N 3.14Å; S440-A443 WeakPolarHBondContact O-CB 3.45Å; N441-A443 VanDerWaalsContact C-N 3.33Å; N441-A443 PolarHBondContact O-N 2.84Å; A443-S445 VanDerWaalsContact C-N 3.28Å; A443-S445 PolarHBondContact O-N 3.14Å; A443-L446 PolarHBondContact O-N 3.19Å; A443-L447 VanDerWaalsContact O-CB 3.23Å; A443-L447 WeakPolarHBondContact O-CB 3.49Å; A443-L447 PolarHBondContact O-N 2.96Å; A443-V537 HydrophobicContact CB-CG1 3.31Å; A443-F541 HydrophobicContact CB-CD2 3.88Å; A443-F541 HydrophobicContact CB-CE1 4.37Å; A443-F541 HydrophobicContact CB-CE2 3.05Å; A443-F541 HydrophobicContact CB-CZ 3.34Å
444	S	85.7	Confident	87.1	Confident	54 Å²	54	29.1 Å²	29.1	38%	0.378	15%	0.147	S	C	.	.	H	α-helix	trans	-60.2	-39	177.9	77.9	0	0	0	0	111.9	S440 N441 I442 H448	S440-S444 WeakPolarHBondContact O-CB 3.19Å; S440-S444 PolarHBondContact O-N 3.03Å; N441-S444 PolarHBondContact O-N 3.28Å; N441-S444 PolarHBondContact O-OG 3.02Å; I442-S444 VanDerWaalsContact C-N 3.33Å; I442-S444 PolarHBondContact O-N 3.07Å; S444-H448 WeakPolarHBondContact O-CB 3.41Å; S444-H448 PolarHBondContact O-N 3.19Å
445	S	87.5	Confident	86.8	Confident	20 Å²	20	29.9 Å²	29.9	14%	0.14	15%	0.149	C	C	.	.	H	α-helix	trans	-68	-45.5	175.4	-57.1	0	0	0	0	112	S297 I442 A443 H448 F449	S297-S445 WeakPolarHBondContact CB-OG 3.42Å; S297-S445 PolarHBondContact OG-OG 2.81Å; I442-S445 WeakPolarHBondContact O-CB 3.47Å; I442-S445 PolarHBondContact O-N 3.16Å; A443-S445 VanDerWaalsContact C-N 3.28Å; A443-S445 PolarHBondContact O-N 3.14Å; S445-H448 WeakPolarHBondContact O-CB 3.23Å; S445-H448 PolarHBondContact O-N 3.22Å; S445-F449 VanDerWaalsContact O-CD2 3.24Å; S445-F449 WeakPolarHBondContact O-CD2 3.3Å; S445-F449 PolarHBondContact O-N 3.24Å; S445-F449 VanDerWaalsContact O-N 3.15Å
446	L	86.8	Confident	86.4	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-42.9	175.9	-78.2	171.6	0	0	0	112.3	I294 A417 I442 A443 H448 F449 I450 P492 F494	I294-L446 HydrophobicContact CD1-CD2 3.44Å; I294-L446 VanDerWaalsContact CD1-CD2 3.44Å; I294-L446 HydrophobicContact CD1-CG 3.81Å; A417-L446 HydrophobicContact CB-CD1 3.69Å; I442-L446 HydrophobicContact CG2-CD1 4.17Å; I442-L446 PolarHBondContact O-N 2.91Å; I442-L446 VanDerWaalsContact O-N 3.09Å; A443-L446 PolarHBondContact O-N 3.19Å; L446-H448 VanDerWaalsContact C-N 3.27Å; L446-H448 PolarHBondContact O-N 3.19Å; L446-F449 PolarHBondContact O-N 2.83Å; L446-I450 WeakPolarHBondContact O-CB 3.46Å; L446-I450 VanDerWaalsContact O-CG1 3.29Å; L446-I450 WeakPolarHBondContact O-CG1 3.44Å; L446-I450 PolarHBondContact O-N 2.96Å; L446-P492 HydrophobicContact CD1-CG 3.99Å; L446-F494 HydrophobicContact CD1-CZ 3.93Å
447	L	85.2	Confident	86	Confident	29 Å²	29	26.2 Å²	26.2	15%	0.152	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-31.7	175.2	-176.8	65.1	0	0	0	111.4	A443 S451 L534 V537 M540	A443-L447 VanDerWaalsContact O-CB 3.23Å; A443-L447 WeakPolarHBondContact O-CB 3.49Å; A443-L447 PolarHBondContact O-N 2.96Å; L447-S451 WeakPolarHBondContact O-CB 3.29Å; L447-S451 PolarHBondContact O-N 3.14Å; L447-S451 PolarHBondContact O-OG 3.43Å; L447-L534 HydrophobicContact CD1-CD1 3.93Å; L447-L534 HydrophobicContact CD2-CD1 4.19Å; L447-V537 HydrophobicContact CD2-CG2 4.32Å; L447-M540 HydrophobicContact CB-CE 4.26Å; L447-M540 HydrophobicContact CB-SD 4.34Å; L447-M540 HydrophobicContact CD1-CE 3.63Å
448	H	86.1	Confident	85.7	Confident	110 Å²	110	28.1 Å²	28.1	51%	0.509	15%	0.148	S	C	.	.	H	α-helix	trans	-63.2	-48.2	171.5	-175	61.9	0	0	0	111.7	S444 S445 L446 S451 K452	S444-H448 WeakPolarHBondContact O-CB 3.41Å; S444-H448 PolarHBondContact O-N 3.19Å; S445-H448 WeakPolarHBondContact O-CB 3.23Å; S445-H448 PolarHBondContact O-N 3.22Å; L446-H448 VanDerWaalsContact C-N 3.27Å; L446-H448 PolarHBondContact O-N 3.19Å; H448-S451 PolarHBondContact O-N 3.34Å; H448-S451 PolarHBondContact O-OG 2.78Å; H448-K452 WeakPolarHBondContact O-CB 3.25Å; H448-K452 PolarHBondContact O-N 3.47Å
449	F	87.4	Confident	85.4	Confident	21 Å²	21	30.4 Å²	30.4	9%	0.092	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-47.2	175.1	-66.2	-55.2	0	0	0	112.5	T293 I294 S445 L446 S451 K452 W453 D460 F466	T293-F449 HydrophobicContact CG2-CZ 4.14Å; T293-F449 VanDerWaalsContact OG1-CE2 3.23Å; T293-F449 WeakPolarHBondContact OG1-CE2 3.4Å; T293-F449 WeakPolarHBondContact OG1-CZ 3.37Å; I294-F449 HydrophobicContact CD1-CE2 4.37Å; I294-F449 HydrophobicContact CG1-CE2 4.18Å; S445-F449 VanDerWaalsContact O-CD2 3.24Å; S445-F449 WeakPolarHBondContact O-CD2 3.3Å; S445-F449 PolarHBondContact O-N 3.24Å; S445-F449 VanDerWaalsContact O-N 3.15Å; L446-F449 PolarHBondContact O-N 2.83Å; F449-S451 VanDerWaalsContact C-N 3.33Å; F449-S451 PolarHBondContact O-N 3.3Å; F449-K452 PolarHBondContact O-N 2.87Å; F449-W453 VanDerWaalsContact O-CB 3.3Å; F449-W453 WeakPolarHBondContact O-CB 3.36Å; F449-W453 PolarHBondContact O-N 3.08Å; F449-D460 WeakPolarHBondContact CE1-O 3.26Å; F449-F466 HydrophobicContact CB-CD2 3.76Å; F449-F466 HydrophobicContact CB-CE2 4Å; F449-F466 HydrophobicContact CB-CG 4.37Å; F449-F466 HydrophobicContact CG-CD2 4.48Å
450	I	87.5	Confident	84.8	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-42.8	178.4	-68.7	169.2	0	0	0	110.4	L446 I454 F466 F467 I495 I503 M540	L446-I450 WeakPolarHBondContact O-CB 3.46Å; L446-I450 VanDerWaalsContact O-CG1 3.29Å; L446-I450 WeakPolarHBondContact O-CG1 3.44Å; L446-I450 PolarHBondContact O-N 2.96Å; I450-I454 HydrophobicContact CG2-CD1 3.47Å; I450-I454 VanDerWaalsContact CG2-CD1 3.47Å; I450-I454 HydrophobicContact CG2-CG1 4.15Å; I450-I454 WeakPolarHBondContact O-CB 3.49Å; I450-I454 WeakPolarHBondContact O-CG1 3.45Å; I450-I454 PolarHBondContact O-N 3.3Å; I450-F466 HydrophobicContact CG1-CE2 3.7Å; I450-F466 HydrophobicContact CG1-CZ 4.17Å; I450-F467 HydrophobicContact CD1-CE1 4.26Å; I450-F467 HydrophobicContact CG1-CE1 4.3Å; I450-F467 HydrophobicContact CG1-CZ 4.43Å; I450-I495 HydrophobicContact CD1-CD1 3.89Å; I450-I503 HydrophobicContact CG2-CD1 4.34Å; I450-I503 HydrophobicContact CG2-CG2 4.47Å; I450-M540 HydrophobicContact CD1-CE 3.58Å; I450-M540 HydrophobicContact CD1-SD 4.41Å
451	S	84.9	Confident	84.6	Confident	34 Å²	34	34 Å²	34	24%	0.238	18%	0.177	C	C	.	.	H	α-helix	trans	-70	-41.8	178.7	59	0	0	0	0	112.7	L447 H448 F449 W453 I454 Y455	L447-S451 WeakPolarHBondContact O-CB 3.29Å; L447-S451 PolarHBondContact O-N 3.14Å; L447-S451 PolarHBondContact O-OG 3.43Å; H448-S451 PolarHBondContact O-N 3.34Å; H448-S451 PolarHBondContact O-OG 2.78Å; F449-S451 VanDerWaalsContact C-N 3.33Å; F449-S451 PolarHBondContact O-N 3.3Å; S451-W453 VanDerWaalsContact C-N 3.32Å; S451-W453 PolarHBondContact O-N 2.83Å; S451-I454 PolarHBondContact O-N 3.45Å; S451-Y455 WeakPolarHBondContact O-CB 3.46Å; S451-Y455 WeakPolarHBondContact O-CD2 3.23Å; S451-Y455 PolarHBondContact O-N 3.44Å
452	K	85.6	Confident	84.4	Confident	52 Å²	52	36.1 Å²	36.1	23%	0.226	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-42.7	174.3	-168.4	175.3	-178.5	165.6	0	111.6	H448 F449 D456 G457 H458 D460	H448-K452 WeakPolarHBondContact O-CB 3.25Å; H448-K452 PolarHBondContact O-N 3.47Å; F449-K452 PolarHBondContact O-N 2.87Å; K452-D456 WeakPolarHBondContact O-CA 3.48Å; K452-D456 WeakPolarHBondContact O-CB 3.3Å; K452-D456 PolarHBondContact O-N 2.92Å; K452-G457 PolarHBondContact O-N 3.3Å; K452-H458 HydrophobicContact CG-CB 4.5Å; K452-D460 HydrophobicContact CD-CB 4.12Å; K452-D460 VanDerWaalsContact NZ-CB 3.34Å; K452-D460 IonicContact NZ-OD2 3.94Å; K452-D460 PolarHBondContact NZ-OD2 2.89Å
453	W	89.1	Confident	84	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-45.7	175	-179.7	-105.7	0	0	0	112.8	F449 S451 G457 L459 F466 V468 Y484 I503 N511	F449-W453 VanDerWaalsContact O-CB 3.3Å; F449-W453 WeakPolarHBondContact O-CB 3.36Å; F449-W453 PolarHBondContact O-N 3.08Å; S451-W453 VanDerWaalsContact C-N 3.32Å; S451-W453 PolarHBondContact O-N 2.83Å; W453-G457 WeakPolarHBondContact CZ3-O 3.07Å; W453-G457 WeakPolarHBondContact O-CA 3.32Å; W453-G457 PolarHBondContact O-N 3.15Å; W453-G457 VanDerWaalsContact O-N 3.12Å; W453-L459 HydrophobicContact CE3-CB 3.88Å; W453-L459 HydrophobicContact CZ3-CB 3.8Å; W453-F466 HydrophobicContact CB-CE1 4.33Å; W453-F466 HydrophobicContact CB-CZ 4.38Å; W453-F466 HydrophobicContact CG-CE1 4.14Å; W453-F466 HydrophobicContact CG-CZ 4.41Å; W453-V468 HydrophobicContact CH2-CG1 4.16Å; W453-V468 HydrophobicContact CZ2-CG1 3.96Å; W453-Y484 AromaticContact CH2-CD1 3.58Å; W453-Y484 HydrophobicContact CH2-CD1 3.58Å; W453-Y484 AromaticContact CH2-CE1 3.48Å; W453-Y484 HydrophobicContact CH2-CE1 3.48Å; W453-Y484 VanDerWaalsContact CH2-CE1 3.48Å; W453-Y484 HydrophobicContact CH2-CE2 4.45Å; W453-Y484 HydrophobicContact CH2-CG 4.13Å; W453-Y484 AromaticContact CH2-CZ 3.96Å; W453-Y484 HydrophobicContact CZ2-CD1 4.44Å; W453-Y484 HydrophobicContact CZ3-CD1 4.29Å; W453-Y484 AromaticContact CZ3-CE1 3.87Å; W453-Y484 HydrophobicContact CZ3-CE1 3.87Å; W453-I503 PolarHBondContact NE1-O 2.85Å; W453-N511 WeakPolarHBondContact CH2-ND2 3.26Å; W453-N511 WeakPolarHBondContact CZ3-ND2 3.49Å
454	I	85.3	Confident	83.8	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-71	-38.4	-178.9	-75.6	178.4	0	0	0	112.3	I450 S451 I503 T506 I510 R526 L553 V556	I450-I454 HydrophobicContact CG2-CD1 3.47Å; I450-I454 VanDerWaalsContact CG2-CD1 3.47Å; I450-I454 HydrophobicContact CG2-CG1 4.15Å; I450-I454 WeakPolarHBondContact O-CB 3.49Å; I450-I454 WeakPolarHBondContact O-CG1 3.45Å; I450-I454 PolarHBondContact O-N 3.3Å; S451-I454 PolarHBondContact O-N 3.45Å; I454-I503 HydrophobicContact CD1-CG1 4.21Å; I454-I503 HydrophobicContact CD1-CG2 4.36Å; I454-I503 HydrophobicContact CG1-CG2 4.2Å; I454-T506 HydrophobicContact CG1-CG2 4.48Å; I454-T506 HydrophobicContact CG2-CG2 4.18Å; I454-I510 WeakPolarHBondContact O-CD1 3.47Å; I454-R526 PolarHBondContact O-NH2 3.46Å; I454-L553 HydrophobicContact CD1-CD1 3.87Å; I454-V556 HydrophobicContact CG2-CB 4.32Å; I454-V556 HydrophobicContact CG2-CG1 3.49Å; I454-V556 VanDerWaalsContact CG2-CG1 3.49Å
455	Y	81.3	Confident	83.8	Confident	30 Å²	30	44.2 Å²	44.2	12%	0.118	22%	0.221	C	C	.	.	H	α-helix	trans	-92.6	-40.2	-175.3	-67.8	-69.6	0	0	0	113.8	S451 I529 R530 V556	S451-Y455 WeakPolarHBondContact O-CB 3.46Å; S451-Y455 WeakPolarHBondContact O-CD2 3.23Å; S451-Y455 PolarHBondContact O-N 3.44Å; Y455-I529 HydrophobicContact CE1-CB 4.26Å; Y455-I529 HydrophobicContact CE1-CG2 3.81Å; Y455-R530 HydrophobicContact CD1-CG 4.19Å; Y455-R530 HydrophobicContact CG-CG 4.25Å; Y455-V556 HydrophobicContact CE1-CG2 4.42Å
456	D	80.3	Confident	83.7	Confident	56 Å²	56	43.3 Å²	43.3	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-109.3	-12.6	-172.7	-50.9	-32.1	0	0	0	112.1	K452 H458 I514 R530	K452-D456 WeakPolarHBondContact O-CA 3.48Å; K452-D456 WeakPolarHBondContact O-CB 3.3Å; K452-D456 PolarHBondContact O-N 2.92Å; D456-H458 PolarHBondContact O-N 3.05Å; D456-H458 PolarHBondContact O-ND1 2.76Å; D456-I514 WeakPolarHBondContact O-CD1 3.35Å; D456-R530 IonicContact OD1-CZ 2.72Å; D456-R530 IonicContact OD1-NE 3.13Å; D456-R530 IonicContact OD1-NH2 3.73Å; D456-R530 PolarHBondContact OD1-NH2 3.21Å
457	G	78.1	Confident	83.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.215	C	C	.	.			trans	73.4	-7.5	-173.3	0	0	0	0	0	114.3	K452 W453 L459 N511	K452-G457 PolarHBondContact O-N 3.3Å; W453-G457 WeakPolarHBondContact CZ3-O 3.07Å; W453-G457 WeakPolarHBondContact O-CA 3.32Å; W453-G457 PolarHBondContact O-N 3.15Å; W453-G457 VanDerWaalsContact O-N 3.12Å; G457-L459 PolarHBondContact O-N 3.4Å; G457-N511 VanDerWaalsContact O-CG 3.31Å; G457-N511 PolarHBondContact O-ND2 2.86Å; G457-N511 PolarHBondContact O-OD1 3.23Å; G457-N511 VanDerWaalsContact O-OD1 3.07Å
458	H	81.9	Confident	84.1	Confident	103 Å²	103	42 Å²	42	48%	0.477	21%	0.208	S	C	.	.			trans	-82	116.2	-171	-72.9	57.2	0	0	0	111.3	K452 D456	K452-H458 HydrophobicContact CG-CB 4.5Å; D456-H458 PolarHBondContact O-N 3.05Å; D456-H458 PolarHBondContact O-ND1 2.76Å
459	L	82.1	Confident	84.1	Confident	48 Å²	48	40.4 Å²	40.4	25%	0.251	20%	0.201	S	C	.	.			trans	-83.4	111.9	169.2	-177.8	64.4	0	0	0	109.3	W453 G457 D461 F466	W453-L459 HydrophobicContact CE3-CB 3.88Å; W453-L459 HydrophobicContact CZ3-CB 3.8Å; G457-L459 PolarHBondContact O-N 3.4Å; L459-D461 HydrophobicContact CD1-CB 4Å; L459-D461 HydrophobicContact CG-CB 4.29Å; L459-F466 HydrophobicContact CD1-CB 4.37Å; L459-F466 HydrophobicContact CD1-CD1 3.44Å; L459-F466 VanDerWaalsContact CD1-CD1 3.44Å; L459-F466 HydrophobicContact CD1-CE1 4.12Å; L459-F466 HydrophobicContact CD1-CG 4.27Å
460	D	77.4	Confident	84.1	Confident	86 Å²	86	41.9 Å²	41.9	46%	0.46	21%	0.214	S	C	.	.			trans	-121.2	75.5	177.4	-171.5	11.4	0	0	0	108.4	F449 K452 P462	F449-D460 WeakPolarHBondContact CE1-O 3.26Å; K452-D460 HydrophobicContact CD-CB 4.12Å; K452-D460 VanDerWaalsContact NZ-CB 3.34Å; K452-D460 IonicContact NZ-OD2 3.94Å; K452-D460 PolarHBondContact NZ-OD2 2.89Å; D460-P462 VanDerWaalsContact C-CD 3.48Å; D460-P462 WeakPolarHBondContact O-CD 3.41Å
461	D	83.4	Confident	83.9	Confident	25 Å²	25	44.5 Å²	44.5	13%	0.134	23%	0.228	C	C	.	.			trans	-120.4	76.1	-177.1	-179.1	16.5	0	0	0	110.5	L459 Y463 Q464 E465 F466 R487	L459-D461 HydrophobicContact CD1-CB 4Å; L459-D461 HydrophobicContact CG-CB 4.29Å; D461-Y463 PolarHBondContact O-N 3.37Å; D461-Q464 WeakPolarHBondContact OD1-CA 3.48Å; D461-Q464 PolarHBondContact OD1-N 3.14Å; D461-Q464 WeakPolarHBondContact OD2-CA 3.46Å; D461-E465 VanDerWaalsContact CG-N 3.27Å; D461-E465 PolarHBondContact OD1-N 3.28Å; D461-E465 PolarHBondContact OD2-N 3.25Å; D461-F466 HydrophobicContact CB-CB 4.19Å; D461-F466 PolarHBondContact OD2-N 3.43Å; D461-R487 IonicContact OD2-NH2 3.07Å; D461-R487 PolarHBondContact OD2-NH2 2.89Å
462	P	80.9	Confident	83.8	Confident	86 Å²	86	48.9 Å²	48.9	56%	0.558	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-16	-178.6	26.6	-34.4	0	0	0	114	D460	D460-P462 VanDerWaalsContact C-CD 3.48Å; D460-P462 WeakPolarHBondContact O-CD 3.41Å
463	Y	81.6	Confident	83.5	Confident	99 Å²	99	50.9 Å²	50.9	39%	0.388	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	9.9	-174.9	-58	-63.3	0	0	0	114	R289 D461 E465	R289-Y463 WeakPolarHBondContact O-CE1 3.38Å; R289-Y463 PolarHBondContact O-OH 3.39Å; D461-Y463 PolarHBondContact O-N 3.37Å; Y463-E465 VanDerWaalsContact C-N 3.29Å; Y463-E465 PolarHBondContact O-N 3.48Å
464	Q	82.9	Confident	82.9	Confident	122 Å²	122	51.8 Å²	51.8	57%	0.57	28%	0.282	S	S	*	.	S	Bend	trans	60.6	34.5	177.2	-82.6	-172.9	2.4	0	0	113.7	D461 R487	D461-Q464 WeakPolarHBondContact OD1-CA 3.48Å; D461-Q464 PolarHBondContact OD1-N 3.14Å; D461-Q464 WeakPolarHBondContact OD2-CA 3.46Å; Q464-R487 PolarHBondContact O-NH1 3.2Å; Q464-R487 PolarHBondContact O-NH2 2.71Å
465	E	84	Confident	82.2	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.009	31%	0.314	C	S	.	.			trans	-86.6	-24.3	-177.5	-69.4	-178	105.5	0	0	115	G292 T293 I294 G414 D461 Y463	G292-E465 VanDerWaalsContact C-OE1 3.25Å; G292-E465 VanDerWaalsContact C-OE2 3.32Å; G292-E465 VanDerWaalsContact CA-OE1 3.27Å; G292-E465 WeakPolarHBondContact CA-OE1 3.24Å; G292-E465 WeakPolarHBondContact CA-OE2 3.39Å; T293-E465 VanDerWaalsContact N-CD 3.32Å; T293-E465 PolarHBondContact N-OE1 2.95Å; T293-E465 PolarHBondContact N-OE2 2.77Å; T293-E465 PolarHBondContact OG1-OE2 2.76Å; I294-E465 VanDerWaalsContact CB-OE1 3.27Å; I294-E465 WeakPolarHBondContact CB-OE1 3.47Å; I294-E465 HydrophobicContact CD1-CB 4.17Å; I294-E465 WeakPolarHBondContact CG1-OE1 3.33Å; I294-E465 PolarHBondContact N-OE1 3.47Å; G414-E465 PolarHBondContact N-O 3.07Å; D461-E465 VanDerWaalsContact CG-N 3.27Å; D461-E465 PolarHBondContact OD1-N 3.28Å; D461-E465 PolarHBondContact OD2-N 3.25Å; Y463-E465 VanDerWaalsContact C-N 3.29Å; Y463-E465 PolarHBondContact O-N 3.48Å
466	F	87.3	Confident	81.5	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.009	33%	0.33	C	S	.	.	S	Bend	trans	-90.6	145.7	-172.2	-170.8	-119.4	0	0	0	112.6	F449 I450 W453 L459 D461 V468 R487	F449-F466 HydrophobicContact CB-CD2 3.76Å; F449-F466 HydrophobicContact CB-CE2 4Å; F449-F466 HydrophobicContact CB-CG 4.37Å; F449-F466 HydrophobicContact CG-CD2 4.48Å; I450-F466 HydrophobicContact CG1-CE2 3.7Å; I450-F466 HydrophobicContact CG1-CZ 4.17Å; W453-F466 HydrophobicContact CB-CE1 4.33Å; W453-F466 HydrophobicContact CB-CZ 4.38Å; W453-F466 HydrophobicContact CG-CE1 4.14Å; W453-F466 HydrophobicContact CG-CZ 4.41Å; L459-F466 HydrophobicContact CD1-CB 4.37Å; L459-F466 HydrophobicContact CD1-CD1 3.44Å; L459-F466 VanDerWaalsContact CD1-CD1 3.44Å; L459-F466 HydrophobicContact CD1-CE1 4.12Å; L459-F466 HydrophobicContact CD1-CG 4.27Å; D461-F466 HydrophobicContact CB-CB 4.19Å; D461-F466 PolarHBondContact OD2-N 3.43Å; F466-V468 VanDerWaalsContact C-N 3.25Å; F466-V468 HydrophobicContact CD1-CB 3.69Å; F466-V468 HydrophobicContact CD1-CG2 4.06Å; F466-V468 HydrophobicContact CE1-CB 3.58Å; F466-V468 HydrophobicContact CE1-CG2 3.47Å; F466-V468 VanDerWaalsContact CE1-CG2 3.47Å; F466-V468 HydrophobicContact CZ-CG2 4.21Å; F466-V468 PolarHBondContact O-N 3.12Å; F466-R487 VanDerWaalsContact O-CZ 3.26Å; F466-R487 PolarHBondContact O-NE 3.24Å; F466-R487 PolarHBondContact O-NH2 2.86Å
467	F	89.2	Confident	81	Confident	1 Å²	1	64.4 Å²	64.4	0%	0.004	34%	0.342	C	S	.	.	S	Bend	trans	-71.5	-13.5	-175.8	57.7	-100	0	0	0	114.9	I450 L486 R487 M490 I491 I495 A500 I503	I450-F467 HydrophobicContact CD1-CE1 4.26Å; I450-F467 HydrophobicContact CG1-CE1 4.3Å; I450-F467 HydrophobicContact CG1-CZ 4.43Å; F467-L486 HydrophobicContact CD2-CD2 3.68Å; F467-L486 HydrophobicContact CE2-CD2 4.24Å; F467-L486 CarbonylContact O-C 3.59Å; F467-L486 WeakPolarHBondContact O-CA 3.39Å; F467-R487 PolarHBondContact O-N 3.05Å; F467-M490 HydrophobicContact CB-CB 4.34Å; F467-I491 HydrophobicContact CB-CG1 3.75Å; F467-I491 HydrophobicContact CG-CG1 4.24Å; F467-I495 HydrophobicContact CE1-CD1 4.01Å; F467-A500 HydrophobicContact CE2-CB 4.39Å; F467-I503 HydrophobicContact CE2-CB 4.41Å; F467-I503 HydrophobicContact CE2-CG2 4.13Å; F467-I503 HydrophobicContact CZ-CB 4.33Å; F467-I503 HydrophobicContact CZ-CD1 3.93Å; F467-I503 HydrophobicContact CZ-CG2 3.93Å
468	V	89.4	Confident	80.8	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.4	168.7	-176	0	0	0	0	109.4	W453 F466 Y484 N485 L486 L504	W453-V468 HydrophobicContact CH2-CG1 4.16Å; W453-V468 HydrophobicContact CZ2-CG1 3.96Å; F466-V468 VanDerWaalsContact C-N 3.25Å; F466-V468 HydrophobicContact CD1-CB 3.69Å; F466-V468 HydrophobicContact CD1-CG2 4.06Å; F466-V468 HydrophobicContact CE1-CB 3.58Å; F466-V468 HydrophobicContact CE1-CG2 3.47Å; F466-V468 VanDerWaalsContact CE1-CG2 3.47Å; F466-V468 HydrophobicContact CZ-CG2 4.21Å; F466-V468 PolarHBondContact O-N 3.12Å; V468-Y484 HydrophobicContact CG1-CD1 4.27Å; V468-N485 WeakPolarHBondContact CA-O 3.43Å; V468-L486 HydrophobicContact CG2-CD2 4.24Å; V468-L504 HydrophobicContact CB-CD1 4.4Å; V468-L504 HydrophobicContact CG1-CD1 3.75Å; V468-L504 HydrophobicContact CG2-CD1 3.84Å
469	E	87.5	Confident	80.7	Confident	77 Å²	77	65.8 Å²	65.8	36%	0.36	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.9	171.5	-176.8	169.5	-163.7	0	0	109.9	Y484 N485 R487	E469-Y484 WeakPolarHBondContact O-CA 3.47Å; E469-N485 PolarHBondContact N-O 2.99Å; E469-N485 PolarHBondContact O-N 3.14Å; E469-R487 HydrophobicContact CB-CG 3.92Å; E469-R487 WeakPolarHBondContact OE2-CD 3.19Å; E469-R487 WeakPolarHBondContact OE2-CG 3.16Å
470	S	85.8	Confident	80.6	Confident	52 Å²	52	64.6 Å²	64.6	36%	0.364	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.8	169.6	63.5	0	0	0	0	111.2	P472 K483	S470-P472 WeakPolarHBondContact O-CD 3.42Å; S470-K483 CarbonylContact C-O 3.6Å; S470-K483 VanDerWaalsContact CA-O 3.25Å; S470-K483 WeakPolarHBondContact CA-O 3.4Å
471	D	85.1	Confident	80.8	Confident	57 Å²	57	64.3 Å²	64.3	31%	0.305	33%	0.328	S	S	.	.			trans	-80.2	114.6	169.6	-175	-13.8	0	0	0	109.7	S473 V474 K483	D471-S473 VanDerWaalsContact C-N 3.26Å; D471-S473 VanDerWaalsContact CG-OG 3.23Å; D471-S473 PolarHBondContact O-N 2.8Å; D471-S473 VanDerWaalsContact OD1-CB 3.22Å; D471-S473 WeakPolarHBondContact OD1-CB 3.25Å; D471-S473 PolarHBondContact OD1-N 3.35Å; D471-S473 PolarHBondContact OD1-OG 3.44Å; D471-S473 PolarHBondContact OD2-OG 2.91Å; D471-S473 VanDerWaalsContact OD2-OG 3.13Å; D471-V474 HydrophobicContact CB-CG2 4.15Å; D471-K483 PolarHBondContact N-O 2.79Å
472	P	81.2	Confident	80.7	Confident	126 Å²	126	67 Å²	67	82%	0.818	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-9.9	179.6	33.3	-36.6	0	0	0	113.6	S470 V474	S470-P472 WeakPolarHBondContact O-CD 3.42Å; P472-V474 VanDerWaalsContact C-N 3.33Å
473	S	79.4	Confident	80.9	Confident	94 Å²	94	63.9 Å²	63.9	66%	0.657	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-16.9	-178.4	75.9	0	0	0	0	113.6	D471	D471-S473 VanDerWaalsContact C-N 3.26Å; D471-S473 VanDerWaalsContact CG-OG 3.23Å; D471-S473 PolarHBondContact O-N 2.8Å; D471-S473 VanDerWaalsContact OD1-CB 3.22Å; D471-S473 WeakPolarHBondContact OD1-CB 3.25Å; D471-S473 PolarHBondContact OD1-N 3.35Å; D471-S473 PolarHBondContact OD1-OG 3.44Å; D471-S473 PolarHBondContact OD2-OG 2.91Å; D471-S473 VanDerWaalsContact OD2-OG 3.13Å
474	V	77.8	Confident	81.2	Confident	20 Å²	20	59.6 Å²	59.6	12%	0.121	30%	0.303	C	S	.	.	S	Bend	trans	-82.8	127.5	-174.2	178.9	0	0	0	0	111.6	D471 P472 R478 D482 K483	D471-V474 HydrophobicContact CB-CG2 4.15Å; P472-V474 VanDerWaalsContact C-N 3.33Å; V474-R478 HydrophobicContact CG1-CB 3.9Å; V474-D482 HydrophobicContact CG1-CB 4.14Å; V474-D482 HydrophobicContact CG2-CB 3.81Å; V474-K483 HydrophobicContact CB-CB 4.19Å; V474-K483 HydrophobicContact CG1-CB 4.15Å
475	K	70.5	Confident	81.4	Confident	158 Å²	158	57.4 Å²	57.4	69%	0.687	30%	0.295	S	S	*	.			trans	-63.1	149.8	172.1	-68.4	-172.6	176.6	-171.9	0	111.8	D477 R478	K475-D477 PolarHBondContact O-N 3.04Å; K475-D477 VanDerWaalsContact O-N 3.1Å; K475-R478 PolarHBondContact O-N 3.03Å
476	M	66.9	Low	81.6	Confident	91 Å²	91	58.8 Å²	58.8	45%	0.448	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-56.2	-32.3	-176.2	-62	-60.1	127.9	0	0	113.6	R478 L479	M476-R478 PolarHBondContact O-N 3.17Å; M476-R478 VanDerWaalsContact O-N 3.17Å; M476-L479 WeakPolarHBondContact O-CB 3.1Å; M476-L479 PolarHBondContact O-N 2.84Å; M476-L479 HydrophobicContact SD-CD1 4.22Å
477	D	68	Low	81.7	Confident	104 Å²	104	60.6 Å²	60.6	56%	0.556	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-61.1	-25.1	178.5	-30.9	-37.4	0	0	0	113.1	K475	K475-D477 PolarHBondContact O-N 3.04Å; K475-D477 VanDerWaalsContact O-N 3.1Å
478	R	75.4	Confident	81.5	Confident	132 Å²	132	67 Å²	67	50%	0.498	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-109.3	19.5	176.8	-64	-172.3	-179.7	-175.3	-1	113.2	V474 K475 M476 W480 Y481 D482 D674	V474-R478 HydrophobicContact CG1-CB 3.9Å; K475-R478 PolarHBondContact O-N 3.03Å; M476-R478 PolarHBondContact O-N 3.17Å; M476-R478 VanDerWaalsContact O-N 3.17Å; R478-W480 PolarHBondContact O-N 2.99Å; R478-Y481 PolarHBondContact O-N 3.1Å; R478-D482 PolarHBondContact O-N 3.48Å; R478-D674 IonicContact CZ-OD2 2.74Å; R478-D674 IonicContact NE-OD2 3.52Å; R478-D674 IonicContact NH2-OD2 2.84Å; R478-D674 PolarHBondContact NH2-OD2 2.95Å
479	L	78.1	Confident	81.3	Confident	0 Å²	0	74 Å²	74	0%	0	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-36	178.8	176.1	147.9	0	0	0	113.4	M476 K483 Y484 F512 H515	M476-L479 WeakPolarHBondContact O-CB 3.1Å; M476-L479 PolarHBondContact O-N 2.84Å; M476-L479 HydrophobicContact SD-CD1 4.22Å; L479-K483 HydrophobicContact CB-CD 4.2Å; L479-K483 HydrophobicContact CD1-CD 3.81Å; L479-K483 HydrophobicContact CG-CD 3.73Å; L479-K483 WeakPolarHBondContact O-CB 3.22Å; L479-Y484 HydrophobicContact CD1-CE2 4.28Å; L479-Y484 HydrophobicContact CD2-CE2 4.01Å; L479-Y484 HydrophobicContact CG-CD2 4.49Å; L479-Y484 HydrophobicContact CG-CE2 3.85Å; L479-F512 HydrophobicContact CD2-CB 4.29Å; L479-H515 HydrophobicContact CD1-CB 4.45Å
480	W	81.1	Confident	81.2	Confident	23 Å²	23	72.2 Å²	72.2	9%	0.087	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-44.3	-177	-164.4	-105	0	0	0	112.6	R478 K508 F512 L564 L765	R478-W480 PolarHBondContact O-N 2.99Å; W480-K508 HydrophobicContact CE3-CB 4.23Å; W480-K508 HydrophobicContact CH2-CB 4.29Å; W480-K508 HydrophobicContact CZ3-CB 3.88Å; W480-K508 PolarHBondContact O-NZ 2.67Å; W480-F512 HydrophobicContact CE3-CB 4.27Å; W480-F512 HydrophobicContact CE3-CD2 4.43Å; W480-F512 HydrophobicContact CE3-CG 4.4Å; W480-F512 HydrophobicContact CZ3-CB 4.16Å; W480-F512 HydrophobicContact CZ3-CG 4.48Å; W480-L564 HydrophobicContact CH2-CD2 4.39Å; W480-L765 HydrophobicContact CD2-CD2 4.32Å; W480-L765 HydrophobicContact CE3-CD2 4.28Å; W480-L765 HydrophobicContact CH2-CB 4.31Å; W480-L765 HydrophobicContact CH2-CD2 3.89Å; W480-L765 HydrophobicContact CH2-CG 4.48Å; W480-L765 HydrophobicContact CZ2-CB 4.1Å; W480-L765 HydrophobicContact CZ2-CD2 3.92Å; W480-L765 HydrophobicContact CZ2-CG 4.14Å; W480-L765 HydrophobicContact CZ3-CD2 4.06Å
481	Y	80.5	Confident	81.3	Confident	80 Å²	80	71 Å²	71	31%	0.314	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-68.8	-174.3	-61.2	-73.4	0	0	0	111.8	R478 T670 T673	R478-Y481 PolarHBondContact O-N 3.1Å; Y481-T670 PolarHBondContact OH-O 3.14Å; Y481-T673 HydrophobicContact CE2-CG2 3.79Å; Y481-T673 WeakPolarHBondContact OH-CG2 3.36Å
482	D	82.1	Confident	81.2	Confident	80 Å²	80	68.3 Å²	68.3	43%	0.428	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-27.8	-160.1	-52.1	-37.5	0	0	0	113.6	V474 R478 Y484 N485	V474-D482 HydrophobicContact CG1-CB 4.14Å; V474-D482 HydrophobicContact CG2-CB 3.81Å; R478-D482 PolarHBondContact O-N 3.48Å; D482-Y484 VanDerWaalsContact C-N 3.32Å; D482-Y484 PolarHBondContact O-N 3.44Å; D482-N485 PolarHBondContact O-ND2 2.94Å
483	K	84.7	Confident	81.4	Confident	22 Å²	22	67.2 Å²	67.2	10%	0.096	33%	0.334	C	S	.	.	S	Bend	trans	-65.2	-30.3	-169.5	-169.7	-170.1	179.3	-164	0	113.7	S470 D471 V474 L479	S470-K483 CarbonylContact C-O 3.6Å; S470-K483 VanDerWaalsContact CA-O 3.25Å; S470-K483 WeakPolarHBondContact CA-O 3.4Å; D471-K483 PolarHBondContact N-O 2.79Å; V474-K483 HydrophobicContact CB-CB 4.19Å; V474-K483 HydrophobicContact CG1-CB 4.15Å; L479-K483 HydrophobicContact CB-CD 4.2Å; L479-K483 HydrophobicContact CD1-CD 3.81Å; L479-K483 HydrophobicContact CG-CD 3.73Å; L479-K483 WeakPolarHBondContact O-CB 3.22Å
484	Y	88.3	Confident	81.5	Confident	9 Å²	9	63.4 Å²	63.4	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	113.5	-172.3	-62.9	-69.2	0	0	0	111.6	W453 V468 E469 L479 D482 K508 N511	W453-Y484 AromaticContact CH2-CD1 3.58Å; W453-Y484 HydrophobicContact CH2-CD1 3.58Å; W453-Y484 AromaticContact CH2-CE1 3.48Å; W453-Y484 HydrophobicContact CH2-CE1 3.48Å; W453-Y484 VanDerWaalsContact CH2-CE1 3.48Å; W453-Y484 HydrophobicContact CH2-CE2 4.45Å; W453-Y484 HydrophobicContact CH2-CG 4.13Å; W453-Y484 AromaticContact CH2-CZ 3.96Å; W453-Y484 HydrophobicContact CZ2-CD1 4.44Å; W453-Y484 HydrophobicContact CZ3-CD1 4.29Å; W453-Y484 AromaticContact CZ3-CE1 3.87Å; W453-Y484 HydrophobicContact CZ3-CE1 3.87Å; V468-Y484 HydrophobicContact CG1-CD1 4.27Å; E469-Y484 WeakPolarHBondContact O-CA 3.47Å; L479-Y484 HydrophobicContact CD1-CE2 4.28Å; L479-Y484 HydrophobicContact CD2-CE2 4.01Å; L479-Y484 HydrophobicContact CG-CD2 4.49Å; L479-Y484 HydrophobicContact CG-CE2 3.85Å; D482-Y484 VanDerWaalsContact C-N 3.32Å; D482-Y484 PolarHBondContact O-N 3.44Å; Y484-K508 HydrophobicContact CD2-CG 4Å; Y484-K508 HydrophobicContact CG-CG 4.38Å; Y484-K508 VanDerWaalsContact O-CE 3.31Å; Y484-K508 WeakPolarHBondContact O-CE 3.39Å; Y484-K508 PolarHBondContact O-NZ 3.16Å; Y484-N511 HydrophobicContact CE2-CB 4.13Å; Y484-N511 VanDerWaalsContact OH-CG 3.28Å; Y484-N511 PolarHBondContact OH-ND2 3.46Å; Y484-N511 PolarHBondContact OH-OD1 3Å
485	N	87.4	Confident	81.8	Confident	75 Å²	75	62.8 Å²	62.8	40%	0.401	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	157	-175.4	-65.9	-56.3	0	0	0	111.8	V468 E469 D482	V468-N485 WeakPolarHBondContact CA-O 3.43Å; E469-N485 PolarHBondContact N-O 2.99Å; E469-N485 PolarHBondContact O-N 3.14Å; D482-N485 PolarHBondContact O-ND2 2.94Å
486	L	88.9	Confident	82.7	Confident	32 Å²	32	58.5 Å²	58.5	17%	0.168	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.2	176.5	-75.4	173.5	0	0	0	111.1	F467 V468 H488 N501 L504	F467-L486 HydrophobicContact CD2-CD2 3.68Å; F467-L486 HydrophobicContact CE2-CD2 4.24Å; F467-L486 CarbonylContact O-C 3.59Å; F467-L486 WeakPolarHBondContact O-CA 3.39Å; V468-L486 HydrophobicContact CG2-CD2 4.24Å; L486-H488 PolarHBondContact O-N 3.45Å; L486-N501 WeakPolarHBondContact CD1-OD1 3.17Å; L486-L504 HydrophobicContact CD1-CD2 4.04Å; L486-L504 HydrophobicContact CD2-CB 4.22Å; L486-L504 HydrophobicContact CD2-CD1 4.06Å; L486-L504 HydrophobicContact CD2-CG 4.49Å; L486-L504 HydrophobicContact CG-CB 4.49Å; L486-L504 HydrophobicContact CG-CD1 4.15Å; L486-L504 HydrophobicContact CG-CD2 3.95Å; L486-L504 HydrophobicContact CG-CG 4.41Å
487	R	88.1	Confident	83.6	Confident	39 Å²	39	57.3 Å²	57.3	15%	0.147	29%	0.293	C	S	.	.			trans	-84.7	89.3	171.7	-70.4	-174.8	-72.1	165.6	-7.1	109.5	D461 Q464 F466 F467 E469 N489 M490	D461-R487 IonicContact OD2-NH2 3.07Å; D461-R487 PolarHBondContact OD2-NH2 2.89Å; Q464-R487 PolarHBondContact O-NH1 3.2Å; Q464-R487 PolarHBondContact O-NH2 2.71Å; F466-R487 VanDerWaalsContact O-CZ 3.26Å; F466-R487 PolarHBondContact O-NE 3.24Å; F466-R487 PolarHBondContact O-NH2 2.86Å; F467-R487 PolarHBondContact O-N 3.05Å; E469-R487 HydrophobicContact CB-CG 3.92Å; E469-R487 WeakPolarHBondContact OE2-CD 3.19Å; E469-R487 WeakPolarHBondContact OE2-CG 3.16Å; R487-N489 PolarHBondContact O-N 3.3Å; R487-N489 VanDerWaalsContact O-N 3.09Å; R487-M490 HydrophobicContact CB-CB 4.36Å; R487-M490 HydrophobicContact CB-CG 4.5Å; R487-M490 PolarHBondContact O-N 3.2Å
488	H	85.4	Confident	84.6	Confident	136 Å²	136	56 Å²	56	63%	0.63	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-50.5	-36	-177.4	-66.7	-71.3	0	0	0	114.2	L486 M490 I491	L486-H488 PolarHBondContact O-N 3.45Å; H488-M490 PolarHBondContact O-N 3.42Å; H488-I491 PolarHBondContact O-N 3.3Å
489	N	85.2	Confident	85.3	Confident	146 Å²	146	50.1 Å²	50.1	78%	0.781	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-67.5	-17.6	178.8	-60	2.3	0	0	0	114.2	R487	R487-N489 PolarHBondContact O-N 3.3Å; R487-N489 VanDerWaalsContact O-N 3.09Å
490	M	85.4	Confident	85.8	Confident	41 Å²	41	50.1 Å²	50.1	20%	0.202	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-104.6	4.2	177.9	-66.3	-61.1	-174.5	0	0	112.5	G414 A415 F467 R487 H488 P492	G414-M490 WeakPolarHBondContact CA-O 3.03Å; A415-M490 HydrophobicContact CB-SD 4.37Å; F467-M490 HydrophobicContact CB-CB 4.34Å; R487-M490 HydrophobicContact CB-CB 4.36Å; R487-M490 HydrophobicContact CB-CG 4.5Å; R487-M490 PolarHBondContact O-N 3.2Å; H488-M490 PolarHBondContact O-N 3.42Å; M490-P492 WeakPolarHBondContact O-CD 3.21Å
491	I	87.4	Confident	86.2	Confident	27 Å²	27	52.9 Å²	52.9	14%	0.138	29%	0.287	C	S	.	.	S	Bend	trans	-75.7	121.1	171.8	-60.1	176.4	0	0	0	107.8	F467 H488 I495 A500	F467-I491 HydrophobicContact CB-CG1 3.75Å; F467-I491 HydrophobicContact CG-CG1 4.24Å; H488-I491 PolarHBondContact O-N 3.3Å; I491-I495 HydrophobicContact CG2-CB 4.29Å; I491-A500 HydrophobicContact CD1-CB 4.12Å
492	P	84.6	Confident	86.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.281	C	S	.	.			trans	-67.9	142.5	175.7	-17.7	32	0	0	0	111.7	A417 S418 L446 M490 F494 I495	A417-P492 HydrophobicContact CB-CB 4.27Å; A417-P492 HydrophobicContact CB-CG 4.48Å; S418-P492 WeakPolarHBondContact OG-CA 3.37Å; L446-P492 HydrophobicContact CD1-CG 3.99Å; M490-P492 WeakPolarHBondContact O-CD 3.21Å; P492-F494 HydrophobicContact CB-CD1 3.76Å; P492-F494 HydrophobicContact CB-CE1 3.07Å; P492-F494 HydrophobicContact CB-CE2 4.04Å; P492-F494 HydrophobicContact CB-CG 4.45Å; P492-F494 HydrophobicContact CB-CZ 3.23Å; P492-F494 HydrophobicContact CG-CE1 4.06Å; P492-F494 HydrophobicContact CG-CE2 4.49Å; P492-F494 HydrophobicContact CG-CZ 3.75Å; P492-F494 PolarHBondContact O-N 2.96Å; P492-F494 VanDerWaalsContact O-N 3.08Å; P492-I495 HydrophobicContact CB-CG1 4.49Å; P492-I495 HydrophobicContact CG-CD1 4.19Å; P492-I495 HydrophobicContact CG-CG1 4.49Å; P492-I495 PolarHBondContact O-N 3.33Å
493	V	83.9	Confident	87.1	Confident	103 Å²	103	47.3 Å²	47.3	62%	0.624	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.2	-174.3	168.1	0	0	0	0	114.4	S418 F421 I495	S418-V493 PolarHBondContact OG-N 3.24Å; S418-V493 VanDerWaalsContact OG-N 3.07Å; F421-V493 HydrophobicContact CD1-CB 4.22Å; F421-V493 HydrophobicContact CD1-CG1 4.1Å; F421-V493 HydrophobicContact CE1-CG1 4.25Å; V493-I495 VanDerWaalsContact C-N 3.3Å; V493-I495 PolarHBondContact O-N 3.2Å
494	F	82.9	Confident	87.4	Confident	14 Å²	14	47 Å²	47	6%	0.061	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-8.2	177.3	58.5	-89.1	0	0	0	114	A417 F421 L446 P492 M540 F541 Q543	A417-F494 HydrophobicContact CB-CE1 4.26Å; F421-F494 HydrophobicContact CB-CD1 4.37Å; F421-F494 HydrophobicContact CD1-CB 4.43Å; F421-F494 HydrophobicContact CD1-CD1 4.47Å; F421-F494 HydrophobicContact CD2-CB 4.43Å; F421-F494 HydrophobicContact CD2-CD1 4.16Å; F421-F494 HydrophobicContact CE1-CB 4.09Å; F421-F494 HydrophobicContact CE2-CB 4.08Å; F421-F494 HydrophobicContact CG-CD1 4.08Å; F421-F494 HydrophobicContact CZ-CB 3.91Å; L446-F494 HydrophobicContact CD1-CZ 3.93Å; P492-F494 HydrophobicContact CB-CD1 3.76Å; P492-F494 HydrophobicContact CB-CE1 3.07Å; P492-F494 HydrophobicContact CB-CE2 4.04Å; P492-F494 HydrophobicContact CB-CG 4.45Å; P492-F494 HydrophobicContact CB-CZ 3.23Å; P492-F494 HydrophobicContact CG-CE1 4.06Å; P492-F494 HydrophobicContact CG-CE2 4.49Å; P492-F494 HydrophobicContact CG-CZ 3.75Å; P492-F494 PolarHBondContact O-N 2.96Å; P492-F494 VanDerWaalsContact O-N 3.08Å; F494-M540 HydrophobicContact CD2-CG 4.22Å; F494-M540 WeakPolarHBondContact CD2-O 3.28Å; F494-M540 HydrophobicContact CE2-CG 3.86Å; F494-M540 HydrophobicContact CE2-SD 4.23Å; F494-F541 HydrophobicContact CB-CD1 4.47Å; F494-F541 AromaticContact CD1-CD1 3.57Å; F494-F541 HydrophobicContact CD1-CD1 3.57Å; F494-F541 AromaticContact CD1-CE1 3.42Å; F494-F541 HydrophobicContact CD1-CE1 3.42Å; F494-F541 VanDerWaalsContact CD1-CE1 3.42Å; F494-F541 HydrophobicContact CD1-CZ 4.32Å; F494-F541 AromaticContact CD2-CD1 3.93Å; F494-F541 HydrophobicContact CD2-CD1 3.93Å; F494-F541 AromaticContact CD2-CE1 3.86Å; F494-F541 HydrophobicContact CD2-CE1 3.86Å; F494-F541 HydrophobicContact CD2-CE2 4.44Å; F494-F541 HydrophobicContact CD2-CG 4.34Å; F494-F541 HydrophobicContact CD2-CZ 4.09Å; F494-F541 AromaticContact CE1-CD1 3.7Å; F494-F541 HydrophobicContact CE1-CD1 3.7Å; F494-F541 AromaticContact CE1-CE1 3.01Å; F494-F541 HydrophobicContact CE1-CE1 3.01Å; F494-F541 AromaticContact CE1-CZ 3.66Å; F494-F541 HydrophobicContact CE1-CZ 3.66Å; F494-F541 HydrophobicContact CE2-CD1 4.05Å; F494-F541 AromaticContact CE2-CE1 3.5Å; F494-F541 HydrophobicContact CE2-CE1 3.5Å; F494-F541 AromaticContact CE2-CE2 3.93Å; F494-F541 HydrophobicContact CE2-CE2 3.93Å; F494-F541 AromaticContact CE2-CZ 3.39Å; F494-F541 HydrophobicContact CE2-CZ 3.39Å; F494-F541 AromaticContact CG-CD1 3.7Å; F494-F541 HydrophobicContact CG-CD1 3.7Å; F494-F541 AromaticContact CG-CE1 3.84Å; F494-F541 HydrophobicContact CG-CE1 3.84Å; F494-F541 HydrophobicContact CG-CG 4.39Å; F494-F541 AromaticContact CZ-CD1 3.95Å; F494-F541 HydrophobicContact CZ-CD1 3.95Å; F494-F541 AromaticContact CZ-CE1 3.06Å; F494-F541 HydrophobicContact CZ-CE1 3.06Å; F494-F541 HydrophobicContact CZ-CE2 4.14Å; F494-F541 AromaticContact CZ-CZ 3.15Å; F494-F541 HydrophobicContact CZ-CZ 3.15Å; F494-Q543 PolarHBondContact O-NE2 2.9Å
495	I	84.2	Confident	87.4	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.031	27%	0.268	C	S	.	.	S	Bend	trans	-98.9	114	173.3	-55.9	-172.1	0	0	0	108.7	I450 F467 I491 P492 V493 Q499 A500	I450-I495 HydrophobicContact CD1-CD1 3.89Å; F467-I495 HydrophobicContact CE1-CD1 4.01Å; I491-I495 HydrophobicContact CG2-CB 4.29Å; P492-I495 HydrophobicContact CB-CG1 4.49Å; P492-I495 HydrophobicContact CG-CD1 4.19Å; P492-I495 HydrophobicContact CG-CG1 4.49Å; P492-I495 PolarHBondContact O-N 3.33Å; V493-I495 VanDerWaalsContact C-N 3.3Å; V493-I495 PolarHBondContact O-N 3.2Å; I495-Q499 HydrophobicContact CG2-CB 3.93Å; I495-A500 HydrophobicContact CG2-CB 4.21Å
496	T	87.6	Confident	87.5	Confident	69 Å²	69	44.7 Å²	44.7	42%	0.423	25%	0.249	S	C	.	.			trans	-65.3	151.1	176.7	66.3	0	0	0	0	111.1	S498 Q499 A500	T496-S498 PolarHBondContact O-N 3.11Å; T496-S498 VanDerWaalsContact O-N 3.12Å; T496-Q499 PolarHBondContact O-N 2.92Å; T496-Q499 VanDerWaalsContact O-N 3.07Å; T496-Q499 VanDerWaalsContact OG1-CG 3.26Å; T496-Q499 WeakPolarHBondContact OG1-CG 3.21Å; T496-Q499 PolarHBondContact OG1-N 3.15Å; T496-Q499 PolarHBondContact OG1-OE1 2.82Å; T496-A500 PolarHBondContact O-N 2.9Å
497	A	87.4	Confident	87.5	Confident	65 Å²	65	43.2 Å²	43.2	54%	0.537	24%	0.241	S	C	.	.	H	α-helix	trans	-58.1	-28	175.8	0	0	0	0	0	112.9	N501	A497-N501 PolarHBondContact O-N 2.94Å; A497-N501 VanDerWaalsContact O-N 3.11Å; A497-N501 PolarHBondContact O-ND2 3.45Å
498	S	88.5	Confident	87.5	Confident	76 Å²	76	42.3 Å²	42.3	53%	0.531	24%	0.239	S	C	.	.	H	α-helix	trans	-67.4	-49.8	173.3	-175.6	0	0	0	0	111.6	T496 A500 N501 K502	T496-S498 PolarHBondContact O-N 3.11Å; T496-S498 VanDerWaalsContact O-N 3.12Å; S498-A500 PolarHBondContact O-N 3.17Å; S498-N501 PolarHBondContact O-N 3.42Å; S498-K502 PolarHBondContact O-N 3.1Å
499	Q	89.4	Confident	87.6	Confident	9 Å²	9	36 Å²	36	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-43.7	175	-70.5	159	-22.6	0	0	111.6	I495 T496 N501 K502 I503 L553	I495-Q499 HydrophobicContact CG2-CB 3.93Å; T496-Q499 PolarHBondContact O-N 2.92Å; T496-Q499 VanDerWaalsContact O-N 3.07Å; T496-Q499 VanDerWaalsContact OG1-CG 3.26Å; T496-Q499 WeakPolarHBondContact OG1-CG 3.21Å; T496-Q499 PolarHBondContact OG1-N 3.15Å; T496-Q499 PolarHBondContact OG1-OE1 2.82Å; Q499-N501 VanDerWaalsContact C-N 3.28Å; Q499-N501 PolarHBondContact O-N 3.05Å; Q499-K502 PolarHBondContact O-N 3.01Å; Q499-K502 VanDerWaalsContact O-N 3.15Å; Q499-I503 WeakPolarHBondContact O-CG1 3.36Å; Q499-I503 PolarHBondContact O-N 2.74Å; Q499-L553 HydrophobicContact CB-CD2 3.89Å; Q499-L553 HydrophobicContact CG-CD2 4Å
500	A	89.9	Confident	87.7	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-40.4	176.2	0	0	0	0	0	112.3	F467 I491 I495 T496 S498 L504	F467-A500 HydrophobicContact CE2-CB 4.39Å; I491-A500 HydrophobicContact CD1-CB 4.12Å; I495-A500 HydrophobicContact CG2-CB 4.21Å; T496-A500 PolarHBondContact O-N 2.9Å; S498-A500 PolarHBondContact O-N 3.17Å; A500-L504 WeakPolarHBondContact O-CB 3.49Å; A500-L504 PolarHBondContact O-N 3.12Å
501	N	89.6	Confident	87.7	Confident	81 Å²	81	27.8 Å²	27.8	43%	0.433	17%	0.167	S	C	.	.	H	α-helix	trans	-67.9	-43.5	173.2	-79.5	-57.1	0	0	0	112.9	L486 A497 S498 Q499 I503 L504 V505	L486-N501 WeakPolarHBondContact CD1-OD1 3.17Å; A497-N501 PolarHBondContact O-N 2.94Å; A497-N501 VanDerWaalsContact O-N 3.11Å; A497-N501 PolarHBondContact O-ND2 3.45Å; S498-N501 PolarHBondContact O-N 3.42Å; Q499-N501 VanDerWaalsContact C-N 3.28Å; Q499-N501 PolarHBondContact O-N 3.05Å; N501-I503 VanDerWaalsContact C-N 3.31Å; N501-I503 PolarHBondContact O-N 2.83Å; N501-L504 WeakPolarHBondContact O-CB 3.31Å; N501-L504 PolarHBondContact O-N 2.65Å; N501-V505 WeakPolarHBondContact O-CG2 3.39Å; N501-V505 PolarHBondContact O-N 3.06Å
502	K	89.5	Confident	87.7	Confident	44 Å²	44	26.5 Å²	26.5	19%	0.191	16%	0.16	C	C	.	.	H	α-helix	trans	-56.1	-46.1	173.2	-70.1	-179.4	-173.2	176.9	0	110.9	S498 Q499 V505 T506 D550 L553 S554 Y557	S498-K502 PolarHBondContact O-N 3.1Å; Q499-K502 PolarHBondContact O-N 3.01Å; Q499-K502 VanDerWaalsContact O-N 3.15Å; K502-V505 PolarHBondContact O-N 2.99Å; K502-T506 WeakPolarHBondContact O-CB 3.48Å; K502-T506 PolarHBondContact O-N 3.43Å; K502-T506 PolarHBondContact O-OG1 3.19Å; K502-D550 IonicContact NZ-OD1 3.56Å; K502-D550 PolarHBondContact NZ-OD1 3.16Å; K502-D550 IonicContact NZ-OD2 3.73Å; K502-D550 PolarHBondContact NZ-OD2 3.28Å; K502-L553 HydrophobicContact CB-CD1 4.23Å; K502-L553 HydrophobicContact CB-CD2 3.98Å; K502-L553 HydrophobicContact CB-CG 4.08Å; K502-L553 HydrophobicContact CD-CD2 4.06Å; K502-L553 HydrophobicContact CD-CG 4.15Å; K502-S554 PolarHBondContact NZ-OG 2.67Å; K502-Y557 HydrophobicContact CB-CD2 4.05Å; K502-Y557 HydrophobicContact CB-CE2 4.34Å; K502-Y557 HydrophobicContact CG-CD2 4.34Å; K502-Y557 HydrophobicContact CG-CE2 4.42Å
503	I	90.7	Very high	87.7	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-45.5	179.4	-64.1	165.5	0	0	0	110.7	I450 W453 I454 F467 Q499 N501 G507 F549 L553	I450-I503 HydrophobicContact CG2-CD1 4.34Å; I450-I503 HydrophobicContact CG2-CG2 4.47Å; W453-I503 PolarHBondContact NE1-O 2.85Å; I454-I503 HydrophobicContact CD1-CG1 4.21Å; I454-I503 HydrophobicContact CD1-CG2 4.36Å; I454-I503 HydrophobicContact CG1-CG2 4.2Å; F467-I503 HydrophobicContact CE2-CB 4.41Å; F467-I503 HydrophobicContact CE2-CG2 4.13Å; F467-I503 HydrophobicContact CZ-CB 4.33Å; F467-I503 HydrophobicContact CZ-CD1 3.93Å; F467-I503 HydrophobicContact CZ-CG2 3.93Å; Q499-I503 WeakPolarHBondContact O-CG1 3.36Å; Q499-I503 PolarHBondContact O-N 2.74Å; N501-I503 VanDerWaalsContact C-N 3.31Å; N501-I503 PolarHBondContact O-N 2.83Å; I503-G507 PolarHBondContact O-N 3.46Å; I503-G507 VanDerWaalsContact O-N 3.17Å; I503-F549 HydrophobicContact CD1-CZ 4.21Å; I503-L553 HydrophobicContact CD1-CD2 4.3Å; I503-L553 HydrophobicContact CG1-CD1 3.58Å; I503-L553 HydrophobicContact CG1-CD2 3.87Å; I503-L553 HydrophobicContact CG1-CG 4.4Å
504	L	91.1	Very high	87.7	Confident	14 Å²	14	24.1 Å²	24.1	7%	0.073	14%	0.143	C	C	.	.	H	α-helix	trans	-55.9	-56.2	174.3	-177.5	80.2	0	0	0	110.8	V468 L486 A500 N501 T506 G507 K508	V468-L504 HydrophobicContact CB-CD1 4.4Å; V468-L504 HydrophobicContact CG1-CD1 3.75Å; V468-L504 HydrophobicContact CG2-CD1 3.84Å; L486-L504 HydrophobicContact CD1-CD2 4.04Å; L486-L504 HydrophobicContact CD2-CB 4.22Å; L486-L504 HydrophobicContact CD2-CD1 4.06Å; L486-L504 HydrophobicContact CD2-CG 4.49Å; L486-L504 HydrophobicContact CG-CB 4.49Å; L486-L504 HydrophobicContact CG-CD1 4.15Å; L486-L504 HydrophobicContact CG-CD2 3.95Å; L486-L504 HydrophobicContact CG-CG 4.41Å; A500-L504 WeakPolarHBondContact O-CB 3.49Å; A500-L504 PolarHBondContact O-N 3.12Å; N501-L504 WeakPolarHBondContact O-CB 3.31Å; N501-L504 PolarHBondContact O-N 2.65Å; L504-T506 VanDerWaalsContact C-N 3.35Å; L504-T506 PolarHBondContact O-N 3.14Å; L504-G507 PolarHBondContact O-N 2.9Å; L504-K508 HydrophobicContact CG-CD 4.46Å; L504-K508 HydrophobicContact CG-CG 4.36Å; L504-K508 WeakPolarHBondContact O-CG 3.21Å; L504-K508 PolarHBondContact O-N 3.44Å
505	V	89.5	Confident	87.6	Confident	36 Å²	36	28 Å²	28	22%	0.218	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-41.7	-177	171.3	0	0	0	0	111.3	N501 K502 G507 K508 S509 Y557	N501-V505 WeakPolarHBondContact O-CG2 3.39Å; N501-V505 PolarHBondContact O-N 3.06Å; K502-V505 PolarHBondContact O-N 2.99Å; V505-G507 PolarHBondContact O-N 3.35Å; V505-K508 PolarHBondContact O-N 3.3Å; V505-S509 WeakPolarHBondContact O-CB 3.04Å; V505-S509 PolarHBondContact O-N 2.94Å; V505-S509 PolarHBondContact O-OG 2.93Å; V505-S509 VanDerWaalsContact O-OG 3.05Å; V505-Y557 HydrophobicContact CB-CE2 3.96Å; V505-Y557 HydrophobicContact CG1-CE2 3.74Å
506	T	89.1	Confident	87.3	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-56.3	-49.6	176.7	-56.5	0	0	0	0	111.4	I454 K502 L504 S509 I510 V556 Y557 T560	I454-T506 HydrophobicContact CG1-CG2 4.48Å; I454-T506 HydrophobicContact CG2-CG2 4.18Å; K502-T506 WeakPolarHBondContact O-CB 3.48Å; K502-T506 PolarHBondContact O-N 3.43Å; K502-T506 PolarHBondContact O-OG1 3.19Å; L504-T506 VanDerWaalsContact C-N 3.35Å; L504-T506 PolarHBondContact O-N 3.14Å; T506-S509 PolarHBondContact O-N 3.29Å; T506-I510 HydrophobicContact CG2-CD1 4.17Å; T506-I510 WeakPolarHBondContact O-CG1 3.35Å; T506-I510 PolarHBondContact O-N 2.82Å; T506-I510 VanDerWaalsContact O-N 3.13Å; T506-V556 HydrophobicContact CG2-CG1 4.12Å; T506-Y557 WeakPolarHBondContact OG1-CD2 3.41Å; T506-T560 HydrophobicContact CG2-CG2 4.29Å
507	G	88.8	Confident	86.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-72.8	-31	178.1	0	0	0	0	0	113.6	I503 L504 V505 I510 N511	I503-G507 PolarHBondContact O-N 3.46Å; I503-G507 VanDerWaalsContact O-N 3.17Å; L504-G507 PolarHBondContact O-N 2.9Å; V505-G507 PolarHBondContact O-N 3.35Å; G507-I510 PolarHBondContact O-N 3.37Å; G507-N511 WeakPolarHBondContact O-CB 3.34Å; G507-N511 PolarHBondContact O-N 3.13Å; G507-N511 PolarHBondContact O-ND2 3.34Å
508	K	87.8	Confident	86.1	Confident	20 Å²	20	25.9 Å²	25.9	9%	0.087	15%	0.152	C	C	.	.	H	α-helix	trans	-60.8	-46.9	169.8	-71.4	-161.6	-168	-148.7	0	110.6	W480 Y484 L504 V505 I510 N511 F512	W480-K508 HydrophobicContact CE3-CB 4.23Å; W480-K508 HydrophobicContact CH2-CB 4.29Å; W480-K508 HydrophobicContact CZ3-CB 3.88Å; W480-K508 PolarHBondContact O-NZ 2.67Å; Y484-K508 HydrophobicContact CD2-CG 4Å; Y484-K508 HydrophobicContact CG-CG 4.38Å; Y484-K508 VanDerWaalsContact O-CE 3.31Å; Y484-K508 WeakPolarHBondContact O-CE 3.39Å; Y484-K508 PolarHBondContact O-NZ 3.16Å; L504-K508 HydrophobicContact CG-CD 4.46Å; L504-K508 HydrophobicContact CG-CG 4.36Å; L504-K508 WeakPolarHBondContact O-CG 3.21Å; L504-K508 PolarHBondContact O-N 3.44Å; V505-K508 PolarHBondContact O-N 3.3Å; K508-I510 VanDerWaalsContact C-N 3.34Å; K508-I510 PolarHBondContact O-N 3.04Å; K508-N511 PolarHBondContact O-N 3.02Å; K508-F512 VanDerWaalsContact O-CB 3.26Å; K508-F512 WeakPolarHBondContact O-CB 3.43Å; K508-F512 PolarHBondContact O-N 3.41Å
509	S	88.1	Confident	85.1	Confident	4 Å²	4	23.2 Å²	23.2	3%	0.028	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-41.6	177.5	-65.1	0	0	0	0	112.6	V505 T506 F512 L513	V505-S509 WeakPolarHBondContact O-CB 3.04Å; V505-S509 PolarHBondContact O-N 2.94Å; V505-S509 PolarHBondContact O-OG 2.93Å; V505-S509 VanDerWaalsContact O-OG 3.05Å; T506-S509 PolarHBondContact O-N 3.29Å; S509-F512 PolarHBondContact O-N 3.46Å; S509-L513 WeakPolarHBondContact O-CG 3.44Å; S509-L513 PolarHBondContact O-N 3.03Å
510	I	86.6	Confident	83.8	Confident	10 Å²	10	31.8 Å²	31.8	5%	0.051	17%	0.168	C	C	.	.	H	α-helix	trans	-73	-43.3	179.2	-67.1	163	0	0	0	111.5	I454 T506 G507 K508 F512 L513 I514 T560	I454-I510 WeakPolarHBondContact O-CD1 3.47Å; T506-I510 HydrophobicContact CG2-CD1 4.17Å; T506-I510 WeakPolarHBondContact O-CG1 3.35Å; T506-I510 PolarHBondContact O-N 2.82Å; T506-I510 VanDerWaalsContact O-N 3.13Å; G507-I510 PolarHBondContact O-N 3.37Å; K508-I510 VanDerWaalsContact C-N 3.34Å; K508-I510 PolarHBondContact O-N 3.04Å; I510-F512 PolarHBondContact O-N 2.8Å; I510-L513 PolarHBondContact O-N 3.4Å; I510-I514 HydrophobicContact CG2-CD1 3.64Å; I510-I514 HydrophobicContact CG2-CG1 4.33Å; I510-I514 VanDerWaalsContact O-CG1 3.31Å; I510-I514 WeakPolarHBondContact O-CG1 3.31Å; I510-I514 PolarHBondContact O-N 3.28Å; I510-T560 HydrophobicContact CD1-CG2 3.97Å; I510-T560 HydrophobicContact CG1-CG2 3.56Å
511	N	86.3	Confident	82	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-37.5	173.1	-80.7	-60.9	0	0	0	112.1	W453 G457 Y484 G507 K508 H515	W453-N511 WeakPolarHBondContact CH2-ND2 3.26Å; W453-N511 WeakPolarHBondContact CZ3-ND2 3.49Å; G457-N511 VanDerWaalsContact O-CG 3.31Å; G457-N511 PolarHBondContact O-ND2 2.86Å; G457-N511 PolarHBondContact O-OD1 3.23Å; G457-N511 VanDerWaalsContact O-OD1 3.07Å; Y484-N511 HydrophobicContact CE2-CB 4.13Å; Y484-N511 VanDerWaalsContact OH-CG 3.28Å; Y484-N511 PolarHBondContact OH-ND2 3.46Å; Y484-N511 PolarHBondContact OH-OD1 3Å; G507-N511 WeakPolarHBondContact O-CB 3.34Å; G507-N511 PolarHBondContact O-N 3.13Å; G507-N511 PolarHBondContact O-ND2 3.34Å; K508-N511 PolarHBondContact O-N 3.02Å; N511-H515 VanDerWaalsContact O-CB 3.25Å; N511-H515 WeakPolarHBondContact O-CB 3.48Å; N511-H515 PolarHBondContact O-CD2 3.13Å; N511-H515 VanDerWaalsContact O-CD2 3.25Å; N511-H515 PolarHBondContact O-N 3.2Å
512	F	85.6	Confident	80.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-45.8	174.6	-179.1	-96.5	0	0	0	111.9	L479 W480 K508 S509 I510 I514 V516 C517 L564 L568 P667 T670	L479-F512 HydrophobicContact CD2-CB 4.29Å; W480-F512 HydrophobicContact CE3-CB 4.27Å; W480-F512 HydrophobicContact CE3-CD2 4.43Å; W480-F512 HydrophobicContact CE3-CG 4.4Å; W480-F512 HydrophobicContact CZ3-CB 4.16Å; W480-F512 HydrophobicContact CZ3-CG 4.48Å; K508-F512 VanDerWaalsContact O-CB 3.26Å; K508-F512 WeakPolarHBondContact O-CB 3.43Å; K508-F512 PolarHBondContact O-N 3.41Å; S509-F512 PolarHBondContact O-N 3.46Å; I510-F512 PolarHBondContact O-N 2.8Å; F512-I514 PolarHBondContact O-N 3.1Å; F512-V516 HydrophobicContact CD2-CB 3.91Å; F512-V516 HydrophobicContact CD2-CG1 4.45Å; F512-V516 HydrophobicContact CD2-CG2 3.66Å; F512-V516 HydrophobicContact CE2-CB 3.89Å; F512-V516 HydrophobicContact CE2-CG1 3.96Å; F512-V516 HydrophobicContact CE2-CG2 3.99Å; F512-V516 HydrophobicContact CG-CB 4.46Å; F512-V516 HydrophobicContact CG-CG2 4.39Å; F512-V516 HydrophobicContact CZ-CB 4.46Å; F512-V516 HydrophobicContact CZ-CG1 4.45Å; F512-V516 WeakPolarHBondContact O-CA 3.32Å; F512-V516 WeakPolarHBondContact O-CB 3.4Å; F512-V516 PolarHBondContact O-N 3.19Å; F512-C517 PolarHBondContact O-N 3.2Å; F512-C517 VanDerWaalsContact O-N 3.12Å; F512-L564 HydrophobicContact CD1-CD1 3.54Å; F512-L564 HydrophobicContact CE1-CD1 3.75Å; F512-L568 HydrophobicContact CE1-CD2 4.25Å; F512-P667 HydrophobicContact CE1-CB 4.04Å; F512-P667 HydrophobicContact CE2-CB 4.23Å; F512-P667 HydrophobicContact CZ-CB 3.47Å; F512-P667 VanDerWaalsContact CZ-CB 3.47Å; F512-P667 WeakPolarHBondContact CZ-O 3.17Å; F512-T670 HydrophobicContact CD2-CG2 4.43Å; F512-T670 HydrophobicContact CE2-CG2 3.7Å; F512-T670 VanDerWaalsContact CE2-OG1 3.23Å; F512-T670 WeakPolarHBondContact CE2-OG1 3.41Å; F512-T670 WeakPolarHBondContact CZ-OG1 3.27Å
513	L	85.1	Confident	78.4	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-45.3	173.9	-75.7	166.9	0	0	0	112.7	S509 I510 C517 G518 E519 L564 T567	S509-L513 WeakPolarHBondContact O-CG 3.44Å; S509-L513 PolarHBondContact O-N 3.03Å; I510-L513 PolarHBondContact O-N 3.4Å; L513-C517 HydrophobicContact CD2-CB 4.34Å; L513-C517 CarbonylContact O-C 3.58Å; L513-C517 WeakPolarHBondContact O-CB 3.26Å; L513-C517 PolarHBondContact O-N 3Å; L513-G518 PolarHBondContact O-N 2.87Å; L513-E519 PolarHBondContact O-N 3.12Å; L513-L564 HydrophobicContact CD1-CB 4.38Å; L513-L564 HydrophobicContact CD2-CD1 3.97Å; L513-L564 HydrophobicContact CG-CD1 4.09Å; L513-T567 HydrophobicContact CD2-CG2 4Å
514	I	83.9	Confident	76.6	Confident	45 Å²	45	48 Å²	48	23%	0.231	25%	0.248	C	C	.	.	H	α-helix	trans	-70.7	-49.1	-177.9	-67	169.3	0	0	0	111.5	D456 I510 F512	D456-I514 WeakPolarHBondContact O-CD1 3.35Å; I510-I514 HydrophobicContact CG2-CD1 3.64Å; I510-I514 HydrophobicContact CG2-CG1 4.33Å; I510-I514 VanDerWaalsContact O-CG1 3.31Å; I510-I514 WeakPolarHBondContact O-CG1 3.31Å; I510-I514 PolarHBondContact O-N 3.28Å; F512-I514 PolarHBondContact O-N 3.1Å
515	H	81.2	Confident	74.7	Confident	97 Å²	97	53.1 Å²	53.1	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-87.1	-36.5	-171.6	-69.6	-65.6	0	0	0	114.1	L479 N511	L479-H515 HydrophobicContact CD1-CB 4.45Å; N511-H515 VanDerWaalsContact O-CB 3.25Å; N511-H515 WeakPolarHBondContact O-CB 3.48Å; N511-H515 PolarHBondContact O-CD2 3.13Å; N511-H515 VanDerWaalsContact O-CD2 3.25Å; N511-H515 PolarHBondContact O-N 3.2Å
516	V	78.3	Confident	73.1	Confident	37 Å²	37	52.3 Å²	52.3	22%	0.224	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-42.4	-171.3	-162.4	0	0	0	0	111.4	F512 G518 P667	F512-V516 HydrophobicContact CD2-CB 3.91Å; F512-V516 HydrophobicContact CD2-CG1 4.45Å; F512-V516 HydrophobicContact CD2-CG2 3.66Å; F512-V516 HydrophobicContact CE2-CB 3.89Å; F512-V516 HydrophobicContact CE2-CG1 3.96Å; F512-V516 HydrophobicContact CE2-CG2 3.99Å; F512-V516 HydrophobicContact CG-CB 4.46Å; F512-V516 HydrophobicContact CG-CG2 4.39Å; F512-V516 HydrophobicContact CZ-CB 4.46Å; F512-V516 HydrophobicContact CZ-CG1 4.45Å; F512-V516 WeakPolarHBondContact O-CA 3.32Å; F512-V516 WeakPolarHBondContact O-CB 3.4Å; F512-V516 PolarHBondContact O-N 3.19Å; V516-G518 VanDerWaalsContact C-N 3.3Å; V516-P667 HydrophobicContact CB-CB 4.49Å; V516-P667 HydrophobicContact CG1-CB 3.79Å
517	C	75.7	Confident	71.3	Confident	10 Å²	10	57.8 Å²	57.8	7%	0.068	29%	0.294	C	S	.	.	S	Bend	trans	-80.7	-9.7	173.5	-57	0	0	0	0	113.6	F512 L513 E519 T567 Y572	F512-C517 PolarHBondContact O-N 3.2Å; F512-C517 VanDerWaalsContact O-N 3.12Å; L513-C517 HydrophobicContact CD2-CB 4.34Å; L513-C517 CarbonylContact O-C 3.58Å; L513-C517 WeakPolarHBondContact O-CB 3.26Å; L513-C517 PolarHBondContact O-N 3Å; C517-E519 VanDerWaalsContact C-N 3.29Å; C517-E519 HydrophobicContact CB-CG 4.09Å; C517-E519 PolarHBondContact O-N 3.48Å; C517-T567 HydrophobicContact CB-CG2 4.45Å; C517-Y572 WeakPolarHBondContact CA-OH 3.4Å; C517-Y572 HydrophobicContact CB-CE2 4Å; C517-Y572 PolarHBondContact O-OH 3.32Å
518	G	72.5	Confident	69.5	Low	48 Å²	48	61 Å²	61	50%	0.495	32%	0.317	S	S	.	.			trans	74.7	10.8	178.5	0	0	0	0	0	115.3	L513 V516 K520	L513-G518 PolarHBondContact O-N 2.87Å; V516-G518 VanDerWaalsContact C-N 3.3Å; G518-K520 PolarHBondContact O-N 3.36Å
519	E	69.1	Low	67.9	Low	20 Å²	20	61.2 Å²	61.2	9%	0.093	32%	0.319	C	S	.	.			trans	-80.5	85.8	-171.4	-63.5	-129.6	-144.3	0	0	112.5	L513 C517 Q521 T567 R571	L513-E519 PolarHBondContact O-N 3.12Å; C517-E519 VanDerWaalsContact C-N 3.29Å; C517-E519 HydrophobicContact CB-CG 4.09Å; C517-E519 PolarHBondContact O-N 3.48Å; E519-Q521 VanDerWaalsContact C-N 3.3Å; E519-Q521 PolarHBondContact O-N 3.45Å; E519-T567 VanDerWaalsContact OE1-CG2 3.26Å; E519-T567 WeakPolarHBondContact OE1-CG2 2.81Å; E519-R571 IonicContact OE1-CZ 2.69Å; E519-R571 IonicContact OE1-NE 3.63Å; E519-R571 IonicContact OE1-NH1 3.35Å; E519-R571 PolarHBondContact OE1-NH1 2.89Å; E519-R571 IonicContact OE1-NH2 3.13Å; E519-R571 PolarHBondContact OE1-NH2 2.9Å; E519-R571 IonicContact OE2-CZ 3.3Å; E519-R571 IonicContact OE2-NH1 3.59Å; E519-R571 PolarHBondContact OE2-NH1 3.22Å; E519-R571 IonicContact OE2-NH2 3.81Å; E519-R571 PolarHBondContact OE2-NH2 2.96Å
520	K	60.6	Low	66.3	Low	188 Å²	188	66 Å²	66	82%	0.817	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.8	177.3	-62.3	-178.2	-177.5	178	0	114.4	G518	G518-K520 PolarHBondContact O-N 3.36Å
521	Q	53.1	Low	64.4	Low	188 Å²	188	72.9 Å²	72.9	88%	0.879	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.6	51.6	-172.3	-65.6	-177.6	-12.2	0	0	111.6	E519	E519-Q521 VanDerWaalsContact C-N 3.3Å; E519-Q521 PolarHBondContact O-N 3.45Å
522	G	50.3	Low	62.8	Low	30 Å²	30	77 Å²	77	31%	0.309	39%	0.393	S	S	.	.			trans	-80.9	-54.6	-163.5	0	0	0	0	0	117.4
523	I	54.2	Low	61.3	Low	53 Å²	53	86.8 Å²	86.8	27%	0.272	43%	0.43	S	S	.	.			trans	-115.8	86.7	-159.8	-48.5	167.2	0	0	0	112.1	N525 R526 H563	I523-N525 HydrophobicContact CG2-CB 4.36Å; I523-N525 PolarHBondContact O-N 2.86Å; I523-R526 HydrophobicContact CB-CB 4.37Å; I523-R526 HydrophobicContact CB-CG 3.95Å; I523-R526 HydrophobicContact CG2-CB 4.24Å; I523-R526 HydrophobicContact CG2-CG 3.61Å; I523-R526 PolarHBondContact O-N 3.38Å; I523-H563 VanDerWaalsContact CG1-CD2 3.48Å; I523-H563 WeakPolarHBondContact CG1-CD2 3.4Å
524	K	51.9	Low	59.9	Low	194 Å²	194	87.5 Å²	87.5	84%	0.843	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.9	175.1	-65.2	-179.6	-179.8	177	0	113.7
525	N	51.4	Low	58.6	Low	123 Å²	123	95.5 Å²	95.5	66%	0.658	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	3.8	177.5	-67.9	-8.3	0	0	0	114.5	I523 S528 I529	I523-N525 HydrophobicContact CG2-CB 4.36Å; I523-N525 PolarHBondContact O-N 2.86Å; N525-S528 PolarHBondContact O-OG 2.95Å; N525-I529 WeakPolarHBondContact O-CD1 3.31Å; N525-I529 WeakPolarHBondContact O-CG1 3.4Å
526	R	55.7	Low	57.4	Low	18 Å²	18	97.3 Å²	97.3	7%	0.068	47%	0.474	C	S	.	.	H	α-helix	trans	-90.1	-17.4	178	-83.2	173.6	98.2	108.2	23.1	114.8	I454 I523 I529 R530 T560	I454-R526 PolarHBondContact O-NH2 3.46Å; I523-R526 HydrophobicContact CB-CB 4.37Å; I523-R526 HydrophobicContact CB-CG 3.95Å; I523-R526 HydrophobicContact CG2-CB 4.24Å; I523-R526 HydrophobicContact CG2-CG 3.61Å; I523-R526 PolarHBondContact O-N 3.38Å; R526-I529 HydrophobicContact CG-CD1 4.3Å; R526-I529 CarbonylContact O-C 3.54Å; R526-I529 PolarHBondContact O-N 2.66Å; R526-R530 WeakPolarHBondContact O-CG 3.44Å; R526-R530 PolarHBondContact O-N 3.42Å; R526-T560 PolarHBondContact NH1-OG1 2.86Å
527	E	51.6	Low	56.6	Low	116 Å²	116	97.3 Å²	97.3	54%	0.542	47%	0.473	S	S	.	.	H	α-helix	trans	-68.7	-43	176.8	-57.4	-154.1	135.3	0	0	110.9	I529 R530 H531	E527-I529 PolarHBondContact O-N 3.41Å; E527-R530 WeakPolarHBondContact O-CB 3.26Å; E527-R530 PolarHBondContact O-N 3.13Å; E527-R530 VanDerWaalsContact O-N 3.1Å; E527-R530 IonicContact OE1-NH1 2.75Å; E527-H531 PolarHBondContact O-CD2 3.17Å; E527-H531 PolarHBondContact O-N 2.84Å; E527-H531 PolarHBondContact O-NE2 2.91Å
528	S	49.6	Very low	55.8	Low	69 Å²	69	101.1 Å²	101.1	48%	0.483	49%	0.49	S	S	.	.	H	α-helix	trans	-54.3	-35.2	168.8	44.1	0	0	0	0	113.1	N525 H531 T532	N525-S528 PolarHBondContact O-OG 2.95Å; S528-H531 WeakPolarHBondContact O-CB 3.39Å; S528-H531 PolarHBondContact O-N 3.4Å; S528-T532 PolarHBondContact O-N 2.97Å; S528-T532 PolarHBondContact O-OG1 2.85Å; S528-T532 VanDerWaalsContact O-OG1 3.13Å
529	I	55.7	Low	55.2	Low	23 Å²	23	99 Å²	99	12%	0.118	47%	0.468	C	S	.	.	H	α-helix	trans	-81	-33.2	177.8	-51.1	165.2	0	0	0	112	Y455 N525 R526 E527 H531 T532 V556	Y455-I529 HydrophobicContact CE1-CB 4.26Å; Y455-I529 HydrophobicContact CE1-CG2 3.81Å; N525-I529 WeakPolarHBondContact O-CD1 3.31Å; N525-I529 WeakPolarHBondContact O-CG1 3.4Å; R526-I529 HydrophobicContact CG-CD1 4.3Å; R526-I529 CarbonylContact O-C 3.54Å; R526-I529 PolarHBondContact O-N 2.66Å; E527-I529 PolarHBondContact O-N 3.41Å; I529-H531 PolarHBondContact O-N 3.27Å; I529-T532 CarbonylContact O-C 3.59Å; I529-T532 VanDerWaalsContact O-C 3.29Å; I529-T532 VanDerWaalsContact O-CA 3.31Å; I529-T532 WeakPolarHBondContact O-CA 3.33Å; I529-T532 WeakPolarHBondContact O-CB 3.15Å; I529-T532 PolarHBondContact O-N 3.33Å; I529-V556 HydrophobicContact CG2-CG2 3.96Å
530	R	54.1	Low	54.7	Low	104 Å²	104	98.1 Å²	98.1	39%	0.392	46%	0.464	S	S	.	.	H	α-helix	trans	-59.5	-28.6	167.4	-75	175.4	173.2	162.5	-5.2	111.2	Y455 D456 R526 E527	Y455-R530 HydrophobicContact CD1-CG 4.19Å; Y455-R530 HydrophobicContact CG-CG 4.25Å; D456-R530 IonicContact OD1-CZ 2.72Å; D456-R530 IonicContact OD1-NE 3.13Å; D456-R530 IonicContact OD1-NH2 3.73Å; D456-R530 PolarHBondContact OD1-NH2 3.21Å; R526-R530 WeakPolarHBondContact O-CG 3.44Å; R526-R530 PolarHBondContact O-N 3.42Å; E527-R530 WeakPolarHBondContact O-CB 3.26Å; E527-R530 PolarHBondContact O-N 3.13Å; E527-R530 VanDerWaalsContact O-N 3.1Å; E527-R530 IonicContact OE1-NH1 2.75Å
531	H	47.5	Very low	54.9	Low	155 Å²	155	90.2 Å²	90.2	72%	0.718	43%	0.429	S	S	*	.	H	α-helix	trans	-78.1	-28.1	171.7	-52.8	-36.6	0	0	0	112.6	E527 S528 I529 R533	E527-H531 PolarHBondContact O-CD2 3.17Å; E527-H531 PolarHBondContact O-N 2.84Å; E527-H531 PolarHBondContact O-NE2 2.91Å; S528-H531 WeakPolarHBondContact O-CB 3.39Å; S528-H531 PolarHBondContact O-N 3.4Å; I529-H531 PolarHBondContact O-N 3.27Å; H531-R533 PolarHBondContact O-N 2.71Å
532	T	52.1	Low	55.3	Low	90 Å²	90	84.2 Å²	84.2	55%	0.552	40%	0.402	S	S	*	.			trans	-73.6	46.1	163.9	-36.8	0	0	0	0	112.2	S528 I529 L534	S528-T532 PolarHBondContact O-N 2.97Å; S528-T532 PolarHBondContact O-OG1 2.85Å; S528-T532 VanDerWaalsContact O-OG1 3.13Å; I529-T532 CarbonylContact O-C 3.59Å; I529-T532 VanDerWaalsContact O-C 3.29Å; I529-T532 VanDerWaalsContact O-CA 3.31Å; I529-T532 WeakPolarHBondContact O-CA 3.33Å; I529-T532 WeakPolarHBondContact O-CB 3.15Å; I529-T532 PolarHBondContact O-N 3.33Å; T532-L534 PolarHBondContact O-N 3.48Å
533	R	53	Low	55.7	Low	207 Å²	207	84.6 Å²	84.6	78%	0.781	40%	0.395	S	S	*	.			trans	-52.7	139.4	158.9	-84.8	177.2	173.5	177.5	-2.8	108.1	H531 K535	H531-R533 PolarHBondContact O-N 2.71Å; R533-K535 PolarHBondContact O-N 2.9Å
534	L	57.2	Low	55.8	Low	23 Å²	23	89.4 Å²	89.4	12%	0.12	42%	0.422	C	S	.	.			trans	-49	119.6	166.7	-63	169.5	0	0	0	107.4	L447 T532 K536 F549 M552	L447-L534 HydrophobicContact CD1-CD1 3.93Å; L447-L534 HydrophobicContact CD2-CD1 4.19Å; T532-L534 PolarHBondContact O-N 3.48Å; L534-K536 PolarHBondContact O-N 2.9Å; L534-F549 HydrophobicContact CD1-CD2 4.02Å; L534-M552 HydrophobicContact CD1-CE 3.96Å; L534-M552 HydrophobicContact CD2-CB 4.48Å; L534-M552 HydrophobicContact CD2-CE 3.94Å; L534-M552 HydrophobicContact CG-CE 3.82Å
535	K	55	Low	55.9	Low	213 Å²	213	88.5 Å²	88.5	93%	0.926	42%	0.418	S	S	*	.	S	Bend	trans	-63.4	-17.5	-173.3	-70.7	-177.5	178	178	0	112.4	R533	R533-K535 PolarHBondContact O-N 2.9Å
536	K	56.9	Low	56.4	Low	135 Å²	135	86 Å²	86	59%	0.587	40%	0.404	S	S	*	.			trans	-139.3	136.6	173	-66.3	176.5	153.5	-139.1	0	108.8	L534 E538 S539	L534-K536 PolarHBondContact O-N 2.9Å; K536-E538 HydrophobicContact CB-CB 4.32Å; K536-E538 WeakPolarHBondContact CD-OE2 3.37Å; K536-E538 IonicContact NZ-OE2 2.66Å; K536-E538 PolarHBondContact NZ-OE2 2.94Å; K536-E538 VanDerWaalsContact NZ-OE2 3.14Å; K536-E538 PolarHBondContact O-N 3.42Å; K536-S539 PolarHBondContact O-OG 2.71Å
537	V	62.2	Low	57.3	Low	36 Å²	36	91.3 Å²	91.3	22%	0.218	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-68.6	-26.5	174.9	175.3	0	0	0	0	111.3	A443 L447 S539 M540	A443-V537 HydrophobicContact CB-CG1 3.31Å; L447-V537 HydrophobicContact CD2-CG2 4.32Å; V537-S539 PolarHBondContact O-N 2.87Å; V537-S539 VanDerWaalsContact O-N 3.16Å; V537-M540 PolarHBondContact O-N 3.4Å
538	E	58.8	Low	58.4	Low	90 Å²	90	87.3 Å²	87.3	42%	0.421	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-51.3	-34.8	177.6	-60.7	164.4	158.8	0	0	113	K536 M540 F541 E542	K536-E538 HydrophobicContact CB-CB 4.32Å; K536-E538 WeakPolarHBondContact CD-OE2 3.37Å; K536-E538 IonicContact NZ-OE2 2.66Å; K536-E538 PolarHBondContact NZ-OE2 2.94Å; K536-E538 VanDerWaalsContact NZ-OE2 3.14Å; K536-E538 PolarHBondContact O-N 3.42Å; E538-M540 PolarHBondContact O-N 2.85Å; E538-M540 VanDerWaalsContact O-N 3.14Å; E538-F541 PolarHBondContact O-N 3.39Å; E538-E542 PolarHBondContact O-N 2.91Å
539	S	59.7	Low	59.8	Low	5 Å²	5	84 Å²	84	4%	0.035	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-67.9	-12.7	-177.5	68.1	0	0	0	0	115.3	K536 V537 F541 D546 S548	K536-S539 PolarHBondContact O-OG 2.71Å; V537-S539 PolarHBondContact O-N 2.87Å; V537-S539 VanDerWaalsContact O-N 3.16Å; S539-F541 VanDerWaalsContact C-N 3.27Å; S539-D546 WeakPolarHBondContact CB-OD2 3.49Å; S539-S548 WeakPolarHBondContact CB-OG 3.14Å; S539-S548 PolarHBondContact OG-OG 2.75Å
540	M	59.2	Low	61.1	Low	0 Å²	0	85.5 Å²	85.5	0%	0	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-74.5	-19.1	173.1	173.1	173.5	-90.8	0	0	112.5	L447 I450 F494 V537 E538 Q543 F549	L447-M540 HydrophobicContact CB-CE 4.26Å; L447-M540 HydrophobicContact CB-SD 4.34Å; L447-M540 HydrophobicContact CD1-CE 3.63Å; I450-M540 HydrophobicContact CD1-CE 3.58Å; I450-M540 HydrophobicContact CD1-SD 4.41Å; F494-M540 HydrophobicContact CD2-CG 4.22Å; F494-M540 WeakPolarHBondContact CD2-O 3.28Å; F494-M540 HydrophobicContact CE2-CG 3.86Å; F494-M540 HydrophobicContact CE2-SD 4.23Å; V537-M540 PolarHBondContact O-N 3.4Å; E538-M540 PolarHBondContact O-N 2.85Å; E538-M540 VanDerWaalsContact O-N 3.14Å; M540-Q543 WeakPolarHBondContact O-CG 3.15Å; M540-Q543 PolarHBondContact O-NE2 2.81Å; M540-F549 HydrophobicContact CE-CD2 4.05Å; M540-F549 HydrophobicContact CE-CE1 4.4Å; M540-F549 HydrophobicContact CE-CE2 3.45Å; M540-F549 VanDerWaalsContact CE-CE2 3.45Å; M540-F549 HydrophobicContact CE-CZ 3.65Å
541	F	63.4	Low	62.5	Low	22 Å²	22	86.1 Å²	86.1	10%	0.096	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-33.5	-171.9	-62.6	-105.5	0	0	0	111.4	F421 M439 A443 F494 E538 S539 Q543	F421-F541 AromaticContact CD2-CD1 3.95Å; F421-F541 HydrophobicContact CD2-CD1 3.95Å; F421-F541 HydrophobicContact CE2-CB 4.28Å; F421-F541 HydrophobicContact CE2-CD1 4.27Å; M439-F541 HydrophobicContact CE-CD1 4.49Å; M439-F541 HydrophobicContact CE-CE1 4.24Å; M439-F541 HydrophobicContact CG-CD1 3.39Å; M439-F541 HydrophobicContact CG-CE1 3.41Å; M439-F541 VanDerWaalsContact CG-CE1 3.41Å; M439-F541 HydrophobicContact CG-CG 4Å; M439-F541 HydrophobicContact CG-CZ 4.14Å; M439-F541 HydrophobicContact SD-CD1 3.74Å; M439-F541 HydrophobicContact SD-CE1 3.16Å; M439-F541 WeakPolarHBondContact SD-CE1 3.4Å; M439-F541 HydrophobicContact SD-CZ 3.91Å; A443-F541 HydrophobicContact CB-CD2 3.88Å; A443-F541 HydrophobicContact CB-CE1 4.37Å; A443-F541 HydrophobicContact CB-CE2 3.05Å; A443-F541 HydrophobicContact CB-CZ 3.34Å; F494-F541 HydrophobicContact CB-CD1 4.47Å; F494-F541 AromaticContact CD1-CD1 3.57Å; F494-F541 HydrophobicContact CD1-CD1 3.57Å; F494-F541 AromaticContact CD1-CE1 3.42Å; F494-F541 HydrophobicContact CD1-CE1 3.42Å; F494-F541 VanDerWaalsContact CD1-CE1 3.42Å; F494-F541 HydrophobicContact CD1-CZ 4.32Å; F494-F541 AromaticContact CD2-CD1 3.93Å; F494-F541 HydrophobicContact CD2-CD1 3.93Å; F494-F541 AromaticContact CD2-CE1 3.86Å; F494-F541 HydrophobicContact CD2-CE1 3.86Å; F494-F541 HydrophobicContact CD2-CE2 4.44Å; F494-F541 HydrophobicContact CD2-CG 4.34Å; F494-F541 HydrophobicContact CD2-CZ 4.09Å; F494-F541 AromaticContact CE1-CD1 3.7Å; F494-F541 HydrophobicContact CE1-CD1 3.7Å; F494-F541 AromaticContact CE1-CE1 3.01Å; F494-F541 HydrophobicContact CE1-CE1 3.01Å; F494-F541 AromaticContact CE1-CZ 3.66Å; F494-F541 HydrophobicContact CE1-CZ 3.66Å; F494-F541 HydrophobicContact CE2-CD1 4.05Å; F494-F541 AromaticContact CE2-CE1 3.5Å; F494-F541 HydrophobicContact CE2-CE1 3.5Å; F494-F541 AromaticContact CE2-CE2 3.93Å; F494-F541 HydrophobicContact CE2-CE2 3.93Å; F494-F541 AromaticContact CE2-CZ 3.39Å; F494-F541 HydrophobicContact CE2-CZ 3.39Å; F494-F541 AromaticContact CG-CD1 3.7Å; F494-F541 HydrophobicContact CG-CD1 3.7Å; F494-F541 AromaticContact CG-CE1 3.84Å; F494-F541 HydrophobicContact CG-CE1 3.84Å; F494-F541 HydrophobicContact CG-CG 4.39Å; F494-F541 AromaticContact CZ-CD1 3.95Å; F494-F541 HydrophobicContact CZ-CD1 3.95Å; F494-F541 AromaticContact CZ-CE1 3.06Å; F494-F541 HydrophobicContact CZ-CE1 3.06Å; F494-F541 HydrophobicContact CZ-CE2 4.14Å; F494-F541 AromaticContact CZ-CZ 3.15Å; F494-F541 HydrophobicContact CZ-CZ 3.15Å; E538-F541 PolarHBondContact O-N 3.39Å; S539-F541 VanDerWaalsContact C-N 3.27Å; F541-Q543 PolarHBondContact O-N 3.1Å
542	E	61.3	Low	64.1	Low	63 Å²	63	80 Å²	80	29%	0.294	38%	0.379	S	S	.	.			trans	-86.9	45.4	171.5	-59.7	-166.6	150.9	0	0	111.4	R436 E538 D544 F545 D546	R436-E542 IonicContact CZ-OE1 3.55Å; R436-E542 IonicContact NE-OE1 3.54Å; R436-E542 PolarHBondContact NE-OE1 3.38Å; R436-E542 IonicContact NH2-OE1 2.64Å; R436-E542 PolarHBondContact NH2-OE1 2.9Å; E538-E542 PolarHBondContact O-N 2.91Å; E542-D544 PolarHBondContact O-N 3.09Å; E542-D544 VanDerWaalsContact O-N 3.17Å; E542-F545 HydrophobicContact CB-CD2 4.37Å; E542-F545 PolarHBondContact O-N 2.61Å; E542-D546 PolarHBondContact O-N 3.19Å
543	Q	58.6	Low	65.7	Low	38 Å²	38	75.7 Å²	75.7	18%	0.178	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.1	-178.2	-65.5	-176.7	26.3	0	0	113.2	F494 M540 F541 F545	F494-Q543 PolarHBondContact O-NE2 2.9Å; M540-Q543 WeakPolarHBondContact O-CG 3.15Å; M540-Q543 PolarHBondContact O-NE2 2.81Å; F541-Q543 PolarHBondContact O-N 3.1Å; Q543-F545 PolarHBondContact O-N 3.17Å
544	D	56.9	Low	67.3	Low	154 Å²	154	67.6 Å²	67.6	82%	0.824	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-24.1	173.2	-62.7	-36.9	0	0	0	112.8	E542	E542-D544 PolarHBondContact O-N 3.09Å; E542-D544 VanDerWaalsContact O-N 3.17Å
545	F	54.2	Low	68.7	Low	175 Å²	175	69.9 Å²	69.9	77%	0.768	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-32.3	-177.2	-62.3	-74.3	0	0	0	113.3	E542 Q543	E542-F545 HydrophobicContact CB-CD2 4.37Å; E542-F545 PolarHBondContact O-N 2.61Å; Q543-F545 PolarHBondContact O-N 3.17Å
546	D	62.6	Low	70.1	Confident	69 Å²	69	59.8 Å²	59.8	37%	0.369	30%	0.299	S	S	.	.			trans	-129.4	102.7	177.5	-173.2	13.4	0	0	0	112.3	S539 E542 S548	S539-D546 WeakPolarHBondContact CB-OD2 3.49Å; E542-D546 PolarHBondContact O-N 3.19Å; D546-S548 PolarHBondContact O-N 3.07Å; D546-S548 VanDerWaalsContact O-N 3.17Å; D546-S548 WeakPolarHBondContact OD1-CB 3.11Å; D546-S548 PolarHBondContact OD1-N 3.2Å; D546-S548 PolarHBondContact OD1-OG 2.84Å; D546-S548 WeakPolarHBondContact OD2-CB 3.26Å; D546-S548 PolarHBondContact OD2-OG 3.4Å
547	Q	73	Confident	71.7	Confident	131 Å²	131	55.5 Å²	55.5	61%	0.612	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	4.1	174.3	-64.5	-177.5	1.3	0	0	113.5	F549 D550 Q551	Q547-F549 PolarHBondContact O-N 3.29Å; Q547-F549 VanDerWaalsContact O-N 3.09Å; Q547-D550 PolarHBondContact O-N 3.26Å; Q547-D550 VanDerWaalsContact O-N 3.1Å; Q547-Q551 HydrophobicContact CB-CG 4.48Å; Q547-Q551 WeakPolarHBondContact O-CG 3.36Å; Q547-Q551 PolarHBondContact O-N 2.73Å
548	S	76.5	Confident	72.9	Confident	31 Å²	31	57.7 Å²	57.7	22%	0.217	29%	0.286	C	S	.	.	H	α-helix	trans	-53.3	-31.6	-179.9	68.1	0	0	0	0	113.5	S539 D546 M552	S539-S548 WeakPolarHBondContact CB-OG 3.14Å; S539-S548 PolarHBondContact OG-OG 2.75Å; D546-S548 PolarHBondContact O-N 3.07Å; D546-S548 VanDerWaalsContact O-N 3.17Å; D546-S548 WeakPolarHBondContact OD1-CB 3.11Å; D546-S548 PolarHBondContact OD1-N 3.2Å; D546-S548 PolarHBondContact OD1-OG 2.84Å; D546-S548 WeakPolarHBondContact OD2-CB 3.26Å; D546-S548 PolarHBondContact OD2-OG 3.4Å; S548-M552 WeakPolarHBondContact O-CB 3.26Å; S548-M552 PolarHBondContact O-N 2.99Å
549	F	78	Confident	74.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.9	-49.4	175	-179	-116.7	0	0	0	113.3	I503 L534 M540 Q547 M552 L553	I503-F549 HydrophobicContact CD1-CZ 4.21Å; L534-F549 HydrophobicContact CD1-CD2 4.02Å; M540-F549 HydrophobicContact CE-CD2 4.05Å; M540-F549 HydrophobicContact CE-CE1 4.4Å; M540-F549 HydrophobicContact CE-CE2 3.45Å; M540-F549 VanDerWaalsContact CE-CE2 3.45Å; M540-F549 HydrophobicContact CE-CZ 3.65Å; Q547-F549 PolarHBondContact O-N 3.29Å; Q547-F549 VanDerWaalsContact O-N 3.09Å; F549-M552 HydrophobicContact CD2-CE 3.91Å; F549-M552 HydrophobicContact CE2-CE 4.16Å; F549-M552 PolarHBondContact O-N 2.95Å; F549-L553 VanDerWaalsContact O-CB 3.28Å; F549-L553 WeakPolarHBondContact O-CB 3.48Å; F549-L553 PolarHBondContact O-N 2.94Å
550	D	83.2	Confident	75.4	Confident	54 Å²	54	57.3 Å²	57.3	29%	0.289	28%	0.284	S	S	.	.	H	α-helix	trans	-71.9	-30.8	178.8	-170.4	73.3	0	0	0	112	K502 Q547 S554	K502-D550 IonicContact NZ-OD1 3.56Å; K502-D550 PolarHBondContact NZ-OD1 3.16Å; K502-D550 IonicContact NZ-OD2 3.73Å; K502-D550 PolarHBondContact NZ-OD2 3.28Å; Q547-D550 PolarHBondContact O-N 3.26Å; Q547-D550 VanDerWaalsContact O-N 3.1Å; D550-S554 WeakPolarHBondContact O-CB 3.47Å; D550-S554 PolarHBondContact O-N 3.41Å; D550-S554 PolarHBondContact O-OG 3.24Å; D550-S554 PolarHBondContact OD2-OG 3.13Å
551	Q	82.4	Confident	76.8	Confident	117 Å²	117	57.5 Å²	57.5	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-65.2	-45	171.3	-69.2	179	14.7	0	0	111.6	Q547 T555	Q547-Q551 HydrophobicContact CB-CG 4.48Å; Q547-Q551 WeakPolarHBondContact O-CG 3.36Å; Q547-Q551 PolarHBondContact O-N 2.73Å; Q551-T555 VanDerWaalsContact O-CB 3.25Å; Q551-T555 WeakPolarHBondContact O-CB 3.36Å; Q551-T555 PolarHBondContact O-N 3.13Å; Q551-T555 PolarHBondContact O-OG1 3.3Å
552	M	81.7	Confident	77.8	Confident	26 Å²	26	60.4 Å²	60.4	13%	0.128	30%	0.299	C	S	.	.	H	α-helix	trans	-63.3	-47.9	174.9	179.6	-94.7	-73.7	0	0	111	L534 S548 F549 S554 T555 V556	L534-M552 HydrophobicContact CD1-CE 3.96Å; L534-M552 HydrophobicContact CD2-CB 4.48Å; L534-M552 HydrophobicContact CD2-CE 3.94Å; L534-M552 HydrophobicContact CG-CE 3.82Å; S548-M552 WeakPolarHBondContact O-CB 3.26Å; S548-M552 PolarHBondContact O-N 2.99Å; F549-M552 HydrophobicContact CD2-CE 3.91Å; F549-M552 HydrophobicContact CE2-CE 4.16Å; F549-M552 PolarHBondContact O-N 2.95Å; M552-S554 PolarHBondContact O-N 2.98Å; M552-T555 PolarHBondContact O-N 3.01Å; M552-V556 WeakPolarHBondContact O-CG2 3.19Å; M552-V556 PolarHBondContact O-N 3.07Å; M552-V556 HydrophobicContact SD-CG2 4.41Å
553	L	85.8	Confident	79	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-47.5	177.5	177.9	58.7	0	0	0	111.8	I454 Q499 K502 I503 F549 V556 Y557	I454-L553 HydrophobicContact CD1-CD1 3.87Å; Q499-L553 HydrophobicContact CB-CD2 3.89Å; Q499-L553 HydrophobicContact CG-CD2 4Å; K502-L553 HydrophobicContact CB-CD1 4.23Å; K502-L553 HydrophobicContact CB-CD2 3.98Å; K502-L553 HydrophobicContact CB-CG 4.08Å; K502-L553 HydrophobicContact CD-CD2 4.06Å; K502-L553 HydrophobicContact CD-CG 4.15Å; I503-L553 HydrophobicContact CD1-CD2 4.3Å; I503-L553 HydrophobicContact CG1-CD1 3.58Å; I503-L553 HydrophobicContact CG1-CD2 3.87Å; I503-L553 HydrophobicContact CG1-CG 4.4Å; F549-L553 VanDerWaalsContact O-CB 3.28Å; F549-L553 WeakPolarHBondContact O-CB 3.48Å; F549-L553 PolarHBondContact O-N 2.94Å; L553-V556 PolarHBondContact O-N 2.71Å; L553-Y557 WeakPolarHBondContact O-CB 3.33Å; L553-Y557 PolarHBondContact O-N 3.44Å
554	S	86.9	Confident	80.3	Confident	37 Å²	37	57.2 Å²	57.2	26%	0.259	29%	0.285	S	S	.	.	H	α-helix	trans	-68.5	-34.2	-179.9	-57.2	0	0	0	0	112.2	K502 D550 M552 K558	K502-S554 PolarHBondContact NZ-OG 2.67Å; D550-S554 WeakPolarHBondContact O-CB 3.47Å; D550-S554 PolarHBondContact O-N 3.41Å; D550-S554 PolarHBondContact O-OG 3.24Å; D550-S554 PolarHBondContact OD2-OG 3.13Å; M552-S554 PolarHBondContact O-N 2.98Å; S554-K558 VanDerWaalsContact O-CB 3.28Å; S554-K558 WeakPolarHBondContact O-CB 3.41Å; S554-K558 PolarHBondContact O-N 3.46Å
555	T	85.9	Confident	81.7	Confident	71 Å²	71	51.5 Å²	51.5	44%	0.436	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-48.9	172.9	-60.2	0	0	0	0	111	Q551 M552 K558 Q559	Q551-T555 VanDerWaalsContact O-CB 3.25Å; Q551-T555 WeakPolarHBondContact O-CB 3.36Å; Q551-T555 PolarHBondContact O-N 3.13Å; Q551-T555 PolarHBondContact O-OG1 3.3Å; M552-T555 PolarHBondContact O-N 3.01Å; T555-K558 PolarHBondContact O-N 3.03Å; T555-Q559 WeakPolarHBondContact O-CB 3.48Å; T555-Q559 VanDerWaalsContact O-CG 3.28Å; T555-Q559 WeakPolarHBondContact O-CG 3.36Å; T555-Q559 PolarHBondContact O-N 2.97Å
556	V	85.7	Confident	83.2	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-68.9	-37.3	-179.7	178.3	0	0	0	0	111.3	I454 Y455 T506 I529 M552 L553 T560	I454-V556 HydrophobicContact CG2-CB 4.32Å; I454-V556 HydrophobicContact CG2-CG1 3.49Å; I454-V556 VanDerWaalsContact CG2-CG1 3.49Å; Y455-V556 HydrophobicContact CE1-CG2 4.42Å; T506-V556 HydrophobicContact CG2-CG1 4.12Å; I529-V556 HydrophobicContact CG2-CG2 3.96Å; M552-V556 WeakPolarHBondContact O-CG2 3.19Å; M552-V556 PolarHBondContact O-N 3.07Å; M552-V556 HydrophobicContact SD-CG2 4.41Å; L553-V556 PolarHBondContact O-N 2.71Å; V556-T560 WeakPolarHBondContact O-CB 3.23Å; V556-T560 PolarHBondContact O-N 2.63Å; V556-T560 PolarHBondContact O-OG1 3.49Å
557	Y	88.7	Confident	84.3	Confident	44 Å²	44	46.2 Å²	46.2	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-55.1	-60.1	171.6	-178.7	-94.5	0	0	0	110.4	K502 V505 T506 L553 Q559 T560 S561 D764	K502-Y557 HydrophobicContact CB-CD2 4.05Å; K502-Y557 HydrophobicContact CB-CE2 4.34Å; K502-Y557 HydrophobicContact CG-CD2 4.34Å; K502-Y557 HydrophobicContact CG-CE2 4.42Å; V505-Y557 HydrophobicContact CB-CE2 3.96Å; V505-Y557 HydrophobicContact CG1-CE2 3.74Å; T506-Y557 WeakPolarHBondContact OG1-CD2 3.41Å; L553-Y557 WeakPolarHBondContact O-CB 3.33Å; L553-Y557 PolarHBondContact O-N 3.44Å; Y557-Q559 PolarHBondContact O-N 2.83Å; Y557-T560 PolarHBondContact O-N 3.06Å; Y557-S561 PolarHBondContact O-N 3.37Å; Y557-S561 PolarHBondContact O-OG 3.19Å; Y557-D764 WeakPolarHBondContact CE1-OD1 3.36Å; Y557-D764 VanDerWaalsContact CE1-OD2 3.26Å; Y557-D764 WeakPolarHBondContact CE1-OD2 3.45Å; Y557-D764 VanDerWaalsContact CZ-OD1 3.3Å; Y557-D764 VanDerWaalsContact CZ-OD2 3.26Å; Y557-D764 PolarHBondContact OH-OD1 3.3Å; Y557-D764 PolarHBondContact OH-OD2 3.01Å
558	K	87.8	Confident	84.9	Confident	83 Å²	83	40 Å²	40	36%	0.361	20%	0.201	S	C	.	.	H	α-helix	trans	-58.6	-43.8	-178	-177.9	164.2	-177	134.8	0	112.9	S554 T555 T560 S561 Q562 E763	S554-K558 VanDerWaalsContact O-CB 3.28Å; S554-K558 WeakPolarHBondContact O-CB 3.41Å; S554-K558 PolarHBondContact O-N 3.46Å; T555-K558 PolarHBondContact O-N 3.03Å; K558-T560 VanDerWaalsContact C-N 3.34Å; K558-T560 PolarHBondContact O-N 2.93Å; K558-S561 PolarHBondContact O-OG 3.4Å; K558-Q562 HydrophobicContact CG-CG 4.33Å; K558-Q562 WeakPolarHBondContact O-CB 3.07Å; K558-Q562 WeakPolarHBondContact O-CG 3.17Å; K558-Q562 PolarHBondContact O-N 2.98Å; K558-E763 IonicContact NZ-OE1 2.9Å; K558-E763 PolarHBondContact NZ-OE1 3.46Å; K558-E763 IonicContact NZ-OE2 2.75Å
559	Q	85.6	Confident	85.2	Confident	85 Å²	85	41.7 Å²	41.7	40%	0.397	21%	0.207	S	C	.	.	H	α-helix	trans	-66.7	-36.1	176.6	-71.8	172.4	-7.5	0	0	112.5	T555 Y557 H563	T555-Q559 WeakPolarHBondContact O-CB 3.48Å; T555-Q559 VanDerWaalsContact O-CG 3.28Å; T555-Q559 WeakPolarHBondContact O-CG 3.36Å; T555-Q559 PolarHBondContact O-N 2.97Å; Y557-Q559 PolarHBondContact O-N 2.83Å; Q559-H563 WeakPolarHBondContact O-CB 3.49Å; Q559-H563 PolarHBondContact O-N 3.05Å
560	T	87	Confident	85.5	Confident	1 Å²	1	44 Å²	44	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-72.3	-41	178.5	-57.8	0	0	0	0	111.2	T506 I510 R526 V556 Y557 K558 L564	T506-T560 HydrophobicContact CG2-CG2 4.29Å; I510-T560 HydrophobicContact CD1-CG2 3.97Å; I510-T560 HydrophobicContact CG1-CG2 3.56Å; R526-T560 PolarHBondContact NH1-OG1 2.86Å; V556-T560 WeakPolarHBondContact O-CB 3.23Å; V556-T560 PolarHBondContact O-N 2.63Å; V556-T560 PolarHBondContact O-OG1 3.49Å; Y557-T560 PolarHBondContact O-N 3.06Å; K558-T560 VanDerWaalsContact C-N 3.34Å; K558-T560 PolarHBondContact O-N 2.93Å; T560-L564 WeakPolarHBondContact O-CB 3.42Å; T560-L564 PolarHBondContact O-N 3.2Å
561	S	86.6	Confident	85.5	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-73	-41.3	178.9	63	0	0	0	0	112.1	Y557 K558 L564 L565 E763 D764	Y557-S561 PolarHBondContact O-N 3.37Å; Y557-S561 PolarHBondContact O-OG 3.19Å; K558-S561 PolarHBondContact O-OG 3.4Å; S561-L564 PolarHBondContact O-N 2.8Å; S561-L565 WeakPolarHBondContact O-CB 3.25Å; S561-L565 PolarHBondContact O-N 3.46Å; S561-E763 VanDerWaalsContact CB-O 3.23Å; S561-E763 WeakPolarHBondContact CB-O 3.33Å; S561-E763 PolarHBondContact OG-O 3.34Å; S561-E763 VanDerWaalsContact OG-O 3.12Å; S561-D764 WeakPolarHBondContact CB-OD1 3.23Å; S561-D764 PolarHBondContact OG-OD1 3.43Å
562	Q	85.7	Confident	85.6	Confident	82 Å²	82	45.3 Å²	45.3	38%	0.383	23%	0.226	S	C	.	.	H	α-helix	trans	-58.2	-48.3	169.9	-74.7	178.3	-28.8	0	0	111.8	K558 L564 L565 E566	K558-Q562 HydrophobicContact CG-CG 4.33Å; K558-Q562 WeakPolarHBondContact O-CB 3.07Å; K558-Q562 WeakPolarHBondContact O-CG 3.17Å; K558-Q562 PolarHBondContact O-N 2.98Å; Q562-L564 VanDerWaalsContact C-N 3.34Å; Q562-L564 PolarHBondContact O-N 3.39Å; Q562-L565 PolarHBondContact O-N 2.7Å; Q562-L565 VanDerWaalsContact O-N 3.14Å; Q562-E566 WeakPolarHBondContact O-CB 3.45Å; Q562-E566 WeakPolarHBondContact O-CG 3.12Å; Q562-E566 PolarHBondContact O-N 3.2Å
563	H	85.2	Confident	85.7	Confident	33 Å²	33	47 Å²	47	15%	0.153	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-36.8	178.9	-177.4	59.5	0	0	0	112.9	I523 Q559 T567	I523-H563 VanDerWaalsContact CG1-CD2 3.48Å; I523-H563 WeakPolarHBondContact CG1-CD2 3.4Å; Q559-H563 WeakPolarHBondContact O-CB 3.49Å; Q559-H563 PolarHBondContact O-N 3.05Å; H563-T567 WeakPolarHBondContact O-CB 3.34Å; H563-T567 PolarHBondContact O-N 3.02Å; H563-T567 PolarHBondContact O-OG1 2.94Å
564	L	87.5	Confident	85.7	Confident	2 Å²	2	47 Å²	47	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-44.4	171.5	171.6	59.2	0	0	0	111.5	W480 F512 L513 T560 S561 Q562 T567 L568 L765	W480-L564 HydrophobicContact CH2-CD2 4.39Å; F512-L564 HydrophobicContact CD1-CD1 3.54Å; F512-L564 HydrophobicContact CE1-CD1 3.75Å; L513-L564 HydrophobicContact CD1-CB 4.38Å; L513-L564 HydrophobicContact CD2-CD1 3.97Å; L513-L564 HydrophobicContact CG-CD1 4.09Å; T560-L564 WeakPolarHBondContact O-CB 3.42Å; T560-L564 PolarHBondContact O-N 3.2Å; S561-L564 PolarHBondContact O-N 2.8Å; Q562-L564 VanDerWaalsContact C-N 3.34Å; Q562-L564 PolarHBondContact O-N 3.39Å; L564-T567 PolarHBondContact O-N 2.91Å; L564-L568 HydrophobicContact CD1-CD1 3.85Å; L564-L568 HydrophobicContact CD1-CG 4.15Å; L564-L568 HydrophobicContact CG-CD1 4.07Å; L564-L568 WeakPolarHBondContact O-CG 3.28Å; L564-L568 PolarHBondContact O-N 3.21Å; L564-L765 HydrophobicContact CD2-CB 3.99Å; L564-L765 HydrophobicContact CD2-CD2 3.96Å
565	L	85.9	Confident	85.7	Confident	33 Å²	33	48 Å²	48	17%	0.173	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-45.7	179.2	-174.5	58.6	0	0	0	112	S561 Q562 T567 L568 I569 I768	S561-L565 WeakPolarHBondContact O-CB 3.25Å; S561-L565 PolarHBondContact O-N 3.46Å; Q562-L565 PolarHBondContact O-N 2.7Å; Q562-L565 VanDerWaalsContact O-N 3.14Å; L565-T567 VanDerWaalsContact C-N 3.26Å; L565-T567 PolarHBondContact O-N 3.1Å; L565-L568 PolarHBondContact O-N 3.16Å; L565-I569 HydrophobicContact CD1-CD1 3.69Å; L565-I569 HydrophobicContact CD1-CG1 4.03Å; L565-I569 HydrophobicContact CD2-CD1 4.48Å; L565-I569 HydrophobicContact CG-CD1 3.77Å; L565-I569 HydrophobicContact CG-CG1 4.4Å; L565-I569 WeakPolarHBondContact O-CB 3.26Å; L565-I569 WeakPolarHBondContact O-CG1 3.35Å; L565-I569 PolarHBondContact O-N 3.16Å; L565-I768 HydrophobicContact CD1-CD1 3.4Å; L565-I768 VanDerWaalsContact CD1-CD1 3.4Å
566	E	85.4	Confident	85.9	Confident	128 Å²	128	46.9 Å²	46.9	60%	0.598	23%	0.227	S	C	*	.	H	α-helix	trans	-57.1	-39.3	172.3	-74.2	172.4	179.9	0	0	111.7	Q562 G570	Q562-E566 WeakPolarHBondContact O-CB 3.45Å; Q562-E566 WeakPolarHBondContact O-CG 3.12Å; Q562-E566 PolarHBondContact O-N 3.2Å; E566-G570 WeakPolarHBondContact O-CA 3.28Å; E566-G570 PolarHBondContact O-N 3.24Å
567	T	85.7	Confident	86	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-68.7	-43	177.3	-58.5	0	0	0	0	111.6	L513 C517 E519 H563 L564 L565 R571 Y572	L513-T567 HydrophobicContact CD2-CG2 4Å; C517-T567 HydrophobicContact CB-CG2 4.45Å; E519-T567 VanDerWaalsContact OE1-CG2 3.26Å; E519-T567 WeakPolarHBondContact OE1-CG2 2.81Å; H563-T567 WeakPolarHBondContact O-CB 3.34Å; H563-T567 PolarHBondContact O-N 3.02Å; H563-T567 PolarHBondContact O-OG1 2.94Å; L564-T567 PolarHBondContact O-N 2.91Å; L565-T567 VanDerWaalsContact C-N 3.26Å; L565-T567 PolarHBondContact O-N 3.1Å; T567-R571 HydrophobicContact CG2-CG 4.49Å; T567-R571 WeakPolarHBondContact O-CB 2.97Å; T567-R571 PolarHBondContact O-N 2.98Å; T567-Y572 HydrophobicContact CG2-CD2 4.49Å; T567-Y572 HydrophobicContact CG2-CE2 4.31Å; T567-Y572 PolarHBondContact O-N 2.9Å
568	L	84.8	Confident	86	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-69.6	-41.4	178.5	-75.4	168.8	0	0	0	113	F512 L564 L565 Y572 H573 F574 P667 L668 L765	F512-L568 HydrophobicContact CE1-CD2 4.25Å; L564-L568 HydrophobicContact CD1-CD1 3.85Å; L564-L568 HydrophobicContact CD1-CG 4.15Å; L564-L568 HydrophobicContact CG-CD1 4.07Å; L564-L568 WeakPolarHBondContact O-CG 3.28Å; L564-L568 PolarHBondContact O-N 3.21Å; L565-L568 PolarHBondContact O-N 3.16Å; L568-Y572 CarbonylContact O-C 3.57Å; L568-H573 PolarHBondContact O-N 2.98Å; L568-F574 WeakPolarHBondContact O-CB 3.16Å; L568-F574 PolarHBondContact O-N 3.16Å; L568-F574 VanDerWaalsContact O-N 3.14Å; L568-P667 HydrophobicContact CD2-CB 4.39Å; L568-L668 HydrophobicContact CD2-CD2 4.35Å; L568-L765 HydrophobicContact CD1-CD1 3.8Å; L568-L765 HydrophobicContact CD1-CD2 4.3Å
569	I	84.2	Confident	86.1	Confident	66 Å²	66	46.8 Å²	46.8	34%	0.338	22%	0.224	S	C	.	.	H	α-helix	trans	-73	-45.7	177.1	-65.8	176.2	0	0	0	110.4	L565 H573 L575	L565-I569 HydrophobicContact CD1-CD1 3.69Å; L565-I569 HydrophobicContact CD1-CG1 4.03Å; L565-I569 HydrophobicContact CD2-CD1 4.48Å; L565-I569 HydrophobicContact CG-CD1 3.77Å; L565-I569 HydrophobicContact CG-CG1 4.4Å; L565-I569 WeakPolarHBondContact O-CB 3.26Å; L565-I569 WeakPolarHBondContact O-CG1 3.35Å; L565-I569 PolarHBondContact O-N 3.16Å; I569-H573 WeakPolarHBondContact O-CA 3.33Å; I569-H573 PolarHBondContact O-N 3.04Å; I569-L575 HydrophobicContact CG2-CD1 4.23Å
570	G	82.7	Confident	86.3	Confident	47 Å²	47	42.8 Å²	42.8	49%	0.485	21%	0.205	S	C	.	.	H	α-helix	trans	-84.8	-41	-170.5	0	0	0	0	0	115.6	E566	E566-G570 WeakPolarHBondContact O-CA 3.28Å; E566-G570 PolarHBondContact O-N 3.24Å
571	R	84.2	Confident	86.4	Confident	141 Å²	141	42.8 Å²	42.8	53%	0.532	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-33.8	-179.7	-60.2	-164.1	-170.5	171.7	17.3	113.5	E519 T567	E519-R571 IonicContact OE1-CZ 2.69Å; E519-R571 IonicContact OE1-NE 3.63Å; E519-R571 IonicContact OE1-NH1 3.35Å; E519-R571 PolarHBondContact OE1-NH1 2.89Å; E519-R571 IonicContact OE1-NH2 3.13Å; E519-R571 PolarHBondContact OE1-NH2 2.9Å; E519-R571 IonicContact OE2-CZ 3.3Å; E519-R571 IonicContact OE2-NH1 3.59Å; E519-R571 PolarHBondContact OE2-NH1 3.22Å; E519-R571 IonicContact OE2-NH2 3.81Å; E519-R571 PolarHBondContact OE2-NH2 2.96Å; T567-R571 HydrophobicContact CG2-CG 4.49Å; T567-R571 WeakPolarHBondContact O-CB 2.97Å; T567-R571 PolarHBondContact O-N 2.98Å
572	Y	83.6	Confident	86.6	Confident	59 Å²	59	45.2 Å²	45.2	23%	0.231	21%	0.214	C	C	.	.	S	Bend	trans	-108.7	12.3	-175.3	-65.2	-77.1	0	0	0	113.1	C517 T567 L568 F574 H577 P667	C517-Y572 WeakPolarHBondContact CA-OH 3.4Å; C517-Y572 HydrophobicContact CB-CE2 4Å; C517-Y572 PolarHBondContact O-OH 3.32Å; T567-Y572 HydrophobicContact CG2-CD2 4.49Å; T567-Y572 HydrophobicContact CG2-CE2 4.31Å; T567-Y572 PolarHBondContact O-N 2.9Å; L568-Y572 CarbonylContact O-C 3.57Å; Y572-F574 PolarHBondContact O-N 2.85Å; Y572-H577 PolarHBondContact O-CD2 3.22Å; Y572-H577 PolarHBondContact O-NE2 3.18Å; Y572-P667 HydrophobicContact CD1-CG 3.59Å; Y572-P667 HydrophobicContact CD2-CG 3.83Å; Y572-P667 HydrophobicContact CE1-CG 3.44Å; Y572-P667 VanDerWaalsContact CE1-CG 3.44Å; Y572-P667 HydrophobicContact CE2-CG 3.7Å; Y572-P667 HydrophobicContact CG-CG 3.78Å
573	H	84	Confident	86.7	Confident	61 Å²	61	42.1 Å²	42.1	28%	0.282	20%	0.2	S	C	.	.			trans	41.6	42.3	173.8	-58.4	108.6	0	0	0	113.9	L568 I569 L575 D576 H577	L568-H573 PolarHBondContact O-N 2.98Å; I569-H573 WeakPolarHBondContact O-CA 3.33Å; I569-H573 PolarHBondContact O-N 3.04Å; H573-L575 VanDerWaalsContact C-N 3.26Å; H573-L575 PolarHBondContact O-N 3.26Å; H573-L575 VanDerWaalsContact O-N 3.13Å; H573-D576 HydrophobicContact CB-CB 4.17Å; H573-D576 IonicContact CD2-OD2 2.8Å; H573-D576 WeakPolarHBondContact O-CB 3.37Å; H573-D576 PolarHBondContact O-N 3.01Å; H573-H577 PolarHBondContact O-CD2 3.15Å; H573-H577 PolarHBondContact O-N 3.32Å; H573-H577 VanDerWaalsContact O-N 3.08Å
574	F	86.9	Confident	86.9	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-54.7	-39.4	-169.7	168.6	-119.5	0	0	0	113.6	L568 Y572 H577 L578 L668 I671 F672 V759 I768	L568-F574 WeakPolarHBondContact O-CB 3.16Å; L568-F574 PolarHBondContact O-N 3.16Å; L568-F574 VanDerWaalsContact O-N 3.14Å; Y572-F574 PolarHBondContact O-N 2.85Å; F574-H577 PolarHBondContact O-N 3.42Å; F574-L578 HydrophobicContact CD1-CD1 4.3Å; F574-L578 HydrophobicContact CD2-CG 4.33Å; F574-L578 HydrophobicContact CE1-CD1 3.61Å; F574-L578 HydrophobicContact CE1-CG 4.41Å; F574-L578 HydrophobicContact CE2-CD1 3.85Å; F574-L578 HydrophobicContact CE2-CD2 4.28Å; F574-L578 HydrophobicContact CE2-CG 3.77Å; F574-L578 HydrophobicContact CZ-CD1 3.37Å; F574-L578 HydrophobicContact CZ-CD2 4.34Å; F574-L578 HydrophobicContact CZ-CG 3.83Å; F574-L578 PolarHBondContact O-N 2.55Å; F574-L668 HydrophobicContact CB-CD2 4.09Å; F574-L668 HydrophobicContact CD2-CD2 3.92Å; F574-L668 HydrophobicContact CG-CD2 4.43Å; F574-I671 HydrophobicContact CD2-CD1 3.87Å; F574-I671 HydrophobicContact CE1-CD1 4.47Å; F574-I671 HydrophobicContact CE2-CB 4.38Å; F574-I671 HydrophobicContact CE2-CD1 3.55Å; F574-I671 HydrophobicContact CE2-CG2 3.9Å; F574-I671 HydrophobicContact CG-CD1 4.45Å; F574-I671 HydrophobicContact CZ-CD1 3.86Å; F574-I671 HydrophobicContact CZ-CG2 4.02Å; F574-F672 HydrophobicContact CD2-CE2 4.34Å; F574-F672 HydrophobicContact CE2-CE2 4Å; F574-V759 HydrophobicContact CE1-CG1 4.46Å; F574-I768 HydrophobicContact CE1-CG2 3.61Å; F574-I768 HydrophobicContact CZ-CG2 3.63Å
575	L	87.1	Confident	87	Confident	56 Å²	56	41 Å²	41	29%	0.293	20%	0.195	S	C	.	.	H	α-helix	trans	-65.5	-37.1	177.4	-65.8	178.7	0	0	0	112.3	I569 H573 L578 R579 V759	I569-L575 HydrophobicContact CG2-CD1 4.23Å; H573-L575 VanDerWaalsContact C-N 3.26Å; H573-L575 PolarHBondContact O-N 3.26Å; H573-L575 VanDerWaalsContact O-N 3.13Å; L575-L578 PolarHBondContact O-N 3.32Å; L575-R579 VanDerWaalsContact O-CB 3.31Å; L575-R579 WeakPolarHBondContact O-CB 3.35Å; L575-R579 PolarHBondContact O-N 3.29Å; L575-V759 HydrophobicContact CD2-CG1 3.8Å
576	D	88.9	Confident	87.1	Confident	48 Å²	48	39.7 Å²	39.7	26%	0.257	19%	0.188	S	C	.	.	H	α-helix	trans	-70.1	-36.9	177.7	-61.3	-30.4	0	0	0	110.7	H573 R579 A580 Q633 I636	H573-D576 HydrophobicContact CB-CB 4.17Å; H573-D576 IonicContact CD2-OD2 2.8Å; H573-D576 WeakPolarHBondContact O-CB 3.37Å; H573-D576 PolarHBondContact O-N 3.01Å; D576-R579 PolarHBondContact O-N 3.32Å; D576-A580 VanDerWaalsContact O-CB 3.28Å; D576-A580 WeakPolarHBondContact O-CB 3.4Å; D576-A580 PolarHBondContact O-N 3.05Å; D576-Q633 PolarHBondContact OD2-NE2 2.81Å; D576-I636 HydrophobicContact CB-CD1 4.08Å
577	H	89.2	Confident	87.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.8	-35.7	173.4	-61.3	-47	0	0	0	113.5	Y572 H573 F574 T581 R639 Y662 L668	Y572-H577 PolarHBondContact O-CD2 3.22Å; Y572-H577 PolarHBondContact O-NE2 3.18Å; H573-H577 PolarHBondContact O-CD2 3.15Å; H573-H577 PolarHBondContact O-N 3.32Å; H573-H577 VanDerWaalsContact O-N 3.08Å; F574-H577 PolarHBondContact O-N 3.42Å; H577-T581 WeakPolarHBondContact O-CB 3.38Å; H577-T581 PolarHBondContact O-N 2.93Å; H577-T581 PolarHBondContact O-OG1 2.71Å; H577-R639 PolarHBondContact CD2-NH1 3.2Å; H577-R639 PolarHBondContact CE1-NH1 3.21Å; H577-R639 PolarHBondContact NE2-NH1 2.86Å; H577-Y662 HydrophobicContact CB-CE1 4.37Å; H577-Y662 PolarHBondContact ND1-OH 3.25Å; H577-L668 WeakPolarHBondContact CD2-CD1 3.43Å
578	L	88.8	Confident	87.1	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-44.3	169.2	-82.8	176.8	0	0	0	111.2	F574 L575 T581 R582 F672 W752	F574-L578 HydrophobicContact CD1-CD1 4.3Å; F574-L578 HydrophobicContact CD2-CG 4.33Å; F574-L578 HydrophobicContact CE1-CD1 3.61Å; F574-L578 HydrophobicContact CE1-CG 4.41Å; F574-L578 HydrophobicContact CE2-CD1 3.85Å; F574-L578 HydrophobicContact CE2-CD2 4.28Å; F574-L578 HydrophobicContact CE2-CG 3.77Å; F574-L578 HydrophobicContact CZ-CD1 3.37Å; F574-L578 HydrophobicContact CZ-CD2 4.34Å; F574-L578 HydrophobicContact CZ-CG 3.83Å; F574-L578 PolarHBondContact O-N 2.55Å; L575-L578 PolarHBondContact O-N 3.32Å; L578-T581 WeakPolarHBondContact O-CB 3.39Å; L578-T581 PolarHBondContact O-N 2.95Å; L578-R582 PolarHBondContact O-N 3.32Å; L578-F672 HydrophobicContact CD2-CE1 4.2Å; L578-F672 HydrophobicContact CD2-CZ 3.73Å; L578-F672 HydrophobicContact CG-CZ 4.23Å; L578-W752 HydrophobicContact CB-CH2 4.07Å; L578-W752 HydrophobicContact CB-CZ3 4.46Å
579	R	89.7	Confident	86.9	Confident	123 Å²	123	39.3 Å²	39.3	46%	0.464	20%	0.198	S	C	.	.	H	α-helix	trans	-62.7	-44.2	177.7	-178.9	-173.4	160.6	174.2	-7.4	111.4	L575 D576 T581 R582 Q583 E632	L575-R579 VanDerWaalsContact O-CB 3.31Å; L575-R579 WeakPolarHBondContact O-CB 3.35Å; L575-R579 PolarHBondContact O-N 3.29Å; D576-R579 PolarHBondContact O-N 3.32Å; R579-T581 PolarHBondContact O-N 3.23Å; R579-R582 CarbonylContact O-C 3.5Å; R579-R582 WeakPolarHBondContact O-CA 3.33Å; R579-R582 WeakPolarHBondContact O-CB 3.22Å; R579-R582 PolarHBondContact O-N 2.73Å; R579-R582 VanDerWaalsContact O-N 3.12Å; R579-Q583 WeakPolarHBondContact O-CG 3.33Å; R579-Q583 PolarHBondContact O-N 3.49Å; R579-Q583 PolarHBondContact O-OE1 2.89Å; R579-E632 IonicContact NH2-OE1 3.85Å
580	A	89.4	Confident	87	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-43	174.4	0	0	0	0	0	112.3	D576 R582 Q583 F584 I636 Y662	D576-A580 VanDerWaalsContact O-CB 3.28Å; D576-A580 WeakPolarHBondContact O-CB 3.4Å; D576-A580 PolarHBondContact O-N 3.05Å; A580-R582 VanDerWaalsContact C-N 3.25Å; A580-R582 PolarHBondContact O-N 3.41Å; A580-Q583 PolarHBondContact O-N 3.48Å; A580-Q583 VanDerWaalsContact O-N 3.13Å; A580-F584 HydrophobicContact CB-CD2 4.13Å; A580-F584 HydrophobicContact CB-CE2 4.19Å; A580-F584 VanDerWaalsContact O-CD2 3.28Å; A580-F584 WeakPolarHBondContact O-CD2 2.97Å; A580-F584 PolarHBondContact O-N 3.41Å; A580-I636 HydrophobicContact CB-CB 4.48Å; A580-I636 HydrophobicContact CB-CD1 4.36Å; A580-I636 HydrophobicContact CB-CG1 4.45Å; A580-I636 HydrophobicContact CB-CG2 3.28Å; A580-Y662 HydrophobicContact CB-CE2 4.45Å
581	T	88.8	Confident	87.4	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	19%	0.186	C	C	.	.	I	π-helix	trans	-58	-40.7	174.3	-54	0	0	0	0	110.6	H577 L578 R579 L585 L586 F672 Y680	H577-T581 WeakPolarHBondContact O-CB 3.38Å; H577-T581 PolarHBondContact O-N 2.93Å; H577-T581 PolarHBondContact O-OG1 2.71Å; L578-T581 WeakPolarHBondContact O-CB 3.39Å; L578-T581 PolarHBondContact O-N 2.95Å; R579-T581 PolarHBondContact O-N 3.23Å; T581-L585 HydrophobicContact CG2-CB 4.22Å; T581-L585 HydrophobicContact CG2-CD2 4.07Å; T581-L585 WeakPolarHBondContact O-CA 3.44Å; T581-L585 VanDerWaalsContact O-CB 3.25Å; T581-L585 WeakPolarHBondContact O-CB 3.35Å; T581-L585 PolarHBondContact O-N 3.32Å; T581-L586 PolarHBondContact O-N 2.98Å; T581-L586 VanDerWaalsContact O-N 3.15Å; T581-F672 HydrophobicContact CG2-CE1 4.41Å; T581-Y680 HydrophobicContact CG2-CD1 4.09Å; T581-Y680 HydrophobicContact CG2-CD2 4.31Å; T581-Y680 HydrophobicContact CG2-CE1 3.64Å; T581-Y680 HydrophobicContact CG2-CE2 3.89Å; T581-Y680 HydrophobicContact CG2-CG 4.41Å
582	R	90.5	Very high	87.7	Confident	56 Å²	56	30.6 Å²	30.6	21%	0.211	16%	0.161	C	C	.	.	I	π-helix	trans	-67	-45.4	172.6	177.4	-173.8	144	140.1	7.9	112.6	L578 R579 A580 L586 G588 E749 W752	L578-R582 PolarHBondContact O-N 3.32Å; R579-R582 CarbonylContact O-C 3.5Å; R579-R582 WeakPolarHBondContact O-CA 3.33Å; R579-R582 WeakPolarHBondContact O-CB 3.22Å; R579-R582 PolarHBondContact O-N 2.73Å; R579-R582 VanDerWaalsContact O-N 3.12Å; A580-R582 VanDerWaalsContact C-N 3.25Å; A580-R582 PolarHBondContact O-N 3.41Å; R582-L586 CarbonylContact O-C 3.6Å; R582-G588 PolarHBondContact O-N 3.36Å; R582-G588 VanDerWaalsContact O-N 3.11Å; R582-E749 IonicContact CZ-OE1 2.86Å; R582-E749 IonicContact CZ-OE2 2.9Å; R582-E749 IonicContact NH1-OE1 3.67Å; R582-E749 IonicContact NH1-OE2 2.69Å; R582-E749 PolarHBondContact NH1-OE2 3.29Å; R582-E749 IonicContact NH2-OE1 3.82Å; R582-E749 PolarHBondContact NH2-OE1 2.98Å; R582-E749 IonicContact NH2-OE2 2.63Å; R582-E749 PolarHBondContact NH2-OE2 2.81Å; R582-E749 VanDerWaalsContact NH2-OE2 3.13Å; R582-W752 HydrophobicContact CB-CE3 4.14Å; R582-W752 HydrophobicContact CB-CH2 4.24Å; R582-W752 HydrophobicContact CB-CZ3 3.88Å; R582-W752 VanDerWaalsContact CD-CD2 3.43Å; R582-W752 HydrophobicContact CG-CE3 4.31Å
583	Q	88.6	Confident	88.1	Confident	17 Å²	17	27.9 Å²	27.9	8%	0.079	15%	0.15	C	C	.	.	I	π-helix	trans	-62.6	-50.6	-177.8	-78.2	165.9	-57.3	0	0	112.2	R579 A580 L587 G588 Q589 E632	R579-Q583 WeakPolarHBondContact O-CG 3.33Å; R579-Q583 PolarHBondContact O-N 3.49Å; R579-Q583 PolarHBondContact O-OE1 2.89Å; A580-Q583 PolarHBondContact O-N 3.48Å; A580-Q583 VanDerWaalsContact O-N 3.13Å; Q583-L587 CarbonylContact O-C 3.39Å; Q583-G588 PolarHBondContact O-N 3.04Å; Q583-G588 VanDerWaalsContact O-N 3.11Å; Q583-Q589 HydrophobicContact CB-CB 4.01Å; Q583-Q589 HydrophobicContact CG-CB 4.4Å; Q583-Q589 WeakPolarHBondContact O-CB 3.17Å; Q583-Q589 PolarHBondContact O-N 2.81Å; Q583-E632 PolarHBondContact NE2-OE1 3.4Å
584	F	89.2	Confident	88.4	Confident	3 Å²	3	29.9 Å²	29.9	1%	0.013	16%	0.159	C	C	.	.	I	π-helix	trans	-93.6	-47.9	-172.8	-56.7	-64.1	0	0	0	113.2	A580 F592 A629 I636 L637 L640	A580-F584 HydrophobicContact CB-CD2 4.13Å; A580-F584 HydrophobicContact CB-CE2 4.19Å; A580-F584 VanDerWaalsContact O-CD2 3.28Å; A580-F584 WeakPolarHBondContact O-CD2 2.97Å; A580-F584 PolarHBondContact O-N 3.41Å; F584-F592 AromaticContact CD1-CD1 3.71Å; F584-F592 HydrophobicContact CD1-CD1 3.71Å; F584-F592 AromaticContact CD1-CE1 3.64Å; F584-F592 HydrophobicContact CD1-CE1 3.64Å; F584-F592 HydrophobicContact CD1-CG 4.49Å; F584-F592 HydrophobicContact CD1-CZ 4.36Å; F584-F592 HydrophobicContact CE1-CD1 4.05Å; F584-F592 HydrophobicContact CE1-CE1 4.19Å; F584-F592 HydrophobicContact CE1-CG 4.4Å; F584-A629 HydrophobicContact CE1-CB 4.21Å; F584-A629 HydrophobicContact CZ-CB 4.43Å; F584-I636 HydrophobicContact CD2-CG2 4.47Å; F584-I636 HydrophobicContact CE2-CG2 3.85Å; F584-L637 HydrophobicContact CZ-CD2 4.21Å; F584-L640 HydrophobicContact CB-CD1 3.86Å; F584-L640 HydrophobicContact CB-CD2 4.2Å; F584-L640 HydrophobicContact CD1-CD2 3.86Å; F584-L640 HydrophobicContact CD2-CD2 4.37Å; F584-L640 HydrophobicContact CE1-CD2 4.32Å; F584-L640 HydrophobicContact CG-CD1 4.33Å; F584-L640 HydrophobicContact CG-CD2 3.89Å
585	L	88.4	Confident	88.6	Confident	9 Å²	9	32.3 Å²	32.3	5%	0.047	17%	0.171	C	C	.	.	I	π-helix	trans	-88.9	-23.3	-170.4	-166.5	58.8	0	0	0	113.6	T581 L660 Y680 F684	T581-L585 HydrophobicContact CG2-CB 4.22Å; T581-L585 HydrophobicContact CG2-CD2 4.07Å; T581-L585 WeakPolarHBondContact O-CA 3.44Å; T581-L585 VanDerWaalsContact O-CB 3.25Å; T581-L585 WeakPolarHBondContact O-CB 3.35Å; T581-L585 PolarHBondContact O-N 3.32Å; L585-L660 VanDerWaalsContact CD1-O 3.3Å; L585-L660 WeakPolarHBondContact CD1-O 3.36Å; L585-Y680 HydrophobicContact CD2-CD1 4.32Å; L585-Y680 HydrophobicContact CD2-CD2 4.48Å; L585-Y680 HydrophobicContact CD2-CG 3.93Å; L585-F684 HydrophobicContact CD1-CB 3.94Å; L585-F684 HydrophobicContact CD1-CD2 3.92Å; L585-F684 HydrophobicContact CD1-CG 4.09Å; L585-F684 WeakPolarHBondContact O-CD2 3.32Å
586	L	89.2	Confident	88.8	Confident	5 Å²	5	29.7 Å²	29.7	3%	0.026	16%	0.157	C	C	.	.	S	Bend	trans	-101.8	13.1	168.8	-59.6	175.7	0	0	0	113.1	T581 R582 G588 Y680 L687 L748 F775	T581-L586 PolarHBondContact O-N 2.98Å; T581-L586 VanDerWaalsContact O-N 3.15Å; R582-L586 CarbonylContact O-C 3.6Å; L586-G588 PolarHBondContact O-N 3.07Å; L586-Y680 HydrophobicContact CD1-CE1 4.14Å; L586-Y680 HydrophobicContact CD2-CD1 4.06Å; L586-Y680 HydrophobicContact CD2-CE1 4.33Å; L586-Y680 HydrophobicContact CG-CD1 4.38Å; L586-Y680 HydrophobicContact CG-CE1 4.29Å; L586-L687 HydrophobicContact CD2-CD1 4.21Å; L586-L748 HydrophobicContact CB-CD2 4.31Å; L586-L748 HydrophobicContact CD1-CD2 4.08Å; L586-L748 HydrophobicContact CD2-CD2 4.37Å; L586-L748 HydrophobicContact CG-CD2 4.5Å; L586-F775 HydrophobicContact CD1-CE1 4.17Å; L586-F775 HydrophobicContact CD1-CZ 3.75Å
587	L	89.3	Confident	88.9	Confident	26 Å²	26	27.4 Å²	27.4	14%	0.136	15%	0.145	C	C	.	.			trans	57.9	24.7	177	-63.9	69.9	0	0	0	114.1	Q583 Q589 I593 F684 L687 K691	Q583-L587 CarbonylContact O-C 3.39Å; L587-Q589 PolarHBondContact O-N 2.8Å; L587-I593 HydrophobicContact CB-CG1 4.28Å; L587-I593 HydrophobicContact CD2-CG2 4.13Å; L587-I593 HydrophobicContact CG-CD1 4.31Å; L587-I593 HydrophobicContact CG-CG1 4.24Å; L587-I593 HydrophobicContact CG-CG2 4.37Å; L587-F684 HydrophobicContact CD1-CD2 3.59Å; L587-F684 HydrophobicContact CD1-CE2 3.78Å; L587-L687 HydrophobicContact CD1-CB 3.83Å; L587-L687 HydrophobicContact CD1-CD1 4.18Å; L587-L687 HydrophobicContact CD2-CB 4.14Å; L587-K691 HydrophobicContact CD2-CB 4.03Å; L587-K691 HydrophobicContact CD2-CG 4.22Å
588	G	82.2	Confident	89	Confident	45 Å²	45	31.4 Å²	31.4	46%	0.464	17%	0.166	S	C	.	.			trans	-64.1	-25.1	179.2	0	0	0	0	0	114	R582 Q583 L586 G590	R582-G588 PolarHBondContact O-N 3.36Å; R582-G588 VanDerWaalsContact O-N 3.11Å; Q583-G588 PolarHBondContact O-N 3.04Å; Q583-G588 VanDerWaalsContact O-N 3.11Å; L586-G588 PolarHBondContact O-N 3.07Å; G588-G590 PolarHBondContact O-N 3.3Å
589	Q	80.8	Confident	89.1	Confident	56 Å²	56	33.8 Å²	33.8	26%	0.262	18%	0.179	S	C	.	.			trans	-95.1	86.4	178.4	-165.4	62.4	33.5	0	0	110.7	Q583 L587 D591 F592 I593	Q583-Q589 HydrophobicContact CB-CB 4.01Å; Q583-Q589 HydrophobicContact CG-CB 4.4Å; Q583-Q589 WeakPolarHBondContact O-CB 3.17Å; Q583-Q589 PolarHBondContact O-N 2.81Å; L587-Q589 PolarHBondContact O-N 2.8Å; Q589-D591 WeakPolarHBondContact CG-OD1 3.19Å; Q589-D591 PolarHBondContact NE2-OD1 3Å; Q589-D591 PolarHBondContact O-N 2.84Å; Q589-F592 HydrophobicContact CG-CB 4.06Å; Q589-I593 WeakPolarHBondContact O-CG1 3.49Å; Q589-I593 PolarHBondContact O-N 2.89Å
590	G	85.8	Confident	89.1	Confident	37 Å²	37	28 Å²	28	38%	0.381	16%	0.157	S	C	.	.	H	α-helix	trans	-67.3	-31	-169.3	0	0	0	0	0	116.1	G588 Q594	G588-G590 PolarHBondContact O-N 3.3Å; G590-Q594 VanDerWaalsContact O-CB 3.26Å; G590-Q594 WeakPolarHBondContact O-CB 3.4Å; G590-Q594 PolarHBondContact O-N 3.25Å
591	D	90.1	Very high	89	Confident	34 Å²	34	30.5 Å²	30.5	18%	0.182	17%	0.17	C	C	.	.	H	α-helix	trans	-68.2	-47.7	179.5	63.6	-26.6	0	0	0	111.4	Q589 Q594 H595 N628	Q589-D591 WeakPolarHBondContact CG-OD1 3.19Å; Q589-D591 PolarHBondContact NE2-OD1 3Å; Q589-D591 PolarHBondContact O-N 2.84Å; D591-Q594 PolarHBondContact O-N 2.96Å; D591-H595 PolarHBondContact O-N 3Å; D591-N628 PolarHBondContact OD2-ND2 3.34Å
592	F	91	Very high	88.7	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-51.5	173.9	167.2	-107	0	0	0	112.1	F584 Q589 Q594 H595 L596 L620 A623 I624 A629 L640 L660	F584-F592 AromaticContact CD1-CD1 3.71Å; F584-F592 HydrophobicContact CD1-CD1 3.71Å; F584-F592 AromaticContact CD1-CE1 3.64Å; F584-F592 HydrophobicContact CD1-CE1 3.64Å; F584-F592 HydrophobicContact CD1-CG 4.49Å; F584-F592 HydrophobicContact CD1-CZ 4.36Å; F584-F592 HydrophobicContact CE1-CD1 4.05Å; F584-F592 HydrophobicContact CE1-CE1 4.19Å; F584-F592 HydrophobicContact CE1-CG 4.4Å; Q589-F592 HydrophobicContact CG-CB 4.06Å; F592-Q594 VanDerWaalsContact C-N 3.31Å; F592-Q594 PolarHBondContact O-N 3.14Å; F592-H595 PolarHBondContact O-N 2.87Å; F592-L596 HydrophobicContact CE1-CD2 4.11Å; F592-L596 HydrophobicContact CZ-CD2 3.88Å; F592-L596 WeakPolarHBondContact O-CB 3.34Å; F592-L596 PolarHBondContact O-N 2.76Å; F592-L620 HydrophobicContact CE2-CD1 4.2Å; F592-L620 HydrophobicContact CZ-CD1 3.62Å; F592-A623 HydrophobicContact CE2-CB 4.16Å; F592-I624 HydrophobicContact CE2-CG1 3.71Å; F592-I624 HydrophobicContact CZ-CG1 4.32Å; F592-A629 HydrophobicContact CD2-CB 4.37Å; F592-L640 HydrophobicContact CE1-CD2 4.45Å; F592-L640 HydrophobicContact CZ-CD2 4.17Å; F592-L660 HydrophobicContact CE1-CD1 4.4Å
593	I	91.5	Very high	88.3	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-35.1	-178.8	-64.4	-64.6	0	0	0	111.8	L587 Q589 L596 M597 L660 W688 K691	L587-I593 HydrophobicContact CB-CG1 4.28Å; L587-I593 HydrophobicContact CD2-CG2 4.13Å; L587-I593 HydrophobicContact CG-CD1 4.31Å; L587-I593 HydrophobicContact CG-CG1 4.24Å; L587-I593 HydrophobicContact CG-CG2 4.37Å; Q589-I593 WeakPolarHBondContact O-CG1 3.49Å; Q589-I593 PolarHBondContact O-N 2.89Å; I593-L596 HydrophobicContact CD1-CD2 4.48Å; I593-M597 WeakPolarHBondContact O-CG 3.06Å; I593-M597 PolarHBondContact O-N 3.46Å; I593-L660 HydrophobicContact CD1-CD1 4.22Å; I593-W688 HydrophobicContact CG2-CZ3 4.28Å; I593-K691 HydrophobicContact CG2-CG 4.28Å
594	Q	90.2	Very high	88.1	Confident	103 Å²	103	30.7 Å²	30.7	48%	0.481	18%	0.182	S	C	.	.	H	α-helix	trans	-66.6	-49.9	176.4	-177.4	171.4	-20	0	0	111.8	G590 D591 F592 L596 M597 D598	G590-Q594 VanDerWaalsContact O-CB 3.26Å; G590-Q594 WeakPolarHBondContact O-CB 3.4Å; G590-Q594 PolarHBondContact O-N 3.25Å; D591-Q594 PolarHBondContact O-N 2.96Å; F592-Q594 VanDerWaalsContact C-N 3.31Å; F592-Q594 PolarHBondContact O-N 3.14Å; Q594-L596 VanDerWaalsContact C-N 3.33Å; Q594-L596 PolarHBondContact O-N 3.03Å; Q594-M597 WeakPolarHBondContact O-CB 3.35Å; Q594-M597 PolarHBondContact O-N 2.91Å; Q594-M597 VanDerWaalsContact O-N 3.16Å; Q594-D598 PolarHBondContact O-N 3.4Å
595	H	91.4	Very high	87.7	Confident	52 Å²	52	35.2 Å²	35.2	24%	0.241	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-39.6	177.5	-173.3	58.4	0	0	0	112.1	D591 F592 M597 D598 L599 D626 T627	D591-H595 PolarHBondContact O-N 3Å; F592-H595 PolarHBondContact O-N 2.87Å; H595-M597 VanDerWaalsContact C-N 3.34Å; H595-M597 PolarHBondContact O-N 3.39Å; H595-D598 PolarHBondContact O-N 3.03Å; H595-L599 WeakPolarHBondContact O-CG 3.45Å; H595-L599 PolarHBondContact O-N 3.25Å; H595-L599 VanDerWaalsContact O-N 3.09Å; H595-D626 IonicContact CD2-OD2 3.38Å; H595-D626 IonicContact CE1-OD2 3.86Å; H595-D626 WeakPolarHBondContact NE2-CB 3.5Å; H595-D626 IonicContact NE2-OD2 2.73Å; H595-D626 PolarHBondContact NE2-OD2 2.85Å; H595-T627 HydrophobicContact CB-CG2 3.78Å
596	L	92.2	Very high	87.3	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-42.8	173.5	-178.3	64.5	0	0	0	111.6	F592 I593 Q594 L600 I619 L620 A623 F658 L660	F592-L596 HydrophobicContact CE1-CD2 4.11Å; F592-L596 HydrophobicContact CZ-CD2 3.88Å; F592-L596 WeakPolarHBondContact O-CB 3.34Å; F592-L596 PolarHBondContact O-N 2.76Å; I593-L596 HydrophobicContact CD1-CD2 4.48Å; Q594-L596 VanDerWaalsContact C-N 3.33Å; Q594-L596 PolarHBondContact O-N 3.03Å; L596-L600 HydrophobicContact CD1-CD1 3.84Å; L596-L600 HydrophobicContact CD1-CG 4.12Å; L596-L600 HydrophobicContact CD2-CD1 4.35Å; L596-L600 HydrophobicContact CG-CD1 3.68Å; L596-L600 HydrophobicContact CG-CG 4.32Å; L596-L600 WeakPolarHBondContact O-CB 3.45Å; L596-L600 WeakPolarHBondContact O-CG 3.28Å; L596-L600 PolarHBondContact O-N 3.12Å; L596-I619 HydrophobicContact CD1-CG2 4.4Å; L596-L620 HydrophobicContact CD1-CD1 4.11Å; L596-L620 HydrophobicContact CD2-CD1 4.19Å; L596-A623 HydrophobicContact CB-CB 4.18Å; L596-A623 HydrophobicContact CD1-CB 3.85Å; L596-F658 HydrophobicContact CD2-CZ 4.5Å; L596-L660 HydrophobicContact CD2-CD1 4.12Å; L596-L660 HydrophobicContact CD2-CD2 4.49Å
597	M	90.7	Very high	86.6	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-42.8	174.5	-77	-170.7	-54.3	0	0	112.9	I593 Q594 H595 L599 L600 D601 W688 K691 F695	I593-M597 WeakPolarHBondContact O-CG 3.06Å; I593-M597 PolarHBondContact O-N 3.46Å; Q594-M597 WeakPolarHBondContact O-CB 3.35Å; Q594-M597 PolarHBondContact O-N 2.91Å; Q594-M597 VanDerWaalsContact O-N 3.16Å; H595-M597 VanDerWaalsContact C-N 3.34Å; H595-M597 PolarHBondContact O-N 3.39Å; M597-L599 VanDerWaalsContact C-N 3.29Å; M597-L599 PolarHBondContact O-N 3.01Å; M597-L600 PolarHBondContact O-N 3.5Å; M597-D601 PolarHBondContact O-N 3.01Å; M597-W688 HydrophobicContact CG-CH2 3.51Å; M597-W688 HydrophobicContact CG-CZ2 4.44Å; M597-W688 HydrophobicContact CG-CZ3 3.74Å; M597-W688 HydrophobicContact SD-CH2 4.38Å; M597-W688 HydrophobicContact SD-CZ3 4.25Å; M597-K691 HydrophobicContact CE-CD 4.11Å; M597-K691 HydrophobicContact CE-CG 3.71Å; M597-K691 HydrophobicContact SD-CG 3.77Å; M597-F695 HydrophobicContact CB-CD2 4.32Å; M597-F695 HydrophobicContact CB-CE2 4.27Å; M597-F695 HydrophobicContact CB-CG 4.47Å; M597-F695 HydrophobicContact CB-CZ 4.37Å; M597-F695 HydrophobicContact CE-CB 3.85Å; M597-F695 HydrophobicContact CE-CD2 3.85Å; M597-F695 HydrophobicContact CE-CG 3.99Å; M597-F695 HydrophobicContact SD-CB 3.93Å; M597-F695 HydrophobicContact SD-CD2 4.49Å; M597-F695 HydrophobicContact SD-CG 4.12Å
598	D	91.2	Very high	85.6	Confident	83 Å²	83	39.7 Å²	39.7	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-58.7	-40	178.1	-80.6	-47.1	0	0	0	111.7	Q594 H595 F695	Q594-D598 PolarHBondContact O-N 3.4Å; H595-D598 PolarHBondContact O-N 3.03Å; D598-F695 VanDerWaalsContact OD1-CE2 3.24Å; D598-F695 WeakPolarHBondContact OD1-CE2 3.31Å; D598-F695 WeakPolarHBondContact OD1-CZ 3.32Å
599	L	91.1	Very high	85.2	Confident	56 Å²	56	42.5 Å²	42.5	29%	0.293	24%	0.242	S	C	.	.	H	α-helix	trans	-75	-35.8	174.8	-62.9	178.9	0	0	0	113.1	H595 M597 S602 N603 I619 T622 A623	H595-L599 WeakPolarHBondContact O-CG 3.45Å; H595-L599 PolarHBondContact O-N 3.25Å; H595-L599 VanDerWaalsContact O-N 3.09Å; M597-L599 VanDerWaalsContact C-N 3.29Å; M597-L599 PolarHBondContact O-N 3.01Å; L599-S602 PolarHBondContact O-OG 3.45Å; L599-N603 PolarHBondContact O-ND2 3.22Å; L599-I619 HydrophobicContact CB-CG2 3.69Å; L599-I619 HydrophobicContact CD1-CG2 4.31Å; L599-T622 HydrophobicContact CD1-CG2 4.39Å; L599-A623 HydrophobicContact CD1-CB 4.15Å
600	L	89.7	Confident	85.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-76.5	-28.5	-177.2	-78.2	177.6	0	0	0	114.3	L596 M597 S602 N603 L604 L616 I619 F658 W688	L596-L600 HydrophobicContact CD1-CD1 3.84Å; L596-L600 HydrophobicContact CD1-CG 4.12Å; L596-L600 HydrophobicContact CD2-CD1 4.35Å; L596-L600 HydrophobicContact CG-CD1 3.68Å; L596-L600 HydrophobicContact CG-CG 4.32Å; L596-L600 WeakPolarHBondContact O-CB 3.45Å; L596-L600 WeakPolarHBondContact O-CG 3.28Å; L596-L600 PolarHBondContact O-N 3.12Å; M597-L600 PolarHBondContact O-N 3.5Å; L600-S602 VanDerWaalsContact C-N 3.29Å; L600-S602 PolarHBondContact O-N 2.91Å; L600-N603 CarbonylContact O-C 3.59Å; L600-N603 WeakPolarHBondContact O-CA 3.34Å; L600-N603 PolarHBondContact O-N 3.26Å; L600-L604 HydrophobicContact CB-CD1 3.81Å; L600-L604 HydrophobicContact CB-CG 4.03Å; L600-L604 HydrophobicContact CD1-CD1 4.2Å; L600-L604 HydrophobicContact CG-CD1 4.49Å; L600-L604 PolarHBondContact O-N 3.15Å; L600-L616 HydrophobicContact CD2-CD2 3.52Å; L600-I619 HydrophobicContact CD2-CD1 4.39Å; L600-I619 HydrophobicContact CD2-CG2 3.98Å; L600-I619 HydrophobicContact CG-CG2 4.2Å; L600-F658 HydrophobicContact CD1-CD1 4.42Å; L600-F658 HydrophobicContact CD1-CD2 4.47Å; L600-F658 HydrophobicContact CD1-CE1 3.81Å; L600-F658 HydrophobicContact CD1-CE2 3.87Å; L600-F658 HydrophobicContact CD1-CZ 3.49Å; L600-F658 VanDerWaalsContact CD1-CZ 3.49Å; L600-F658 HydrophobicContact CD2-CE2 4.44Å; L600-W688 HydrophobicContact CD1-CH2 4.18Å; L600-W688 HydrophobicContact CD1-CZ2 4.46Å
601	D	86.5	Confident	84.9	Confident	53 Å²	53	45 Å²	45	28%	0.283	25%	0.245	S	C	.	.	H	α-helix	trans	-49.2	-47.1	-175.4	-177.9	48.4	0	0	0	112.6	M597 N603 L604 N605 W655 F695	M597-D601 PolarHBondContact O-N 3.01Å; D601-N603 PolarHBondContact O-N 2.94Å; D601-L604 PolarHBondContact O-N 2.92Å; D601-N605 WeakPolarHBondContact O-CB 3.27Å; D601-N605 VanDerWaalsContact O-CG 3.28Å; D601-N605 PolarHBondContact O-N 2.92Å; D601-N605 PolarHBondContact O-ND2 3.27Å; D601-N605 PolarHBondContact OD1-ND2 2.94Å; D601-W655 HydrophobicContact CB-CZ2 4.4Å; D601-F695 HydrophobicContact CB-CE1 4.16Å
602	S	84	Confident	84.4	Confident	70 Å²	70	49 Å²	49	49%	0.49	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-14.8	177.6	70.6	0	0	0	0	115.5	L599 L600 K606	L599-S602 PolarHBondContact O-OG 3.45Å; L600-S602 VanDerWaalsContact C-N 3.29Å; L600-S602 PolarHBondContact O-N 2.91Å; S602-K606 WeakPolarHBondContact O-CE 3.17Å; S602-K606 PolarHBondContact O-NZ 3.34Å; S602-K606 VanDerWaalsContact O-NZ 3.11Å
603	N	82.1	Confident	84.1	Confident	9 Å²	9	53.1 Å²	53.1	5%	0.048	29%	0.287	C	S	.	.	H	α-helix	trans	-111.9	-36.4	-177.5	-57.9	-69	0	0	0	112.2	L599 L600 D601 K606 R615 I619	L599-N603 PolarHBondContact O-ND2 3.22Å; L600-N603 CarbonylContact O-C 3.59Å; L600-N603 WeakPolarHBondContact O-CA 3.34Å; L600-N603 PolarHBondContact O-N 3.26Å; D601-N603 PolarHBondContact O-N 2.94Å; N603-K606 WeakPolarHBondContact O-CB 3.3Å; N603-K606 PolarHBondContact O-N 3.45Å; N603-K606 PolarHBondContact OD1-NZ 2.96Å; N603-R615 VanDerWaalsContact OD1-CZ 3.28Å; N603-R615 PolarHBondContact OD1-NE 2.86Å; N603-R615 PolarHBondContact OD1-NH2 3.34Å; N603-R615 VanDerWaalsContact OD1-NH2 3.16Å; N603-I619 VanDerWaalsContact ND2-CD1 3.31Å; N603-I619 WeakPolarHBondContact ND2-CD1 3.23Å
604	L	83.4	Confident	83.8	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-76.9	-20.4	179.1	-61.2	-177	0	0	0	113.6	L600 D601 K606 G654 W655 F658 W688	L600-L604 HydrophobicContact CB-CD1 3.81Å; L600-L604 HydrophobicContact CB-CG 4.03Å; L600-L604 HydrophobicContact CD1-CD1 4.2Å; L600-L604 HydrophobicContact CG-CD1 4.49Å; L600-L604 PolarHBondContact O-N 3.15Å; D601-L604 PolarHBondContact O-N 2.92Å; L604-K606 PolarHBondContact O-N 3.49Å; L604-G654 PolarHBondContact O-N 3.39Å; L604-G654 VanDerWaalsContact O-N 3.09Å; L604-W655 HydrophobicContact CB-CD2 3.77Å; L604-W655 HydrophobicContact CB-CE3 4.4Å; L604-W655 HydrophobicContact CB-CG 3.88Å; L604-W655 HydrophobicContact CB-CZ2 4.21Å; L604-W655 HydrophobicContact CD1-CD2 3.84Å; L604-W655 HydrophobicContact CD1-CE3 3.6Å; L604-W655 HydrophobicContact CD1-CG 4.47Å; L604-W655 HydrophobicContact CD1-CH2 4.22Å; L604-W655 HydrophobicContact CD1-CZ2 4.43Å; L604-W655 HydrophobicContact CD1-CZ3 3.8Å; L604-W655 HydrophobicContact CG-CD2 4.48Å; L604-F658 HydrophobicContact CD1-CB 4.48Å; L604-F658 HydrophobicContact CD1-CG 4.49Å; L604-F658 HydrophobicContact CD2-CB 3.87Å; L604-F658 HydrophobicContact CD2-CD2 4.4Å; L604-F658 HydrophobicContact CD2-CG 4.24Å; L604-W688 HydrophobicContact CD1-CZ2 3.81Å
605	N	81.6	Confident	83.7	Confident	98 Å²	98	59.2 Å²	59.2	52%	0.524	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-6.7	170	-69.2	-29.7	0	0	0	113.7	D601 W655	D601-N605 WeakPolarHBondContact O-CB 3.27Å; D601-N605 VanDerWaalsContact O-CG 3.28Å; D601-N605 PolarHBondContact O-N 2.92Å; D601-N605 PolarHBondContact O-ND2 3.27Å; D601-N605 PolarHBondContact OD1-ND2 2.94Å; N605-W655 PolarHBondContact OD1-NE1 3.27Å
606	K	79.6	Confident	83.6	Confident	70 Å²	70	56.9 Å²	56.9	30%	0.304	31%	0.309	S	S	.	.	S	Bend	trans	-85	153	173.1	-64.7	170.7	-174.9	149.2	0	110.3	S602 N603 L604	S602-K606 WeakPolarHBondContact O-CE 3.17Å; S602-K606 PolarHBondContact O-NZ 3.34Å; S602-K606 VanDerWaalsContact O-NZ 3.11Å; N603-K606 WeakPolarHBondContact O-CB 3.3Å; N603-K606 PolarHBondContact O-N 3.45Å; N603-K606 PolarHBondContact OD1-NZ 2.96Å; L604-K606 PolarHBondContact O-N 3.49Å
607	P	75	Confident	83.5	Confident	57 Å²	57	59 Å²	59	37%	0.37	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-61.4	143.1	172.2	27.5	-35.2	0	0	0	110.2	S609 Q610	P607-S609 PolarHBondContact O-N 2.91Å; P607-Q610 HydrophobicContact CG-CG 4.36Å; P607-Q610 PolarHBondContact O-N 3.49Å
608	C	67.4	Low	83.5	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.047	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-57.1	-26.6	-170.4	-168.1	0	0	0	0	114.7	Q610 I611 D652 I657	C608-Q610 PolarHBondContact O-N 3.38Å; C608-Q610 VanDerWaalsContact O-N 3.07Å; C608-I611 WeakPolarHBondContact O-CB 3.27Å; C608-I611 PolarHBondContact O-N 2.83Å; C608-D652 PolarHBondContact N-O 3.43Å; C608-I657 HydrophobicContact CB-CD1 3.69Å; C608-I657 WeakPolarHBondContact SG-CD1 3.35Å
609	S	74.6	Confident	83.5	Confident	103 Å²	103	57.8 Å²	57.8	72%	0.72	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-59.4	-17.5	176.8	56.6	0	0	0	0	114.9	P607	P607-S609 PolarHBondContact O-N 2.91Å
610	Q	79.6	Confident	83.6	Confident	126 Å²	126	55.3 Å²	55.3	59%	0.589	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-100.2	-0.4	178	-60.7	-177.9	1.6	0	0	113.5	P607 C608	P607-Q610 HydrophobicContact CG-CG 4.36Å; P607-Q610 PolarHBondContact O-N 3.49Å; C608-Q610 PolarHBondContact O-N 3.38Å; C608-Q610 VanDerWaalsContact O-N 3.07Å
611	I	80.6	Confident	83.6	Confident	21 Å²	21	60.4 Å²	60.4	11%	0.108	34%	0.336	C	S	.	.			trans	-93.9	107.4	-172.3	-57.6	-176.3	0	0	0	109.8	C608 L616 L644 G654	C608-I611 WeakPolarHBondContact O-CB 3.27Å; C608-I611 PolarHBondContact O-N 2.83Å; I611-L616 HydrophobicContact CG2-CD1 3.49Å; I611-L616 VanDerWaalsContact CG2-CD1 3.49Å; I611-L616 HydrophobicContact CG2-CD2 4.15Å; I611-L616 HydrophobicContact CG2-CG 3.93Å; I611-L644 HydrophobicContact CG2-CD2 4.26Å; I611-G654 VanDerWaalsContact CD1-CA 3.4Å
612	L	79.7	Confident	83.9	Confident	118 Å²	118	61.1 Å²	61.1	62%	0.618	34%	0.343	S	S	*	.			trans	-89.9	128	176	-67.8	167.7	0	0	0	110.6	S614 R615 L616	L612-S614 VanDerWaalsContact C-N 3.28Å; L612-S614 PolarHBondContact O-N 3.49Å; L612-R615 HydrophobicContact CB-CB 4.35Å; L612-R615 WeakPolarHBondContact O-CB 3.37Å; L612-R615 PolarHBondContact O-N 2.63Å; L612-L616 PolarHBondContact O-N 3.25Å
613	L	85.3	Confident	84.3	Confident	86 Å²	86	57.8 Å²	57.8	45%	0.45	32%	0.319	S	S	.	.	H	α-helix	trans	-54.1	-43.2	178.6	-179.4	62.1	0	0	0	112.7	R615 L616 S617 V642 L644	L613-R615 VanDerWaalsContact C-N 3.27Å; L613-R615 PolarHBondContact O-N 2.84Å; L613-L616 PolarHBondContact O-N 3.35Å; L613-L616 VanDerWaalsContact O-N 3.08Å; L613-S617 PolarHBondContact O-N 3.32Å; L613-V642 HydrophobicContact CD1-CB 3.87Å; L613-V642 HydrophobicContact CD1-CG1 3.84Å; L613-V642 WeakPolarHBondContact CD1-O 3.45Å; L613-L644 HydrophobicContact CB-CD1 4.02Å; L613-L644 HydrophobicContact CD1-CD1 4.29Å; L613-L644 HydrophobicContact CD1-CG 4.32Å
614	S	85.1	Confident	84.7	Confident	90 Å²	90	57.7 Å²	57.7	63%	0.629	32%	0.319	S	S	*	.	H	α-helix	trans	-59.8	-34.1	178.3	53	0	0	0	0	113.3	L612 G618	L612-S614 VanDerWaalsContact C-N 3.28Å; L612-S614 PolarHBondContact O-N 3.49Å; S614-G618 PolarHBondContact O-N 2.66Å
615	R	87.4	Confident	85.1	Confident	142 Å²	142	66.9 Å²	66.9	54%	0.536	35%	0.353	S	S	.	.	H	α-helix	trans	-70.4	-38.2	175.3	-176.7	176.8	177.7	137	5.6	111.3	N603 L612 L613 I619	N603-R615 VanDerWaalsContact OD1-CZ 3.28Å; N603-R615 PolarHBondContact OD1-NE 2.86Å; N603-R615 PolarHBondContact OD1-NH2 3.34Å; N603-R615 VanDerWaalsContact OD1-NH2 3.16Å; L612-R615 HydrophobicContact CB-CB 4.35Å; L612-R615 WeakPolarHBondContact O-CB 3.37Å; L612-R615 PolarHBondContact O-N 2.63Å; L613-R615 VanDerWaalsContact C-N 3.27Å; L613-R615 PolarHBondContact O-N 2.84Å; R615-I619 HydrophobicContact CG-CD1 4.13Å; R615-I619 WeakPolarHBondContact O-CD1 3.44Å; R615-I619 VanDerWaalsContact O-CG1 3.26Å; R615-I619 WeakPolarHBondContact O-CG1 3.34Å; R615-I619 PolarHBondContact O-N 3.26Å
616	L	88.7	Confident	85.6	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.016	35%	0.352	C	S	.	.	H	α-helix	trans	-70.1	-41.5	177.5	-61.8	176.2	0	0	0	111.9	L600 I611 L612 L613 I619 L620 V642 L644 F658	L600-L616 HydrophobicContact CD2-CD2 3.52Å; I611-L616 HydrophobicContact CG2-CD1 3.49Å; I611-L616 VanDerWaalsContact CG2-CD1 3.49Å; I611-L616 HydrophobicContact CG2-CD2 4.15Å; I611-L616 HydrophobicContact CG2-CG 3.93Å; L612-L616 PolarHBondContact O-N 3.25Å; L613-L616 PolarHBondContact O-N 3.35Å; L613-L616 VanDerWaalsContact O-N 3.08Å; L616-I619 PolarHBondContact O-N 3.22Å; L616-L620 WeakPolarHBondContact O-CB 3.42Å; L616-L620 PolarHBondContact O-N 3.47Å; L616-V642 HydrophobicContact CB-CB 4.42Å; L616-V642 HydrophobicContact CB-CG1 3.92Å; L616-V642 HydrophobicContact CB-CG2 4.19Å; L616-V642 HydrophobicContact CD1-CG1 3.94Å; L616-L644 HydrophobicContact CD1-CD2 3.82Å; L616-L644 HydrophobicContact CD1-CG 4.44Å; L616-F658 HydrophobicContact CD1-CD2 4.06Å
617	S	90	Very high	86.2	Confident	45 Å²	45	64 Å²	64	32%	0.315	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-44.7	172	163.6	0	0	0	0	111.4	L613 I619 L620 E621	L613-S617 PolarHBondContact O-N 3.32Å; S617-I619 VanDerWaalsContact C-N 3.3Å; S617-I619 PolarHBondContact O-N 3Å; S617-L620 WeakPolarHBondContact O-CB 3.47Å; S617-L620 PolarHBondContact O-N 2.98Å; S617-L620 VanDerWaalsContact O-N 3.12Å; S617-E621 WeakPolarHBondContact O-CG 3.37Å; S617-E621 PolarHBondContact O-N 2.95Å
618	G	91.2	Very high	86.9	Confident	36 Å²	36	66 Å²	66	37%	0.371	35%	0.349	S	S	.	.	H	α-helix	trans	-62.2	-33.1	174	0	0	0	0	0	114.4	S614 T622	S614-G618 PolarHBondContact O-N 2.66Å; G618-T622 PolarHBondContact O-N 3.46Å; G618-T622 VanDerWaalsContact O-N 3.17Å; G618-T622 PolarHBondContact O-OG1 3.25Å
619	I	91.9	Very high	87.7	Confident	22 Å²	22	65.9 Å²	65.9	11%	0.113	35%	0.349	C	S	.	.	H	α-helix	trans	-71.3	-39.9	172.6	-69.4	161.4	0	0	0	111	L596 L599 L600 N603 R615 L616 S617 T622 A623	L596-I619 HydrophobicContact CD1-CG2 4.4Å; L599-I619 HydrophobicContact CB-CG2 3.69Å; L599-I619 HydrophobicContact CD1-CG2 4.31Å; L600-I619 HydrophobicContact CD2-CD1 4.39Å; L600-I619 HydrophobicContact CD2-CG2 3.98Å; L600-I619 HydrophobicContact CG-CG2 4.2Å; N603-I619 VanDerWaalsContact ND2-CD1 3.31Å; N603-I619 WeakPolarHBondContact ND2-CD1 3.23Å; R615-I619 HydrophobicContact CG-CD1 4.13Å; R615-I619 WeakPolarHBondContact O-CD1 3.44Å; R615-I619 VanDerWaalsContact O-CG1 3.26Å; R615-I619 WeakPolarHBondContact O-CG1 3.34Å; R615-I619 PolarHBondContact O-N 3.26Å; L616-I619 PolarHBondContact O-N 3.22Å; S617-I619 VanDerWaalsContact C-N 3.3Å; S617-I619 PolarHBondContact O-N 3Å; I619-T622 PolarHBondContact O-N 3.17Å; I619-A623 WeakPolarHBondContact O-CB 3.34Å; I619-A623 PolarHBondContact O-N 3.3Å
620	L	91.4	Very high	88.3	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-50.6	175.8	179.6	66.3	0	0	0	111	F592 L596 L616 S617 T622 A623 I624 L640 V642 L660	F592-L620 HydrophobicContact CE2-CD1 4.2Å; F592-L620 HydrophobicContact CZ-CD1 3.62Å; L596-L620 HydrophobicContact CD1-CD1 4.11Å; L596-L620 HydrophobicContact CD2-CD1 4.19Å; L616-L620 WeakPolarHBondContact O-CB 3.42Å; L616-L620 PolarHBondContact O-N 3.47Å; S617-L620 WeakPolarHBondContact O-CB 3.47Å; S617-L620 PolarHBondContact O-N 2.98Å; S617-L620 VanDerWaalsContact O-N 3.12Å; L620-T622 VanDerWaalsContact C-N 3.3Å; L620-T622 PolarHBondContact O-N 3.33Å; L620-A623 PolarHBondContact O-N 2.92Å; L620-A623 VanDerWaalsContact O-N 3.1Å; L620-I624 HydrophobicContact CD1-CD1 4.36Å; L620-I624 HydrophobicContact CG-CD1 4.03Å; L620-I624 VanDerWaalsContact O-CG1 3.32Å; L620-I624 WeakPolarHBondContact O-CG1 3.33Å; L620-I624 PolarHBondContact O-N 3.34Å; L620-L640 HydrophobicContact CD1-CD2 4.28Å; L620-L640 HydrophobicContact CD2-CG 4.34Å; L620-V642 HydrophobicContact CB-CG2 4.14Å; L620-V642 HydrophobicContact CD2-CG2 3.75Å; L620-V642 HydrophobicContact CG-CG2 4.49Å; L620-L660 HydrophobicContact CD1-CD2 4.07Å; L620-L660 HydrophobicContact CD2-CD2 4.39Å
621	E	90.6	Very high	88.7	Confident	109 Å²	109	67.9 Å²	67.9	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-57.6	-41.3	175.3	-71.6	-68.2	171.5	0	0	112.4	S617 I624 R625	S617-E621 WeakPolarHBondContact O-CG 3.37Å; S617-E621 PolarHBondContact O-N 2.95Å; E621-I624 PolarHBondContact O-N 3.32Å; E621-R625 WeakPolarHBondContact O-CB 3.44Å; E621-R625 PolarHBondContact O-N 2.89Å
622	T	92.5	Very high	88.9	Confident	68 Å²	68	69.1 Å²	69.1	42%	0.417	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-44.9	174.9	-54	0	0	0	0	110.8	L599 G618 I619 L620 I624 R625 D626	L599-T622 HydrophobicContact CD1-CG2 4.39Å; G618-T622 PolarHBondContact O-N 3.46Å; G618-T622 VanDerWaalsContact O-N 3.17Å; G618-T622 PolarHBondContact O-OG1 3.25Å; I619-T622 PolarHBondContact O-N 3.17Å; L620-T622 VanDerWaalsContact C-N 3.3Å; L620-T622 PolarHBondContact O-N 3.33Å; T622-I624 PolarHBondContact O-N 2.94Å; T622-R625 PolarHBondContact O-N 3.08Å; T622-D626 WeakPolarHBondContact O-CB 3.35Å; T622-D626 VanDerWaalsContact O-CG 3.26Å; T622-D626 PolarHBondContact O-N 3.3Å
623	A	92.6	Very high	89.2	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.7	-36.8	178.9	0	0	0	0	0	113	F592 L596 L599 I619 L620 T627	F592-A623 HydrophobicContact CE2-CB 4.16Å; L596-A623 HydrophobicContact CB-CB 4.18Å; L596-A623 HydrophobicContact CD1-CB 3.85Å; L599-A623 HydrophobicContact CD1-CB 4.15Å; I619-A623 WeakPolarHBondContact O-CB 3.34Å; I619-A623 PolarHBondContact O-N 3.3Å; L620-A623 PolarHBondContact O-N 2.92Å; L620-A623 VanDerWaalsContact O-N 3.1Å; A623-T627 WeakPolarHBondContact O-CB 3.41Å; A623-T627 WeakPolarHBondContact O-CG2 3.36Å; A623-T627 PolarHBondContact O-N 3.05Å; A623-T627 PolarHBondContact O-OG1 2.91Å
624	I	90.7	Very high	89.2	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.036	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-45.2	173.8	-68.5	166.4	0	0	0	110	F592 L620 E621 T622 T627 A629 Q630 L637 L640	F592-I624 HydrophobicContact CE2-CG1 3.71Å; F592-I624 HydrophobicContact CZ-CG1 4.32Å; L620-I624 HydrophobicContact CD1-CD1 4.36Å; L620-I624 HydrophobicContact CG-CD1 4.03Å; L620-I624 VanDerWaalsContact O-CG1 3.32Å; L620-I624 WeakPolarHBondContact O-CG1 3.33Å; L620-I624 PolarHBondContact O-N 3.34Å; E621-I624 PolarHBondContact O-N 3.32Å; T622-I624 PolarHBondContact O-N 2.94Å; I624-T627 PolarHBondContact O-N 2.92Å; I624-T627 PolarHBondContact O-OG1 3.11Å; I624-A629 HydrophobicContact CG2-CB 4.33Å; I624-Q630 PolarHBondContact O-N 3.46Å; I624-L637 HydrophobicContact CG2-CD1 3.98Å; I624-L637 HydrophobicContact CG2-CD2 3.88Å; I624-L637 HydrophobicContact CG2-CG 4.47Å; I624-L640 HydrophobicContact CD1-CD2 4.38Å
625	R	91.5	Very high	89.1	Confident	193 Å²	193	66.2 Å²	66.2	73%	0.728	32%	0.324	S	S	*	.	H	α-helix	trans	-67.7	-37.6	-179	-176.3	178.8	179.1	-178.1	-0.2	113.8	E621 T622 T627 Q630	E621-R625 WeakPolarHBondContact O-CB 3.44Å; E621-R625 PolarHBondContact O-N 2.89Å; T622-R625 PolarHBondContact O-N 3.08Å; R625-T627 VanDerWaalsContact C-N 3.26Å; R625-T627 PolarHBondContact O-N 3.13Å; R625-Q630 PolarHBondContact O-NE2 3.14Å
626	D	92.6	Very high	89.1	Confident	94 Å²	94	59.5 Å²	59.5	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-75.1	-15.5	-179.4	-71	-16.6	0	0	0	113.1	H595 T622	H595-D626 IonicContact CD2-OD2 3.38Å; H595-D626 IonicContact CE1-OD2 3.86Å; H595-D626 WeakPolarHBondContact NE2-CB 3.5Å; H595-D626 IonicContact NE2-OD2 2.73Å; H595-D626 PolarHBondContact NE2-OD2 2.85Å; T622-D626 WeakPolarHBondContact O-CB 3.35Å; T622-D626 VanDerWaalsContact O-CG 3.26Å; T622-D626 PolarHBondContact O-N 3.3Å
627	T	91.3	Very high	89	Confident	13 Å²	13	60.7 Å²	60.7	8%	0.08	31%	0.305	C	S	.	.	S	Bend	trans	-113.7	175.8	-171.9	61.8	0	0	0	0	112.3	H595 A623 I624 R625 A629 Q630	H595-T627 HydrophobicContact CB-CG2 3.78Å; A623-T627 WeakPolarHBondContact O-CB 3.41Å; A623-T627 WeakPolarHBondContact O-CG2 3.36Å; A623-T627 PolarHBondContact O-N 3.05Å; A623-T627 PolarHBondContact O-OG1 2.91Å; I624-T627 PolarHBondContact O-N 2.92Å; I624-T627 PolarHBondContact O-OG1 3.11Å; R625-T627 VanDerWaalsContact C-N 3.26Å; R625-T627 PolarHBondContact O-N 3.13Å; T627-A629 PolarHBondContact O-N 3.22Å; T627-Q630 PolarHBondContact O-N 3.04Å; T627-Q630 PolarHBondContact O-NE2 3.08Å
628	N	89.2	Confident	88.8	Confident	99 Å²	99	65.4 Å²	65.4	53%	0.529	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-68.4	-9.7	178.1	-60.5	-61.7	0	0	0	113.3	D591 Q630 Y631	D591-N628 PolarHBondContact OD2-ND2 3.34Å; N628-Q630 PolarHBondContact O-N 2.92Å; N628-Y631 WeakPolarHBondContact O-CD2 3.46Å; N628-Y631 PolarHBondContact O-N 3.13Å
629	A	85.6	Confident	88.6	Confident	4 Å²	4	65.5 Å²	65.5	3%	0.033	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-61.3	-23.1	176.8	0	0	0	0	0	113.2	F584 F592 I624 T627 Y631 E632	F584-A629 HydrophobicContact CE1-CB 4.21Å; F584-A629 HydrophobicContact CZ-CB 4.43Å; F592-A629 HydrophobicContact CD2-CB 4.37Å; I624-A629 HydrophobicContact CG2-CB 4.33Å; T627-A629 PolarHBondContact O-N 3.22Å; A629-Y631 PolarHBondContact O-N 2.93Å; A629-Y631 VanDerWaalsContact O-N 3.08Å; A629-E632 PolarHBondContact O-N 3.14Å; A629-E632 VanDerWaalsContact O-N 3.11Å
630	Q	86.9	Confident	88.5	Confident	93 Å²	93	64.8 Å²	64.8	44%	0.435	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-59.5	-17	176.6	76.4	-171.3	-80.1	0	0	115	I624 R625 T627 N628	I624-Q630 PolarHBondContact O-N 3.46Å; R625-Q630 PolarHBondContact O-NE2 3.14Å; T627-Q630 PolarHBondContact O-N 3.04Å; T627-Q630 PolarHBondContact O-NE2 3.08Å; N628-Q630 PolarHBondContact O-N 2.92Å
631	Y	87.2	Confident	88.3	Confident	178 Å²	178	68 Å²	68	70%	0.698	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-91.7	-5.9	179.2	-57.8	-62.5	0	0	0	113.9	N628 A629	N628-Y631 WeakPolarHBondContact O-CD2 3.46Å; N628-Y631 PolarHBondContact O-N 3.13Å; A629-Y631 PolarHBondContact O-N 2.93Å; A629-Y631 VanDerWaalsContact O-N 3.08Å
632	E	85.1	Confident	88.2	Confident	48 Å²	48	63.4 Å²	63.4	22%	0.224	30%	0.304	C	S	.	.	S	Bend	trans	-74.3	162.3	172.5	-65	-70.7	-175.9	0	0	110.8	R579 Q583 A629	R579-E632 IonicContact NH2-OE1 3.85Å; Q583-E632 PolarHBondContact NE2-OE1 3.4Å; A629-E632 PolarHBondContact O-N 3.14Å; A629-E632 VanDerWaalsContact O-N 3.11Å
633	Q	85.5	Confident	87.8	Confident	63 Å²	63	64.4 Å²	64.4	29%	0.294	30%	0.3	S	S	.	.			trans	-61.8	138.9	-176.1	-62.2	169.3	10.9	0	0	111.5	D576 E635 I636 L637	D576-Q633 PolarHBondContact OD2-NE2 2.81Å; Q633-E635 PolarHBondContact O-N 3.03Å; Q633-E635 VanDerWaalsContact O-N 3.17Å; Q633-I636 HydrophobicContact CB-CD1 3.94Å; Q633-I636 HydrophobicContact CB-CG1 4.17Å; Q633-I636 HydrophobicContact CG-CD1 4.36Å; Q633-I636 WeakPolarHBondContact O-CB 3.42Å; Q633-I636 PolarHBondContact O-N 2.73Å; Q633-L637 PolarHBondContact O-N 3.38Å
634	P	85.1	Confident	87.3	Confident	85 Å²	85	66.9 Å²	66.9	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-63	-27.5	-177.7	25.6	-34.8	0	0	0	113	I636 L637 Q638	P634-I636 PolarHBondContact O-N 2.96Å; P634-L637 PolarHBondContact O-N 2.84Å; P634-Q638 WeakPolarHBondContact O-CB 3.15Å; P634-Q638 VanDerWaalsContact O-CG 3.27Å; P634-Q638 WeakPolarHBondContact O-CG 3.46Å; P634-Q638 PolarHBondContact O-N 2.97Å
635	E	83.4	Confident	86.7	Confident	84 Å²	84	69 Å²	69	39%	0.393	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-25.3	174	-62.5	-173.9	-160.9	0	0	113.6	Q633 R639	Q633-E635 PolarHBondContact O-N 3.03Å; Q633-E635 VanDerWaalsContact O-N 3.17Å; E635-R639 WeakPolarHBondContact O-CD 3.25Å; E635-R639 VanDerWaalsContact O-CG 3.23Å; E635-R639 WeakPolarHBondContact O-CG 3.3Å; E635-R639 PolarHBondContact O-NE 2.89Å; E635-R639 IonicContact OE2-NH2 2.68Å
636	I	87.5	Confident	85.8	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-81.2	-45.2	176	-63.1	169.9	0	0	0	109.6	D576 A580 F584 Q633 P634 R639 L640 Y662	D576-I636 HydrophobicContact CB-CD1 4.08Å; A580-I636 HydrophobicContact CB-CB 4.48Å; A580-I636 HydrophobicContact CB-CD1 4.36Å; A580-I636 HydrophobicContact CB-CG1 4.45Å; A580-I636 HydrophobicContact CB-CG2 3.28Å; F584-I636 HydrophobicContact CD2-CG2 4.47Å; F584-I636 HydrophobicContact CE2-CG2 3.85Å; Q633-I636 HydrophobicContact CB-CD1 3.94Å; Q633-I636 HydrophobicContact CB-CG1 4.17Å; Q633-I636 HydrophobicContact CG-CD1 4.36Å; Q633-I636 WeakPolarHBondContact O-CB 3.42Å; Q633-I636 PolarHBondContact O-N 2.73Å; P634-I636 PolarHBondContact O-N 2.96Å; I636-R639 PolarHBondContact O-N 3.09Å; I636-R639 VanDerWaalsContact O-N 3.14Å; I636-L640 PolarHBondContact O-N 2.64Å; I636-Y662 HydrophobicContact CG2-CE2 4.31Å
637	L	86.6	Confident	84.6	Confident	29 Å²	29	67.5 Å²	67.5	15%	0.152	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-42.7	-178.5	-60.6	178.3	0	0	0	111.5	F584 I624 Q633 P634 R639 L640	F584-L637 HydrophobicContact CZ-CD2 4.21Å; I624-L637 HydrophobicContact CG2-CD1 3.98Å; I624-L637 HydrophobicContact CG2-CD2 3.88Å; I624-L637 HydrophobicContact CG2-CG 4.47Å; Q633-L637 PolarHBondContact O-N 3.38Å; P634-L637 PolarHBondContact O-N 2.84Å; L637-R639 PolarHBondContact O-N 3.35Å; L637-R639 VanDerWaalsContact O-N 3.13Å; L637-L640 PolarHBondContact O-N 3.39Å; L637-L640 VanDerWaalsContact O-N 3.11Å
638	Q	86.4	Confident	83.2	Confident	144 Å²	144	71.8 Å²	71.8	67%	0.673	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.2	174.3	-73.7	174.7	10.8	0	0	113.6	P634 H663	P634-Q638 WeakPolarHBondContact O-CB 3.15Å; P634-Q638 VanDerWaalsContact O-CG 3.27Å; P634-Q638 WeakPolarHBondContact O-CG 3.46Å; P634-Q638 PolarHBondContact O-N 2.97Å; Q638-H663 PolarHBondContact O-CE1 3.41Å; Q638-H663 PolarHBondContact O-NE2 3.37Å
639	R	87.1	Confident	81.8	Confident	37 Å²	37	71 Å²	71	14%	0.14	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-6.2	179.1	-73	-178.8	-158.1	167.1	19.1	114.3	H577 E635 I636 L637 Y662 H663	H577-R639 PolarHBondContact CD2-NH1 3.2Å; H577-R639 PolarHBondContact CE1-NH1 3.21Å; H577-R639 PolarHBondContact NE2-NH1 2.86Å; E635-R639 WeakPolarHBondContact O-CD 3.25Å; E635-R639 VanDerWaalsContact O-CG 3.23Å; E635-R639 WeakPolarHBondContact O-CG 3.3Å; E635-R639 PolarHBondContact O-NE 2.89Å; E635-R639 IonicContact OE2-NH2 2.68Å; I636-R639 PolarHBondContact O-N 3.09Å; I636-R639 VanDerWaalsContact O-N 3.14Å; L637-R639 PolarHBondContact O-N 3.35Å; L637-R639 VanDerWaalsContact O-N 3.13Å; R639-Y662 HydrophobicContact CB-CD2 4.13Å; R639-Y662 HydrophobicContact CB-CE2 3.65Å; R639-Y662 CarbonylContact O-C 3.58Å; R639-Y662 WeakPolarHBondContact O-CA 3.3Å; R639-H663 WeakPolarHBondContact CB-O 3.36Å; R639-H663 WeakPolarHBondContact CD-O 3.33Å; R639-H663 WeakPolarHBondContact CG-O 3.49Å; R639-H663 PolarHBondContact O-N 2.95Å; R639-H663 PolarHBondContact O-ND1 2.97Å
640	L	88.9	Confident	80.6	Confident	7 Å²	7	74.3 Å²	74.3	4%	0.037	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	104.7	179.3	-175.9	67.2	0	0	0	110.3	F584 F592 L620 I624 I636 L637 L660	F584-L640 HydrophobicContact CB-CD1 3.86Å; F584-L640 HydrophobicContact CB-CD2 4.2Å; F584-L640 HydrophobicContact CD1-CD2 3.86Å; F584-L640 HydrophobicContact CD2-CD2 4.37Å; F584-L640 HydrophobicContact CE1-CD2 4.32Å; F584-L640 HydrophobicContact CG-CD1 4.33Å; F584-L640 HydrophobicContact CG-CD2 3.89Å; F592-L640 HydrophobicContact CE1-CD2 4.45Å; F592-L640 HydrophobicContact CZ-CD2 4.17Å; L620-L640 HydrophobicContact CD1-CD2 4.28Å; L620-L640 HydrophobicContact CD2-CG 4.34Å; I624-L640 HydrophobicContact CD1-CD2 4.38Å; I636-L640 PolarHBondContact O-N 2.64Å; L637-L640 PolarHBondContact O-N 3.39Å; L637-L640 VanDerWaalsContact O-N 3.11Å; L640-L660 HydrophobicContact CD1-CB 4.43Å
641	D	88.5	Confident	79.4	Confident	73 Å²	73	78.5 Å²	78.5	39%	0.39	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	159.1	179.6	-86.1	-46.6	0	0	0	112.6	D661 H663	D641-D661 PolarHBondContact N-O 3Å; D641-D661 PolarHBondContact O-N 2.94Å; D641-H663 IonicContact OD2-CE1 3.74Å; D641-H663 PolarHBondContact OD2-CE1 3.22Å; D641-H663 IonicContact OD2-CG 2.83Å; D641-H663 IonicContact OD2-ND1 2.6Å; D641-H663 PolarHBondContact OD2-ND1 3.13Å
642	V	88.4	Confident	78.4	Confident	12 Å²	12	72 Å²	72	7%	0.073	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	137.5	162.9	-178.2	0	0	0	0	109.2	L613 L616 L620 F658 L660	L613-V642 HydrophobicContact CD1-CB 3.87Å; L613-V642 HydrophobicContact CD1-CG1 3.84Å; L613-V642 WeakPolarHBondContact CD1-O 3.45Å; L616-V642 HydrophobicContact CB-CB 4.42Å; L616-V642 HydrophobicContact CB-CG1 3.92Å; L616-V642 HydrophobicContact CB-CG2 4.19Å; L616-V642 HydrophobicContact CD1-CG1 3.94Å; L620-V642 HydrophobicContact CB-CG2 4.14Å; L620-V642 HydrophobicContact CD2-CG2 3.75Å; L620-V642 HydrophobicContact CG-CG2 4.49Å; V642-F658 HydrophobicContact CG1-CD2 3.88Å; V642-F658 HydrophobicContact CG1-CE2 3.6Å; V642-F658 HydrophobicContact CG2-CE2 4.16Å; V642-L660 HydrophobicContact CG2-CD2 4.37Å
643	R	84.4	Confident	78	Confident	88 Å²	88	72.2 Å²	72.2	33%	0.332	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132	169.9	-179.5	167.7	179.9	179.8	0.3	111.1	S659 D661	R643-S659 PolarHBondContact N-O 3.12Å; R643-S659 PolarHBondContact O-N 3.24Å; R643-S659 PolarHBondContact O-OG 3.42Å; R643-D661 HydrophobicContact CB-CB 3.87Å; R643-D661 WeakPolarHBondContact CD-OD2 3.43Å; R643-D661 IonicContact CZ-OD2 3.6Å; R643-D661 IonicContact NE-OD2 2.69Å; R643-D661 IonicContact NH1-OD2 3.93Å; R643-D661 PolarHBondContact NH1-OD2 3.49Å
644	L	82.2	Confident	77.7	Confident	53 Å²	53	69.2 Å²	69.2	28%	0.277	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	133	168.9	-66	166.2	0	0	0	108.7	I611 L613 L616 I657	I611-L644 HydrophobicContact CG2-CD2 4.26Å; L613-L644 HydrophobicContact CB-CD1 4.02Å; L613-L644 HydrophobicContact CD1-CD1 4.29Å; L613-L644 HydrophobicContact CD1-CG 4.32Å; L616-L644 HydrophobicContact CD1-CD2 3.82Å; L616-L644 HydrophobicContact CD1-CG 4.44Å; L644-I657 HydrophobicContact CB-CG2 4.21Å; L644-I657 HydrophobicContact CD2-CG2 3.98Å
645	L	78.2	Confident	77.7	Confident	52 Å²	52	65.4 Å²	65.4	27%	0.272	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-75.8	158.8	170.9	-60.9	175.5	0	0	0	111.3	I647 I657 L681	L645-I647 PolarHBondContact O-N 2.98Å; L645-I657 HydrophobicContact CB-CG2 4.31Å; L645-I657 PolarHBondContact N-O 3.29Å; L645-I657 WeakPolarHBondContact O-CG2 3.45Å; L645-L681 HydrophobicContact CD2-CD2 4.25Å
646	D	70.6	Confident	77.6	Confident	154 Å²	154	63.9 Å²	63.9	82%	0.824	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-64.1	117.9	-179.8	-71.6	-33.9	0	0	0	111.2	S648	D646-S648 PolarHBondContact O-N 2.83Å; D646-S648 PolarHBondContact O-OG 2.98Å
647	I	68.6	Low	77.4	Confident	100 Å²	100	64.2 Å²	64.2	51%	0.513	35%	0.352	S	S	.	.			trans	-65.6	106.1	-175.7	-48.9	174.3	0	0	0	109.2	L645 I657	L645-I647 PolarHBondContact O-N 2.98Å; I647-I657 HydrophobicContact CG1-CD1 4.35Å; I647-I657 HydrophobicContact CG2-CD1 4.25Å
648	S	61.1	Low	77.4	Confident	104 Å²	104	62.9 Å²	62.9	73%	0.727	35%	0.345	S	S	*	.			trans	-92	-32.2	-175	-65.2	0	0	0	0	112.5	D646	D646-S648 PolarHBondContact O-N 2.83Å; D646-S648 PolarHBondContact O-OG 2.98Å
649	T	61	Low	77.6	Confident	83 Å²	83	56 Å²	56	51%	0.509	31%	0.313	S	S	.	.			trans	-137	133.5	177.8	17.9	0	0	0	0	111.8	Q651 D652	T649-Q651 PolarHBondContact O-N 3.33Å; T649-D652 WeakPolarHBondContact CB-OD1 3.3Å; T649-D652 PolarHBondContact N-OD2 3.4Å; T649-D652 WeakPolarHBondContact O-CB 3.48Å; T649-D652 PolarHBondContact O-N 3.26Å; T649-D652 VanDerWaalsContact O-OD2 3.06Å; T649-D652 VanDerWaalsContact OG1-CG 3.24Å; T649-D652 PolarHBondContact OG1-OD1 2.97Å; T649-D652 PolarHBondContact OG1-OD2 3.44Å
650	G	59.1	Low	77.7	Confident	72 Å²	72	54.3 Å²	54.3	74%	0.742	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	0.1	-177.6	0	0	0	0	0	115.7
651	Q	62.3	Low	77.8	Confident	181 Å²	181	54.4 Å²	54.4	85%	0.846	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-5.6	175.4	-64.8	178.7	-6.9	0	0	112.6	T649 T653	T649-Q651 PolarHBondContact O-N 3.33Å; Q651-T653 PolarHBondContact O-N 2.78Å
652	D	67	Low	77.8	Confident	42 Å²	42	51.4 Å²	51.4	23%	0.225	29%	0.291	C	S	.	.			trans	-65.6	127.7	-174.2	-60.3	-16.1	0	0	0	111.1	C608 T649 I657	C608-D652 PolarHBondContact N-O 3.43Å; T649-D652 WeakPolarHBondContact CB-OD1 3.3Å; T649-D652 PolarHBondContact N-OD2 3.4Å; T649-D652 WeakPolarHBondContact O-CB 3.48Å; T649-D652 PolarHBondContact O-N 3.26Å; T649-D652 VanDerWaalsContact O-OD2 3.06Å; T649-D652 VanDerWaalsContact OG1-CG 3.24Å; T649-D652 PolarHBondContact OG1-OD1 2.97Å; T649-D652 PolarHBondContact OG1-OD2 3.44Å; D652-I657 HydrophobicContact CB-CD1 3.55Å; D652-I657 HydrophobicContact CB-CG1 4.41Å
653	T	76.2	Confident	77.8	Confident	52 Å²	52	53.1 Å²	53.1	32%	0.319	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-72.7	144	175.4	70.2	0	0	0	0	110.3	Q651 W655 D656 R692	Q651-T653 PolarHBondContact O-N 2.78Å; T653-W655 PolarHBondContact O-N 2.82Å; T653-D656 PolarHBondContact O-N 2.87Å; T653-D656 PolarHBondContact OG1-OD2 3.08Å; T653-R692 PolarHBondContact OG1-NH2 3.45Å
654	G	80	Confident	77.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-54.4	-29.9	-177.2	0	0	0	0	0	114.1	L604 I611 D656 I657 F658	L604-G654 PolarHBondContact O-N 3.39Å; L604-G654 VanDerWaalsContact O-N 3.09Å; I611-G654 VanDerWaalsContact CD1-CA 3.4Å; G654-D656 PolarHBondContact O-N 2.85Å; G654-I657 PolarHBondContact O-N 3Å; G654-F658 WeakPolarHBondContact O-CB 3.48Å; G654-F658 PolarHBondContact O-N 2.89Å
655	W	83.5	Confident	77.6	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.015	30%	0.303	C	S	.	.	H	α-helix	trans	-53.4	-30.9	174.4	-70.7	103.5	0	0	0	115.9	D601 L604 N605 T653 W688 R692 F695	D601-W655 HydrophobicContact CB-CZ2 4.4Å; L604-W655 HydrophobicContact CB-CD2 3.77Å; L604-W655 HydrophobicContact CB-CE3 4.4Å; L604-W655 HydrophobicContact CB-CG 3.88Å; L604-W655 HydrophobicContact CB-CZ2 4.21Å; L604-W655 HydrophobicContact CD1-CD2 3.84Å; L604-W655 HydrophobicContact CD1-CE3 3.6Å; L604-W655 HydrophobicContact CD1-CG 4.47Å; L604-W655 HydrophobicContact CD1-CH2 4.22Å; L604-W655 HydrophobicContact CD1-CZ2 4.43Å; L604-W655 HydrophobicContact CD1-CZ3 3.8Å; L604-W655 HydrophobicContact CG-CD2 4.48Å; N605-W655 PolarHBondContact OD1-NE1 3.27Å; T653-W655 PolarHBondContact O-N 2.82Å; W655-W688 AromaticContact CE3-CZ2 3.93Å; W655-W688 HydrophobicContact CE3-CZ2 3.93Å; W655-W688 AromaticContact CE3-NE1 3.99Å; W655-W688 HydrophobicContact CZ3-CH2 4.4Å; W655-W688 AromaticContact CZ3-CZ2 3.74Å; W655-W688 HydrophobicContact CZ3-CZ2 3.74Å; W655-W688 PolarHBondContact O-NE1 3.21Å; W655-R692 VanDerWaalsContact CD1-NH2 3.27Å; W655-R692 HydrophobicContact CD2-CG 3.99Å; W655-R692 HydrophobicContact CE3-CB 4.13Å; W655-R692 HydrophobicContact CE3-CG 3.73Å; W655-R692 VanDerWaalsContact CG-NE 3.31Å; W655-R692 HydrophobicContact CZ3-CB 4.27Å; W655-R692 HydrophobicContact CZ3-CG 4.05Å; W655-F695 HydrophobicContact CH2-CD1 4.28Å; W655-F695 HydrophobicContact CH2-CE1 4.45Å
656	D	81.2	Confident	77.7	Confident	53 Å²	53	52.1 Å²	52.1	28%	0.283	31%	0.31	S	S	.	.	H	α-helix	trans	-91.5	-14.1	-176.3	-75.7	-76	0	0	0	113.3	T653 G654 R689 R692	T653-D656 PolarHBondContact O-N 2.87Å; T653-D656 PolarHBondContact OG1-OD2 3.08Å; G654-D656 PolarHBondContact O-N 2.85Å; D656-R689 PolarHBondContact O-NH2 2.75Å; D656-R689 VanDerWaalsContact O-NH2 3.12Å; D656-R689 IonicContact OD1-CZ 2.71Å; D656-R689 IonicContact OD1-NE 3.71Å; D656-R689 PolarHBondContact OD1-NE 2.84Å; D656-R689 IonicContact OD1-NH2 3.13Å; D656-R689 PolarHBondContact OD1-NH2 2.87Å; D656-R692 IonicContact OD2-NH1 3.07Å; D656-R692 PolarHBondContact OD2-NH1 2.9Å; D656-R692 VanDerWaalsContact OD2-NH1 3.13Å
657	I	84	Confident	78.3	Confident	7 Å²	7	45 Å²	45	4%	0.036	27%	0.272	C	S	.	.	H	α-helix	trans	-108.5	-24.4	-175.3	-69.1	170.6	0	0	0	111.9	C608 L644 L645 I647 D652 G654 S659	C608-I657 HydrophobicContact CB-CD1 3.69Å; C608-I657 WeakPolarHBondContact SG-CD1 3.35Å; L644-I657 HydrophobicContact CB-CG2 4.21Å; L644-I657 HydrophobicContact CD2-CG2 3.98Å; L645-I657 HydrophobicContact CB-CG2 4.31Å; L645-I657 PolarHBondContact N-O 3.29Å; L645-I657 WeakPolarHBondContact O-CG2 3.45Å; I647-I657 HydrophobicContact CG1-CD1 4.35Å; I647-I657 HydrophobicContact CG2-CD1 4.25Å; D652-I657 HydrophobicContact CB-CD1 3.55Å; D652-I657 HydrophobicContact CB-CG1 4.41Å; G654-I657 PolarHBondContact O-N 3Å; I657-S659 PolarHBondContact O-N 3.28Å
658	F	87.4	Confident	79	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.009	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	125.4	173.3	178	-97.3	0	0	0	111.7	L596 L600 L604 L616 V642 G654 L660 F684 W688	L596-F658 HydrophobicContact CD2-CZ 4.5Å; L600-F658 HydrophobicContact CD1-CD1 4.42Å; L600-F658 HydrophobicContact CD1-CD2 4.47Å; L600-F658 HydrophobicContact CD1-CE1 3.81Å; L600-F658 HydrophobicContact CD1-CE2 3.87Å; L600-F658 HydrophobicContact CD1-CZ 3.49Å; L600-F658 VanDerWaalsContact CD1-CZ 3.49Å; L600-F658 HydrophobicContact CD2-CE2 4.44Å; L604-F658 HydrophobicContact CD1-CB 4.48Å; L604-F658 HydrophobicContact CD1-CG 4.49Å; L604-F658 HydrophobicContact CD2-CB 3.87Å; L604-F658 HydrophobicContact CD2-CD2 4.4Å; L604-F658 HydrophobicContact CD2-CG 4.24Å; L616-F658 HydrophobicContact CD1-CD2 4.06Å; V642-F658 HydrophobicContact CG1-CD2 3.88Å; V642-F658 HydrophobicContact CG1-CE2 3.6Å; V642-F658 HydrophobicContact CG2-CE2 4.16Å; G654-F658 WeakPolarHBondContact O-CB 3.48Å; G654-F658 PolarHBondContact O-N 2.89Å; F658-L660 HydrophobicContact CE1-CD2 4.33Å; F658-L660 HydrophobicContact CE1-CG 4.27Å; F658-L660 HydrophobicContact CZ-CD2 3.73Å; F658-L660 HydrophobicContact CZ-CG 4.16Å; F658-F684 HydrophobicContact CE1-CZ 4.37Å; F658-W688 HydrophobicContact CD1-CD2 4.39Å; F658-W688 AromaticContact CD1-CE2 3.65Å; F658-W688 HydrophobicContact CD1-CH2 4.12Å; F658-W688 AromaticContact CD1-CZ2 3.51Å; F658-W688 HydrophobicContact CD1-CZ2 3.51Å; F658-W688 AromaticContact CD1-NE1 3.87Å; F658-W688 AromaticContact CE1-CH2 3.84Å; F658-W688 HydrophobicContact CE1-CH2 3.84Å; F658-W688 AromaticContact CE1-CZ2 3.73Å; F658-W688 HydrophobicContact CE1-CZ2 3.73Å; F658-W688 HydrophobicContact CE1-CZ3 4.35Å
659	S	90.1	Very high	80.1	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.7	167.9	53.6	0	0	0	0	110.9	R643 I657	R643-S659 PolarHBondContact N-O 3.12Å; R643-S659 PolarHBondContact O-N 3.24Å; R643-S659 PolarHBondContact O-OG 3.42Å; I657-S659 PolarHBondContact O-N 3.28Å
660	L	89.8	Confident	81.2	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	141.3	160.9	-64.7	179.8	0	0	0	108.3	L585 F592 I593 L596 L620 L640 V642 F658 F684	L585-L660 VanDerWaalsContact CD1-O 3.3Å; L585-L660 WeakPolarHBondContact CD1-O 3.36Å; F592-L660 HydrophobicContact CE1-CD1 4.4Å; I593-L660 HydrophobicContact CD1-CD1 4.22Å; L596-L660 HydrophobicContact CD2-CD1 4.12Å; L596-L660 HydrophobicContact CD2-CD2 4.49Å; L620-L660 HydrophobicContact CD1-CD2 4.07Å; L620-L660 HydrophobicContact CD2-CD2 4.39Å; L640-L660 HydrophobicContact CD1-CB 4.43Å; V642-L660 HydrophobicContact CG2-CD2 4.37Å; F658-L660 HydrophobicContact CE1-CD2 4.33Å; F658-L660 HydrophobicContact CE1-CG 4.27Å; F658-L660 HydrophobicContact CZ-CD2 3.73Å; F658-L660 HydrophobicContact CZ-CG 4.16Å; L660-F684 HydrophobicContact CB-CD2 4.43Å; L660-F684 HydrophobicContact CB-CE2 3.87Å; L660-F684 HydrophobicContact CB-CZ 4.04Å; L660-F684 HydrophobicContact CD1-CE2 3.98Å; L660-F684 HydrophobicContact CD1-CZ 4.29Å; L660-F684 HydrophobicContact CG-CE2 3.97Å; L660-F684 HydrophobicContact CG-CZ 3.92Å
661	D	89.6	Confident	82.5	Confident	9 Å²	9	29.8 Å²	29.8	5%	0.048	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143.4	175.2	-153.8	-22.3	0	0	0	108.2	D641 R643 R677	D641-D661 PolarHBondContact N-O 3Å; D641-D661 PolarHBondContact O-N 2.94Å; R643-D661 HydrophobicContact CB-CB 3.87Å; R643-D661 WeakPolarHBondContact CD-OD2 3.43Å; R643-D661 IonicContact CZ-OD2 3.6Å; R643-D661 IonicContact NE-OD2 2.69Å; R643-D661 IonicContact NH1-OD2 3.93Å; R643-D661 PolarHBondContact NH1-OD2 3.49Å; D661-R677 VanDerWaalsContact CG-NH2 3.25Å; D661-R677 IonicContact OD1-CZ 3.06Å; D661-R677 IonicContact OD1-NE 2.8Å; D661-R677 PolarHBondContact OD1-NE 3.47Å; D661-R677 IonicContact OD1-NH2 2.65Å; D661-R677 PolarHBondContact OD1-NH2 3.32Å; D661-R677 IonicContact OD2-CZ 2.79Å; D661-R677 IonicContact OD2-NE 3.26Å; D661-R677 PolarHBondContact OD2-NE 3.47Å; D661-R677 IonicContact OD2-NH2 3.52Å; D661-R677 PolarHBondContact OD2-NH2 2.83Å
662	Y	90.1	Very high	83.5	Confident	11 Å²	11	22.2 Å²	22.2	4%	0.043	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	102.3	179.7	-174.2	-111.2	0	0	0	107.1	H577 A580 I636 R639 V664	H577-Y662 HydrophobicContact CB-CE1 4.37Å; H577-Y662 PolarHBondContact ND1-OH 3.25Å; A580-Y662 HydrophobicContact CB-CE2 4.45Å; I636-Y662 HydrophobicContact CG2-CE2 4.31Å; R639-Y662 HydrophobicContact CB-CD2 4.13Å; R639-Y662 HydrophobicContact CB-CE2 3.65Å; R639-Y662 CarbonylContact O-C 3.58Å; R639-Y662 WeakPolarHBondContact O-CA 3.3Å; Y662-V664 HydrophobicContact CD1-CG2 3.45Å; Y662-V664 VanDerWaalsContact CD1-CG2 3.45Å; Y662-V664 HydrophobicContact CE1-CG2 3.55Å; Y662-V664 HydrophobicContact CG-CG2 4.49Å
663	H	87.9	Confident	84.4	Confident	48 Å²	48	21.2 Å²	21.2	22%	0.222	13%	0.126	C	C	.	.			trans	-78.3	127.6	-177.4	71.9	-116.5	0	0	0	109.7	Q638 R639 D641 D665	Q638-H663 PolarHBondContact O-CE1 3.41Å; Q638-H663 PolarHBondContact O-NE2 3.37Å; R639-H663 WeakPolarHBondContact CB-O 3.36Å; R639-H663 WeakPolarHBondContact CD-O 3.33Å; R639-H663 WeakPolarHBondContact CG-O 3.49Å; R639-H663 PolarHBondContact O-N 2.95Å; R639-H663 PolarHBondContact O-ND1 2.97Å; D641-H663 IonicContact OD2-CE1 3.74Å; D641-H663 PolarHBondContact OD2-CE1 3.22Å; D641-H663 IonicContact OD2-CG 2.83Å; D641-H663 IonicContact OD2-ND1 2.6Å; D641-H663 PolarHBondContact OD2-ND1 3.13Å; H663-D665 IonicContact CD2-OD2 2.68Å
664	V	83.1	Confident	84.7	Confident	20 Å²	20	22.8 Å²	22.8	12%	0.121	13%	0.132	C	C	.	.			trans	-122.7	94.7	-175	-177.7	0	0	0	0	108.8	Y662 L668 S669 F672	Y662-V664 HydrophobicContact CD1-CG2 3.45Å; Y662-V664 VanDerWaalsContact CD1-CG2 3.45Å; Y662-V664 HydrophobicContact CE1-CG2 3.55Å; Y662-V664 HydrophobicContact CG-CG2 4.49Å; V664-L668 HydrophobicContact CG1-CB 3.25Å; V664-L668 HydrophobicContact CG1-CD1 4.38Å; V664-L668 HydrophobicContact CG1-CG 4.47Å; V664-S669 WeakPolarHBondContact O-CB 3.25Å; V664-F672 HydrophobicContact CB-CB 4.22Å; V664-F672 HydrophobicContact CB-CD2 4.46Å; V664-F672 HydrophobicContact CB-CG 4.43Å; V664-F672 HydrophobicContact CG1-CB 4.16Å; V664-F672 HydrophobicContact CG1-CD2 3.75Å; V664-F672 HydrophobicContact CG1-CE2 4.44Å; V664-F672 HydrophobicContact CG1-CG 4.17Å; V664-F672 HydrophobicContact CG2-CB 4.33Å; V664-F672 HydrophobicContact CG2-CD2 4.26Å; V664-F672 HydrophobicContact CG2-CG 4.14Å
665	D	79.7	Confident	85.1	Confident	110 Å²	110	27.5 Å²	27.5	59%	0.588	16%	0.157	S	C	*	.			trans	-92.3	163.4	179.5	-65.6	-29	0	0	0	112.2	H663	H663-D665 IonicContact CD2-OD2 2.68Å
666	G	80.1	Confident	85.3	Confident	41 Å²	41	27.4 Å²	27.4	42%	0.423	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	73.2	-150.7	177.7	0	0	0	0	0	113.8	L668 S669	G666-L668 PolarHBondContact O-N 2.93Å; G666-L668 VanDerWaalsContact O-N 3.13Å; G666-S669 WeakPolarHBondContact O-CB 3.23Å; G666-S669 PolarHBondContact O-N 3.29Å; G666-S669 VanDerWaalsContact O-N 3.13Å; G666-S669 PolarHBondContact O-OG 3.2Å
667	P	82	Confident	85.6	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.032	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-64.1	-19.9	-172.3	23.5	-32.1	0	0	0	114.3	F512 V516 L568 Y572 S669 T670	F512-P667 HydrophobicContact CE1-CB 4.04Å; F512-P667 HydrophobicContact CE2-CB 4.23Å; F512-P667 HydrophobicContact CZ-CB 3.47Å; F512-P667 VanDerWaalsContact CZ-CB 3.47Å; F512-P667 WeakPolarHBondContact CZ-O 3.17Å; V516-P667 HydrophobicContact CB-CB 4.49Å; V516-P667 HydrophobicContact CG1-CB 3.79Å; L568-P667 HydrophobicContact CD2-CB 4.39Å; Y572-P667 HydrophobicContact CD1-CG 3.59Å; Y572-P667 HydrophobicContact CD2-CG 3.83Å; Y572-P667 HydrophobicContact CE1-CG 3.44Å; Y572-P667 VanDerWaalsContact CE1-CG 3.44Å; Y572-P667 HydrophobicContact CE2-CG 3.7Å; Y572-P667 HydrophobicContact CG-CG 3.78Å; P667-S669 VanDerWaalsContact C-N 3.25Å; P667-S669 PolarHBondContact O-N 3.13Å; P667-T670 PolarHBondContact O-N 2.93Å; P667-T670 PolarHBondContact O-OG1 3.3Å
668	L	84	Confident	85.7	Confident	2 Å²	2	34 Å²	34	1%	0.01	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-70.6	-24.6	178.7	-59.4	174.5	0	0	0	112.1	L568 F574 H577 V664 G666 T670 I671 F672	L568-L668 HydrophobicContact CD2-CD2 4.35Å; F574-L668 HydrophobicContact CB-CD2 4.09Å; F574-L668 HydrophobicContact CD2-CD2 3.92Å; F574-L668 HydrophobicContact CG-CD2 4.43Å; H577-L668 WeakPolarHBondContact CD2-CD1 3.43Å; V664-L668 HydrophobicContact CG1-CB 3.25Å; V664-L668 HydrophobicContact CG1-CD1 4.38Å; V664-L668 HydrophobicContact CG1-CG 4.47Å; G666-L668 PolarHBondContact O-N 2.93Å; G666-L668 VanDerWaalsContact O-N 3.13Å; L668-T670 PolarHBondContact O-N 3.4Å; L668-I671 PolarHBondContact O-N 3.09Å; L668-F672 HydrophobicContact CB-CD2 4.41Å; L668-F672 WeakPolarHBondContact O-CD2 3.48Å; L668-F672 PolarHBondContact O-N 3.34Å
669	S	84.3	Confident	85.8	Confident	35 Å²	35	35.5 Å²	35.5	25%	0.245	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-59	-26.3	176.3	65.9	0	0	0	0	113.7	V664 G666 P667 I671 F672	V664-S669 WeakPolarHBondContact O-CB 3.25Å; G666-S669 WeakPolarHBondContact O-CB 3.23Å; G666-S669 PolarHBondContact O-N 3.29Å; G666-S669 VanDerWaalsContact O-N 3.13Å; G666-S669 PolarHBondContact O-OG 3.2Å; P667-S669 VanDerWaalsContact C-N 3.25Å; P667-S669 PolarHBondContact O-N 3.13Å; S669-I671 VanDerWaalsContact C-N 3.29Å; S669-I671 PolarHBondContact O-N 3.37Å; S669-F672 CarbonylContact O-C 3.6Å
670	T	83.9	Confident	85.9	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.012	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-75.4	-18.8	176.3	62.3	0	0	0	0	113.4	Y481 F512 P667 L668	Y481-T670 PolarHBondContact OH-O 3.14Å; F512-T670 HydrophobicContact CD2-CG2 4.43Å; F512-T670 HydrophobicContact CE2-CG2 3.7Å; F512-T670 VanDerWaalsContact CE2-OG1 3.23Å; F512-T670 WeakPolarHBondContact CE2-OG1 3.41Å; F512-T670 WeakPolarHBondContact CZ-OG1 3.27Å; P667-T670 PolarHBondContact O-N 2.93Å; P667-T670 PolarHBondContact O-OG1 3.3Å; L668-T670 PolarHBondContact O-N 3.4Å
671	I	85.5	Confident	85.9	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-49.7	172.4	-51.8	175.2	0	0	0	108.9	F574 L668 S669 T673 L765 I769	F574-I671 HydrophobicContact CD2-CD1 3.87Å; F574-I671 HydrophobicContact CE1-CD1 4.47Å; F574-I671 HydrophobicContact CE2-CB 4.38Å; F574-I671 HydrophobicContact CE2-CD1 3.55Å; F574-I671 HydrophobicContact CE2-CG2 3.9Å; F574-I671 HydrophobicContact CG-CD1 4.45Å; F574-I671 HydrophobicContact CZ-CD1 3.86Å; F574-I671 HydrophobicContact CZ-CG2 4.02Å; L668-I671 PolarHBondContact O-N 3.09Å; S669-I671 VanDerWaalsContact C-N 3.29Å; S669-I671 PolarHBondContact O-N 3.37Å; I671-T673 PolarHBondContact O-N 3.25Å; I671-L765 HydrophobicContact CD1-CD1 3.71Å; I671-L765 HydrophobicContact CG1-CD1 3.87Å; I671-I769 HydrophobicContact CG1-CG1 4.49Å; I671-I769 HydrophobicContact CG2-CG1 4.29Å
672	F	84.9	Confident	85.8	Confident	22 Å²	22	41.7 Å²	41.7	10%	0.096	22%	0.216	C	C	.	.	S	Bend	trans	-80.5	66.4	176.3	-68.2	-87.9	0	0	0	111.2	F574 L578 T581 V664 L668 S669 Y680	F574-F672 HydrophobicContact CD2-CE2 4.34Å; F574-F672 HydrophobicContact CE2-CE2 4Å; L578-F672 HydrophobicContact CD2-CE1 4.2Å; L578-F672 HydrophobicContact CD2-CZ 3.73Å; L578-F672 HydrophobicContact CG-CZ 4.23Å; T581-F672 HydrophobicContact CG2-CE1 4.41Å; V664-F672 HydrophobicContact CB-CB 4.22Å; V664-F672 HydrophobicContact CB-CD2 4.46Å; V664-F672 HydrophobicContact CB-CG 4.43Å; V664-F672 HydrophobicContact CG1-CB 4.16Å; V664-F672 HydrophobicContact CG1-CD2 3.75Å; V664-F672 HydrophobicContact CG1-CE2 4.44Å; V664-F672 HydrophobicContact CG1-CG 4.17Å; V664-F672 HydrophobicContact CG2-CB 4.33Å; V664-F672 HydrophobicContact CG2-CD2 4.26Å; V664-F672 HydrophobicContact CG2-CG 4.14Å; L668-F672 HydrophobicContact CB-CD2 4.41Å; L668-F672 WeakPolarHBondContact O-CD2 3.48Å; L668-F672 PolarHBondContact O-N 3.34Å; S669-F672 CarbonylContact O-C 3.6Å; F672-Y680 HydrophobicContact CD1-CE2 4.19Å; F672-Y680 HydrophobicContact CE1-CE2 4.2Å
673	T	84.1	Confident	85.8	Confident	21 Å²	21	41.2 Å²	41.2	13%	0.129	21%	0.214	C	C	.	.			trans	-55.2	156.2	179	71.5	0	0	0	0	112.5	Y481 I671 N675 C676 R677	Y481-T673 HydrophobicContact CE2-CG2 3.79Å; Y481-T673 WeakPolarHBondContact OH-CG2 3.36Å; I671-T673 PolarHBondContact O-N 3.25Å; T673-N675 PolarHBondContact O-N 3.44Å; T673-N675 VanDerWaalsContact O-N 3.1Å; T673-C676 WeakPolarHBondContact O-CA 3.41Å; T673-C676 WeakPolarHBondContact O-CB 3.43Å; T673-C676 PolarHBondContact O-N 3Å; T673-C676 PolarHBondContact OG1-N 3.17Å; T673-C676 VanDerWaalsContact OG1-N 3.16Å; T673-C676 PolarHBondContact OG1-SG 3.44Å; T673-R677 PolarHBondContact O-N 2.91Å
674	D	84.4	Confident	85.9	Confident	84 Å²	84	39 Å²	39	45%	0.449	20%	0.203	S	C	.	.	H	α-helix	trans	-46.7	-42.8	172	-65.5	-46.5	0	0	0	111.8	R478 R677 F678	R478-D674 IonicContact CZ-OD2 2.74Å; R478-D674 IonicContact NE-OD2 3.52Å; R478-D674 IonicContact NH2-OD2 2.84Å; R478-D674 PolarHBondContact NH2-OD2 2.95Å; D674-R677 PolarHBondContact O-N 2.92Å; D674-F678 HydrophobicContact CB-CE2 4.31Å; D674-F678 WeakPolarHBondContact O-CD2 3.35Å; D674-F678 PolarHBondContact O-N 3.32Å
675	N	86.8	Confident	86.2	Confident	100 Å²	100	38.8 Å²	38.8	54%	0.535	20%	0.202	S	C	.	.	H	α-helix	trans	-63.6	-44.5	177.9	-170.6	49.2	0	0	0	112.1	T673 R677 F678 M679	T673-N675 PolarHBondContact O-N 3.44Å; T673-N675 VanDerWaalsContact O-N 3.1Å; N675-R677 VanDerWaalsContact C-N 3.32Å; N675-R677 PolarHBondContact O-N 3.09Å; N675-F678 PolarHBondContact O-N 3.3Å; N675-M679 WeakPolarHBondContact O-CG 3.46Å; N675-M679 PolarHBondContact O-N 2.75Å
676	C	88.3	Confident	86.6	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-43.7	175.5	-63.9	0	0	0	0	111.4	T673 F678 M679 Y680 L776	T673-C676 WeakPolarHBondContact O-CA 3.41Å; T673-C676 WeakPolarHBondContact O-CB 3.43Å; T673-C676 PolarHBondContact O-N 3Å; T673-C676 PolarHBondContact OG1-N 3.17Å; T673-C676 VanDerWaalsContact OG1-N 3.16Å; T673-C676 PolarHBondContact OG1-SG 3.44Å; C676-F678 PolarHBondContact O-N 3.16Å; C676-M679 PolarHBondContact O-N 3.01Å; C676-Y680 WeakPolarHBondContact O-CD2 3.4Å; C676-Y680 PolarHBondContact O-N 3.22Å; C676-L776 HydrophobicContact CB-CD1 3.52Å
677	R	86.7	Confident	87.1	Confident	98 Å²	98	32.7 Å²	32.7	37%	0.37	16%	0.159	S	C	.	.	H	α-helix	trans	-62	-41.1	176.1	-175.3	177	176.1	-172.2	2.8	112.2	D661 T673 D674 N675 L681	D661-R677 VanDerWaalsContact CG-NH2 3.25Å; D661-R677 IonicContact OD1-CZ 3.06Å; D661-R677 IonicContact OD1-NE 2.8Å; D661-R677 PolarHBondContact OD1-NE 3.47Å; D661-R677 IonicContact OD1-NH2 2.65Å; D661-R677 PolarHBondContact OD1-NH2 3.32Å; D661-R677 IonicContact OD2-CZ 2.79Å; D661-R677 IonicContact OD2-NE 3.26Å; D661-R677 PolarHBondContact OD2-NE 3.47Å; D661-R677 IonicContact OD2-NH2 3.52Å; D661-R677 PolarHBondContact OD2-NH2 2.83Å; T673-R677 PolarHBondContact O-N 2.91Å; D674-R677 PolarHBondContact O-N 2.92Å; N675-R677 VanDerWaalsContact C-N 3.32Å; N675-R677 PolarHBondContact O-N 3.09Å; R677-L681 WeakPolarHBondContact O-CB 3.31Å; R677-L681 PolarHBondContact O-N 2.85Å
678	F	87.1	Confident	87.5	Confident	102 Å²	102	32.5 Å²	32.5	45%	0.447	16%	0.157	S	C	.	.	H	α-helix	trans	-64.4	-43.5	173.7	-70.2	-59.9	0	0	0	112.4	D674 N675 C676 L681 F682	D674-F678 HydrophobicContact CB-CE2 4.31Å; D674-F678 WeakPolarHBondContact O-CD2 3.35Å; D674-F678 PolarHBondContact O-N 3.32Å; N675-F678 PolarHBondContact O-N 3.3Å; C676-F678 PolarHBondContact O-N 3.16Å; F678-L681 PolarHBondContact O-N 2.87Å; F678-F682 HydrophobicContact CB-CE2 4.38Å; F678-F682 WeakPolarHBondContact O-CD2 3.45Å; F678-F682 PolarHBondContact O-N 3.39Å
679	M	89.4	Confident	87.8	Confident	33 Å²	33	35.5 Å²	35.5	16%	0.163	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-46	176.4	-67.4	-174	81.1	0	0	111.5	N675 C676 L681 F682 S683 L776 F780	N675-M679 WeakPolarHBondContact O-CG 3.46Å; N675-M679 PolarHBondContact O-N 2.75Å; C676-M679 PolarHBondContact O-N 3.01Å; M679-L681 PolarHBondContact O-N 3.1Å; M679-F682 PolarHBondContact O-N 3.11Å; M679-S683 PolarHBondContact O-N 3.05Å; M679-S683 PolarHBondContact O-OG 3.33Å; M679-L776 HydrophobicContact CB-CD2 4.33Å; M679-L776 HydrophobicContact CE-CB 4.48Å; M679-L776 HydrophobicContact SD-CB 4.35Å; M679-F780 HydrophobicContact CE-CB 3.59Å; M679-F780 HydrophobicContact CE-CD1 4.17Å; M679-F780 HydrophobicContact CE-CD2 3.96Å; M679-F780 HydrophobicContact CE-CG 3.66Å
680	Y	91.7	Very high	88	Confident	6 Å²	6	34 Å²	34	2%	0.024	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-43	172.9	-79.3	-60.1	0	0	0	112.8	T581 L585 L586 F672 C676 F682 S683 F684 H772 F775 L776	T581-Y680 HydrophobicContact CG2-CD1 4.09Å; T581-Y680 HydrophobicContact CG2-CD2 4.31Å; T581-Y680 HydrophobicContact CG2-CE1 3.64Å; T581-Y680 HydrophobicContact CG2-CE2 3.89Å; T581-Y680 HydrophobicContact CG2-CG 4.41Å; L585-Y680 HydrophobicContact CD2-CD1 4.32Å; L585-Y680 HydrophobicContact CD2-CD2 4.48Å; L585-Y680 HydrophobicContact CD2-CG 3.93Å; L586-Y680 HydrophobicContact CD1-CE1 4.14Å; L586-Y680 HydrophobicContact CD2-CD1 4.06Å; L586-Y680 HydrophobicContact CD2-CE1 4.33Å; L586-Y680 HydrophobicContact CG-CD1 4.38Å; L586-Y680 HydrophobicContact CG-CE1 4.29Å; F672-Y680 HydrophobicContact CD1-CE2 4.19Å; F672-Y680 HydrophobicContact CE1-CE2 4.2Å; C676-Y680 WeakPolarHBondContact O-CD2 3.4Å; C676-Y680 PolarHBondContact O-N 3.22Å; Y680-F682 VanDerWaalsContact C-N 3.33Å; Y680-F682 PolarHBondContact O-N 3.33Å; Y680-S683 PolarHBondContact O-N 2.93Å; Y680-F684 WeakPolarHBondContact O-CB 3.46Å; Y680-F684 PolarHBondContact O-N 2.83Å; Y680-H772 AromaticContact CE2-CE1 3.88Å; Y680-H772 AromaticContact CE2-NE2 3.69Å; Y680-H772 AromaticContact CZ-NE2 3.66Å; Y680-H772 PolarHBondContact OH-NE2 3.12Å; Y680-F775 HydrophobicContact CE1-CE1 4.28Å; Y680-L776 HydrophobicContact CD1-CD2 3.73Å; Y680-L776 HydrophobicContact CD2-CD1 4.4Å; Y680-L776 HydrophobicContact CD2-CD2 4.11Å; Y680-L776 HydrophobicContact CE1-CD2 3.56Å; Y680-L776 HydrophobicContact CE2-CD1 4.01Å; Y680-L776 HydrophobicContact CE2-CD2 3.95Å; Y680-L776 HydrophobicContact CE2-CG 4.39Å; Y680-L776 HydrophobicContact CG-CD2 4Å
681	L	89.6	Confident	88.3	Confident	17 Å²	17	35.8 Å²	35.8	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-37	178.1	-179.5	60.9	0	0	0	112	L645 R677 F678 M679 N685	L645-L681 HydrophobicContact CD2-CD2 4.25Å; R677-L681 WeakPolarHBondContact O-CB 3.31Å; R677-L681 PolarHBondContact O-N 2.85Å; F678-L681 PolarHBondContact O-N 2.87Å; M679-L681 PolarHBondContact O-N 3.1Å; L681-N685 VanDerWaalsContact O-CB 3.3Å; L681-N685 WeakPolarHBondContact O-CB 3.17Å; L681-N685 PolarHBondContact O-N 2.87Å; L681-N685 PolarHBondContact O-ND2 3.13Å
682	F	87.8	Confident	88.6	Confident	116 Å²	116	36.8 Å²	36.8	51%	0.509	17%	0.17	S	C	.	.	H	α-helix	trans	-68.2	-42.8	172.8	-72.4	-58.7	0	0	0	112.1	F678 M679 Y680 N685 F686 F780 L785	F678-F682 HydrophobicContact CB-CE2 4.38Å; F678-F682 WeakPolarHBondContact O-CD2 3.45Å; F678-F682 PolarHBondContact O-N 3.39Å; M679-F682 PolarHBondContact O-N 3.11Å; Y680-F682 VanDerWaalsContact C-N 3.33Å; Y680-F682 PolarHBondContact O-N 3.33Å; F682-N685 PolarHBondContact O-N 3.49Å; F682-F686 PolarHBondContact O-N 2.79Å; F682-F686 VanDerWaalsContact O-N 3.08Å; F682-F780 HydrophobicContact CB-CE2 4.04Å; F682-F780 HydrophobicContact CD2-CE2 4.46Å; F682-L785 HydrophobicContact CB-CD1 4.26Å
683	S	89.6	Confident	88.8	Confident	1 Å²	1	36 Å²	36	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-60	-48.3	172.9	-65.5	0	0	0	0	111.8	M679 Y680 N685 F686 L687	M679-S683 PolarHBondContact O-N 3.05Å; M679-S683 PolarHBondContact O-OG 3.33Å; Y680-S683 PolarHBondContact O-N 2.93Å; S683-N685 VanDerWaalsContact C-N 3.34Å; S683-N685 PolarHBondContact O-N 3.32Å; S683-F686 WeakPolarHBondContact O-CB 3.26Å; S683-F686 PolarHBondContact O-N 3.3Å; S683-F686 VanDerWaalsContact O-N 3.15Å; S683-L687 WeakPolarHBondContact O-CB 3.15Å; S683-L687 VanDerWaalsContact O-CG 3.24Å; S683-L687 WeakPolarHBondContact O-CG 3.37Å; S683-L687 PolarHBondContact O-N 3.05Å
684	F	91	Very high	89.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.9	-48.8	174.5	179.9	-85.4	0	0	0	110.9	L585 L587 F658 L660 Y680 F686 L687 W688	L585-F684 HydrophobicContact CD1-CB 3.94Å; L585-F684 HydrophobicContact CD1-CD2 3.92Å; L585-F684 HydrophobicContact CD1-CG 4.09Å; L585-F684 WeakPolarHBondContact O-CD2 3.32Å; L587-F684 HydrophobicContact CD1-CD2 3.59Å; L587-F684 HydrophobicContact CD1-CE2 3.78Å; F658-F684 HydrophobicContact CE1-CZ 4.37Å; L660-F684 HydrophobicContact CB-CD2 4.43Å; L660-F684 HydrophobicContact CB-CE2 3.87Å; L660-F684 HydrophobicContact CB-CZ 4.04Å; L660-F684 HydrophobicContact CD1-CE2 3.98Å; L660-F684 HydrophobicContact CD1-CZ 4.29Å; L660-F684 HydrophobicContact CG-CE2 3.97Å; L660-F684 HydrophobicContact CG-CZ 3.92Å; Y680-F684 WeakPolarHBondContact O-CB 3.46Å; Y680-F684 PolarHBondContact O-N 2.83Å; F684-F686 PolarHBondContact O-N 3.18Å; F684-L687 PolarHBondContact O-N 2.88Å; F684-W688 HydrophobicContact CD1-CB 4.18Å; F684-W688 HydrophobicContact CE1-CB 3.77Å; F684-W688 HydrophobicContact CE1-CD2 4.2Å; F684-W688 AromaticContact CE1-CG 3.88Å; F684-W688 HydrophobicContact CE1-CG 3.88Å; F684-W688 HydrophobicContact CZ-CB 4.14Å; F684-W688 HydrophobicContact CZ-CD2 4.04Å; F684-W688 AromaticContact CZ-CE3 3.89Å; F684-W688 HydrophobicContact CZ-CE3 3.89Å; F684-W688 HydrophobicContact CZ-CG 4.16Å; F684-W688 WeakPolarHBondContact O-CB 3.18Å; F684-W688 PolarHBondContact O-N 2.84Å
685	N	88.5	Confident	89.5	Confident	17 Å²	17	33.4 Å²	33.4	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-59.6	-30.1	179.6	-94.3	-74.8	0	0	0	114	L681 F682 S683 R689	L681-N685 VanDerWaalsContact O-CB 3.3Å; L681-N685 WeakPolarHBondContact O-CB 3.17Å; L681-N685 PolarHBondContact O-N 2.87Å; L681-N685 PolarHBondContact O-ND2 3.13Å; F682-N685 PolarHBondContact O-N 3.49Å; S683-N685 VanDerWaalsContact C-N 3.34Å; S683-N685 PolarHBondContact O-N 3.32Å; N685-R689 WeakPolarHBondContact O-CD 3.28Å; N685-R689 WeakPolarHBondContact O-CG 3.42Å; N685-R689 PolarHBondContact O-NH1 3.48Å; N685-R689 PolarHBondContact OD1-NH1 3.33Å
686	F	88.5	Confident	89.6	Confident	13 Å²	13	29.9 Å²	29.9	6%	0.057	13%	0.132	C	C	.	.	H	α-helix	trans	-77.7	-51.6	174	173.6	-103.5	0	0	0	111.8	F682 S683 F684 W688 R689 A690 I743 C783 L785 L793 L796	F682-F686 PolarHBondContact O-N 2.79Å; F682-F686 VanDerWaalsContact O-N 3.08Å; S683-F686 WeakPolarHBondContact O-CB 3.26Å; S683-F686 PolarHBondContact O-N 3.3Å; S683-F686 VanDerWaalsContact O-N 3.15Å; F684-F686 PolarHBondContact O-N 3.18Å; F686-W688 VanDerWaalsContact C-N 3.33Å; F686-W688 PolarHBondContact O-N 3.12Å; F686-R689 PolarHBondContact O-N 3.41Å; F686-A690 PolarHBondContact O-N 3.01Å; F686-I743 HydrophobicContact CE1-CD1 3.75Å; F686-I743 HydrophobicContact CE1-CG1 4.49Å; F686-I743 HydrophobicContact CZ-CD1 4.27Å; F686-C783 HydrophobicContact CD1-CB 3.99Å; F686-C783 HydrophobicContact CE1-CB 4.02Å; F686-C783 WeakPolarHBondContact CZ-O 3.43Å; F686-L785 HydrophobicContact CB-CD1 4.28Å; F686-L785 HydrophobicContact CB-CD2 4.16Å; F686-L785 HydrophobicContact CD2-CD2 4.47Å; F686-L785 HydrophobicContact CG-CD2 4.44Å; F686-L793 HydrophobicContact CD2-CD1 4.08Å; F686-L793 HydrophobicContact CE2-CD1 4.04Å; F686-L796 HydrophobicContact CE2-CD2 3.69Å; F686-L796 HydrophobicContact CZ-CD2 4.04Å
687	L	90.9	Very high	89.7	Confident	10 Å²	10	30 Å²	30	5%	0.052	13%	0.132	C	C	.	.	H	α-helix	trans	-60.5	-42.1	179.9	-65.9	173.5	0	0	0	111.7	L586 L587 S683 F684 R689 A690 K691 I743	L586-L687 HydrophobicContact CD2-CD1 4.21Å; L587-L687 HydrophobicContact CD1-CB 3.83Å; L587-L687 HydrophobicContact CD1-CD1 4.18Å; L587-L687 HydrophobicContact CD2-CB 4.14Å; S683-L687 WeakPolarHBondContact O-CB 3.15Å; S683-L687 VanDerWaalsContact O-CG 3.24Å; S683-L687 WeakPolarHBondContact O-CG 3.37Å; S683-L687 PolarHBondContact O-N 3.05Å; F684-L687 PolarHBondContact O-N 2.88Å; L687-R689 PolarHBondContact O-N 3.21Å; L687-A690 PolarHBondContact O-N 3.38Å; L687-K691 VanDerWaalsContact O-CB 3.3Å; L687-K691 WeakPolarHBondContact O-CB 3.46Å; L687-K691 PolarHBondContact O-N 3.01Å; L687-I743 HydrophobicContact CD2-CD1 4.46Å; L687-I743 HydrophobicContact CD2-CG2 3.37Å
688	W	91	Very high	89.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.6	-41.4	175.7	-176.5	-114.1	0	0	0	112.3	I593 M597 L600 L604 W655 F658 F684 F686 K691 R692	I593-W688 HydrophobicContact CG2-CZ3 4.28Å; M597-W688 HydrophobicContact CG-CH2 3.51Å; M597-W688 HydrophobicContact CG-CZ2 4.44Å; M597-W688 HydrophobicContact CG-CZ3 3.74Å; M597-W688 HydrophobicContact SD-CH2 4.38Å; M597-W688 HydrophobicContact SD-CZ3 4.25Å; L600-W688 HydrophobicContact CD1-CH2 4.18Å; L600-W688 HydrophobicContact CD1-CZ2 4.46Å; L604-W688 HydrophobicContact CD1-CZ2 3.81Å; W655-W688 AromaticContact CE3-CZ2 3.93Å; W655-W688 HydrophobicContact CE3-CZ2 3.93Å; W655-W688 AromaticContact CE3-NE1 3.99Å; W655-W688 HydrophobicContact CZ3-CH2 4.4Å; W655-W688 AromaticContact CZ3-CZ2 3.74Å; W655-W688 HydrophobicContact CZ3-CZ2 3.74Å; W655-W688 PolarHBondContact O-NE1 3.21Å; F658-W688 HydrophobicContact CD1-CD2 4.39Å; F658-W688 AromaticContact CD1-CE2 3.65Å; F658-W688 HydrophobicContact CD1-CH2 4.12Å; F658-W688 AromaticContact CD1-CZ2 3.51Å; F658-W688 HydrophobicContact CD1-CZ2 3.51Å; F658-W688 AromaticContact CD1-NE1 3.87Å; F658-W688 AromaticContact CE1-CH2 3.84Å; F658-W688 HydrophobicContact CE1-CH2 3.84Å; F658-W688 AromaticContact CE1-CZ2 3.73Å; F658-W688 HydrophobicContact CE1-CZ2 3.73Å; F658-W688 HydrophobicContact CE1-CZ3 4.35Å; F684-W688 HydrophobicContact CD1-CB 4.18Å; F684-W688 HydrophobicContact CE1-CB 3.77Å; F684-W688 HydrophobicContact CE1-CD2 4.2Å; F684-W688 AromaticContact CE1-CG 3.88Å; F684-W688 HydrophobicContact CE1-CG 3.88Å; F684-W688 HydrophobicContact CZ-CB 4.14Å; F684-W688 HydrophobicContact CZ-CD2 4.04Å; F684-W688 AromaticContact CZ-CE3 3.89Å; F684-W688 HydrophobicContact CZ-CE3 3.89Å; F684-W688 HydrophobicContact CZ-CG 4.16Å; F684-W688 WeakPolarHBondContact O-CB 3.18Å; F684-W688 PolarHBondContact O-N 2.84Å; F686-W688 VanDerWaalsContact C-N 3.33Å; F686-W688 PolarHBondContact O-N 3.12Å; W688-K691 PolarHBondContact O-N 3.32Å; W688-R692 WeakPolarHBondContact O-CB 3.28Å; W688-R692 PolarHBondContact O-N 2.9Å
689	R	89	Confident	90	Very high	66 Å²	66	24.4 Å²	24.4	25%	0.249	12%	0.118	C	C	.	.	H	α-helix	trans	-66.2	-44.6	174.5	-75.8	176.2	177.8	83.2	1.5	111.6	D656 N685 F686 L687 K691 R692 M693	D656-R689 PolarHBondContact O-NH2 2.75Å; D656-R689 VanDerWaalsContact O-NH2 3.12Å; D656-R689 IonicContact OD1-CZ 2.71Å; D656-R689 IonicContact OD1-NE 3.71Å; D656-R689 PolarHBondContact OD1-NE 2.84Å; D656-R689 IonicContact OD1-NH2 3.13Å; D656-R689 PolarHBondContact OD1-NH2 2.87Å; N685-R689 WeakPolarHBondContact O-CD 3.28Å; N685-R689 WeakPolarHBondContact O-CG 3.42Å; N685-R689 PolarHBondContact O-NH1 3.48Å; N685-R689 PolarHBondContact OD1-NH1 3.33Å; F686-R689 PolarHBondContact O-N 3.41Å; L687-R689 PolarHBondContact O-N 3.21Å; R689-K691 VanDerWaalsContact C-N 3.32Å; R689-K691 PolarHBondContact O-N 3.11Å; R689-R692 PolarHBondContact O-N 3.43Å; R689-M693 WeakPolarHBondContact O-CG 3.31Å; R689-M693 PolarHBondContact O-N 3.09Å; R689-M693 VanDerWaalsContact O-N 3.13Å
690	A	90	Very high	90	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.033	11%	0.113	C	C	.	.	H	α-helix	trans	-61.7	-39.3	174.9	0	0	0	0	0	112.2	F686 L687 M693 E694 F800	F686-A690 PolarHBondContact O-N 3.01Å; L687-A690 PolarHBondContact O-N 3.38Å; A690-M693 PolarHBondContact O-N 3.14Å; A690-E694 PolarHBondContact O-N 3.15Å; A690-F800 HydrophobicContact CB-CZ 4.23Å
691	K	90.2	Very high	90	Very high	38 Å²	38	29.3 Å²	29.3	17%	0.165	14%	0.135	C	C	.	.	H	α-helix	trans	-70.8	-38.4	178	-168.7	57.8	172.4	163.5	0	112.4	L587 I593 M597 L687 W688 R689 M693 E694 F695	L587-K691 HydrophobicContact CD2-CB 4.03Å; L587-K691 HydrophobicContact CD2-CG 4.22Å; I593-K691 HydrophobicContact CG2-CG 4.28Å; M597-K691 HydrophobicContact CE-CD 4.11Å; M597-K691 HydrophobicContact CE-CG 3.71Å; M597-K691 HydrophobicContact SD-CG 3.77Å; L687-K691 VanDerWaalsContact O-CB 3.3Å; L687-K691 WeakPolarHBondContact O-CB 3.46Å; L687-K691 PolarHBondContact O-N 3.01Å; W688-K691 PolarHBondContact O-N 3.32Å; R689-K691 VanDerWaalsContact C-N 3.32Å; R689-K691 PolarHBondContact O-N 3.11Å; K691-M693 VanDerWaalsContact C-N 3.32Å; K691-M693 PolarHBondContact O-N 3.06Å; K691-E694 IonicContact NZ-OE2 3.22Å; K691-E694 PolarHBondContact NZ-OE2 3.39Å; K691-E694 PolarHBondContact O-N 2.78Å; K691-F695 WeakPolarHBondContact O-CB 3.4Å; K691-F695 PolarHBondContact O-N 3.07Å
692	R	90.4	Very high	89.9	Confident	23 Å²	23	35.2 Å²	35.2	9%	0.087	16%	0.16	C	C	.	.	H	α-helix	trans	-56.1	-43.3	169.2	178.1	-170.8	179.9	-175.8	5.7	111.7	T653 W655 D656 W688 R689 F695 T696	T653-R692 PolarHBondContact OG1-NH2 3.45Å; W655-R692 VanDerWaalsContact CD1-NH2 3.27Å; W655-R692 HydrophobicContact CD2-CG 3.99Å; W655-R692 HydrophobicContact CE3-CB 4.13Å; W655-R692 HydrophobicContact CE3-CG 3.73Å; W655-R692 VanDerWaalsContact CG-NE 3.31Å; W655-R692 HydrophobicContact CZ3-CB 4.27Å; W655-R692 HydrophobicContact CZ3-CG 4.05Å; D656-R692 IonicContact OD2-NH1 3.07Å; D656-R692 PolarHBondContact OD2-NH1 2.9Å; D656-R692 VanDerWaalsContact OD2-NH1 3.13Å; W688-R692 WeakPolarHBondContact O-CB 3.28Å; W688-R692 PolarHBondContact O-N 2.9Å; R689-R692 PolarHBondContact O-N 3.43Å; R692-F695 PolarHBondContact O-N 3.45Å; R692-T696 VanDerWaalsContact O-CB 3.3Å; R692-T696 WeakPolarHBondContact O-CB 3.49Å; R692-T696 PolarHBondContact O-N 3.49Å; R692-T696 PolarHBondContact O-OG1 3.15Å
693	M	90.7	Very high	89.9	Confident	6 Å²	6	33.6 Å²	33.6	3%	0.03	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-44.2	178.7	-62.7	-56.6	145.4	0	0	111.5	R689 A690 K691 T696 L697 I736 F800 I803 L804	R689-M693 WeakPolarHBondContact O-CG 3.31Å; R689-M693 PolarHBondContact O-N 3.09Å; R689-M693 VanDerWaalsContact O-N 3.13Å; A690-M693 PolarHBondContact O-N 3.14Å; K691-M693 VanDerWaalsContact C-N 3.32Å; K691-M693 PolarHBondContact O-N 3.06Å; M693-T696 PolarHBondContact O-N 3.25Å; M693-L697 WeakPolarHBondContact O-CB 3.35Å; M693-L697 WeakPolarHBondContact O-CD1 3.46Å; M693-L697 VanDerWaalsContact O-CG 3.23Å; M693-L697 WeakPolarHBondContact O-CG 3.09Å; M693-L697 PolarHBondContact O-N 2.85Å; M693-I736 HydrophobicContact CB-CD1 4.24Å; M693-F800 HydrophobicContact CE-CB 4.03Å; M693-F800 HydrophobicContact CE-CG 4.45Å; M693-F800 HydrophobicContact CG-CB 4.39Å; M693-F800 HydrophobicContact CG-CD1 3.79Å; M693-F800 HydrophobicContact CG-CE1 4.21Å; M693-F800 HydrophobicContact CG-CG 4.06Å; M693-F800 HydrophobicContact SD-CB 4.28Å; M693-I803 HydrophobicContact CB-CD1 4.44Å; M693-I803 HydrophobicContact SD-CB 4.08Å; M693-I803 HydrophobicContact SD-CG2 3.97Å; M693-L804 HydrophobicContact CE-CD1 4.09Å; M693-L804 HydrophobicContact CE-CD2 3.92Å; M693-L804 HydrophobicContact CE-CG 3.89Å; M693-L804 HydrophobicContact SD-CD2 4.11Å; M693-L804 HydrophobicContact SD-CG 4.16Å
694	E	90.8	Very high	89.8	Confident	37 Å²	37	33.7 Å²	33.7	17%	0.173	16%	0.155	C	C	.	.	H	α-helix	trans	-62.9	-48.7	175.3	-176.6	-90.1	122	0	0	112.2	A690 K691 T696 L697 S698 I736	A690-E694 PolarHBondContact O-N 3.15Å; K691-E694 IonicContact NZ-OE2 3.22Å; K691-E694 PolarHBondContact NZ-OE2 3.39Å; K691-E694 PolarHBondContact O-N 2.78Å; E694-T696 VanDerWaalsContact C-N 3.31Å; E694-T696 PolarHBondContact O-N 3.2Å; E694-L697 CarbonylContact O-C 3.6Å; E694-L697 PolarHBondContact O-N 3.39Å; E694-L697 VanDerWaalsContact O-N 3.11Å; E694-S698 WeakPolarHBondContact O-CB 3.47Å; E694-S698 PolarHBondContact O-N 3.47Å; E694-S698 PolarHBondContact O-OG 3.18Å; E694-S698 PolarHBondContact OE1-OG 2.84Å; E694-I736 HydrophobicContact CB-CG2 3.77Å; E694-I736 HydrophobicContact CG-CG2 4.35Å
695	F	91.1	Very high	89.5	Confident	12 Å²	12	36.8 Å²	36.8	5%	0.053	17%	0.171	C	C	.	.	H	α-helix	trans	-56.5	-45.8	176.8	-178.8	-108.6	0	0	0	111.9	M597 D598 D601 W655 K691 R692 S698 N699	M597-F695 HydrophobicContact CB-CD2 4.32Å; M597-F695 HydrophobicContact CB-CE2 4.27Å; M597-F695 HydrophobicContact CB-CG 4.47Å; M597-F695 HydrophobicContact CB-CZ 4.37Å; M597-F695 HydrophobicContact CE-CB 3.85Å; M597-F695 HydrophobicContact CE-CD2 3.85Å; M597-F695 HydrophobicContact CE-CG 3.99Å; M597-F695 HydrophobicContact SD-CB 3.93Å; M597-F695 HydrophobicContact SD-CD2 4.49Å; M597-F695 HydrophobicContact SD-CG 4.12Å; D598-F695 VanDerWaalsContact OD1-CE2 3.24Å; D598-F695 WeakPolarHBondContact OD1-CE2 3.31Å; D598-F695 WeakPolarHBondContact OD1-CZ 3.32Å; D601-F695 HydrophobicContact CB-CE1 4.16Å; W655-F695 HydrophobicContact CH2-CD1 4.28Å; W655-F695 HydrophobicContact CH2-CE1 4.45Å; K691-F695 WeakPolarHBondContact O-CB 3.4Å; K691-F695 PolarHBondContact O-N 3.07Å; R692-F695 PolarHBondContact O-N 3.45Å; F695-S698 PolarHBondContact O-N 2.77Å; F695-N699 WeakPolarHBondContact CE1-ND2 3.44Å; F695-N699 WeakPolarHBondContact CZ-ND2 3.49Å; F695-N699 WeakPolarHBondContact O-CB 3.49Å; F695-N699 PolarHBondContact O-N 3.42Å
696	T	89.2	Confident	89.3	Confident	27 Å²	27	39.6 Å²	39.6	17%	0.166	19%	0.191	C	C	.	.	H	α-helix	trans	-58.6	-50.7	174.6	-55.3	0	0	0	0	110.3	R692 M693 E694 S698 N699 L700 A807	R692-T696 VanDerWaalsContact O-CB 3.3Å; R692-T696 WeakPolarHBondContact O-CB 3.49Å; R692-T696 PolarHBondContact O-N 3.49Å; R692-T696 PolarHBondContact O-OG1 3.15Å; M693-T696 PolarHBondContact O-N 3.25Å; E694-T696 VanDerWaalsContact C-N 3.31Å; E694-T696 PolarHBondContact O-N 3.2Å; T696-S698 VanDerWaalsContact C-N 3.32Å; T696-S698 PolarHBondContact O-N 2.9Å; T696-N699 PolarHBondContact O-N 3.15Å; T696-L700 HydrophobicContact CG2-CD1 4.16Å; T696-L700 HydrophobicContact CG2-CG 4.29Å; T696-L700 VanDerWaalsContact O-CG 3.25Å; T696-L700 WeakPolarHBondContact O-CG 3.4Å; T696-L700 PolarHBondContact O-N 2.93Å; T696-A807 HydrophobicContact CG2-CB 3.81Å
697	L	91.4	Very high	89.1	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-36.6	178.9	-73.9	160.3	0	0	0	113.3	M693 E694 W701 I732 R733 I736 I803 Y806	M693-L697 WeakPolarHBondContact O-CB 3.35Å; M693-L697 WeakPolarHBondContact O-CD1 3.46Å; M693-L697 VanDerWaalsContact O-CG 3.23Å; M693-L697 WeakPolarHBondContact O-CG 3.09Å; M693-L697 PolarHBondContact O-N 2.85Å; E694-L697 CarbonylContact O-C 3.6Å; E694-L697 PolarHBondContact O-N 3.39Å; E694-L697 VanDerWaalsContact O-N 3.11Å; L697-W701 WeakPolarHBondContact O-CB 3.38Å; L697-W701 PolarHBondContact O-N 2.97Å; L697-I732 HydrophobicContact CD1-CG2 3.56Å; L697-I732 HydrophobicContact CD2-CB 4.14Å; L697-I732 HydrophobicContact CD2-CG2 3.69Å; L697-I732 HydrophobicContact CG-CG2 4.25Å; L697-R733 PolarHBondContact O-NH2 2.94Å; L697-I736 HydrophobicContact CD1-CB 4.21Å; L697-I736 HydrophobicContact CD1-CG1 3.73Å; L697-I803 HydrophobicContact CD1-CG2 4.14Å; L697-I803 HydrophobicContact CD2-CG2 4.2Å; L697-I803 HydrophobicContact CG-CG2 4.07Å; L697-Y806 HydrophobicContact CD2-CD1 4.23Å; L697-Y806 HydrophobicContact CD2-CE1 4.02Å
698	S	90.7	Very high	88.6	Confident	38 Å²	38	41.3 Å²	41.3	27%	0.266	20%	0.204	S	C	.	.	H	α-helix	trans	-67.7	-41.8	175.7	-70.5	0	0	0	0	111.2	E694 F695 T696 W701 K702	E694-S698 WeakPolarHBondContact O-CB 3.47Å; E694-S698 PolarHBondContact O-N 3.47Å; E694-S698 PolarHBondContact O-OG 3.18Å; E694-S698 PolarHBondContact OE1-OG 2.84Å; F695-S698 PolarHBondContact O-N 2.77Å; T696-S698 VanDerWaalsContact C-N 3.32Å; T696-S698 PolarHBondContact O-N 2.9Å; S698-W701 PolarHBondContact O-N 3.49Å; S698-K702 PolarHBondContact O-N 3.2Å
699	N	89.2	Confident	88.2	Confident	46 Å²	46	50.6 Å²	50.6	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-66.3	-41.6	172.4	-78.9	-26.2	0	0	0	113.2	F695 T696 W701 K702 Q703	F695-N699 WeakPolarHBondContact CE1-ND2 3.44Å; F695-N699 WeakPolarHBondContact CZ-ND2 3.49Å; F695-N699 WeakPolarHBondContact O-CB 3.49Å; F695-N699 PolarHBondContact O-N 3.42Å; T696-N699 PolarHBondContact O-N 3.15Å; N699-W701 VanDerWaalsContact C-N 3.34Å; N699-W701 PolarHBondContact O-N 3.45Å; N699-K702 WeakPolarHBondContact O-CB 3.24Å; N699-K702 PolarHBondContact O-N 3.16Å; N699-Q703 WeakPolarHBondContact O-CG 3.47Å; N699-Q703 PolarHBondContact O-N 2.96Å
700	L	89.7	Confident	87.6	Confident	12 Å²	12	48.7 Å²	48.7	6%	0.063	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-43.2	174.3	-67.3	177.6	0	0	0	111.2	T696 Q703 Q704 Y806 A807 H810	T696-L700 HydrophobicContact CG2-CD1 4.16Å; T696-L700 HydrophobicContact CG2-CG 4.29Å; T696-L700 VanDerWaalsContact O-CG 3.25Å; T696-L700 WeakPolarHBondContact O-CG 3.4Å; T696-L700 PolarHBondContact O-N 2.93Å; L700-Q703 CarbonylContact O-C 3.46Å; L700-Q703 WeakPolarHBondContact O-CA 3.49Å; L700-Q703 WeakPolarHBondContact O-CB 3.4Å; L700-Q703 PolarHBondContact O-N 3.47Å; L700-Q703 VanDerWaalsContact O-N 3.11Å; L700-Q704 WeakPolarHBondContact O-CG 3.31Å; L700-Q704 PolarHBondContact O-N 3.01Å; L700-Y806 HydrophobicContact CD1-CD1 3.75Å; L700-Y806 HydrophobicContact CD1-CE1 3.69Å; L700-A807 HydrophobicContact CD1-CB 3.83Å; L700-A807 HydrophobicContact CD2-CB 4.27Å; L700-H810 HydrophobicContact CD2-CB 3.79Å
701	W	90.5	Very high	86.6	Confident	130 Å²	130	49.8 Å²	49.8	49%	0.492	25%	0.246	S	C	.	.	H	α-helix	trans	-68	-36.5	178	177.4	62.7	0	0	0	113.2	L697 S698 N699 Q703 Q704 L705	L697-W701 WeakPolarHBondContact O-CB 3.38Å; L697-W701 PolarHBondContact O-N 2.97Å; S698-W701 PolarHBondContact O-N 3.49Å; N699-W701 VanDerWaalsContact C-N 3.34Å; N699-W701 PolarHBondContact O-N 3.45Å; W701-Q703 VanDerWaalsContact C-N 3.29Å; W701-Q703 PolarHBondContact O-N 3.35Å; W701-Q704 WeakPolarHBondContact O-CB 3.5Å; W701-Q704 PolarHBondContact O-N 3.19Å; W701-L705 HydrophobicContact CD2-CD1 3.83Å; W701-L705 HydrophobicContact CE3-CD1 4.18Å; W701-L705 HydrophobicContact CG-CD1 4.34Å; W701-L705 HydrophobicContact CH2-CD1 4.2Å; W701-L705 HydrophobicContact CZ2-CD1 3.84Å; W701-L705 HydrophobicContact CZ3-CD1 4.36Å; W701-L705 WeakPolarHBondContact O-CB 3.44Å; W701-L705 WeakPolarHBondContact O-CG 3.09Å; W701-L705 PolarHBondContact O-N 3.48Å
702	K	88.8	Confident	85.6	Confident	140 Å²	140	53 Å²	53	61%	0.609	26%	0.257	S	S	*	.	H	α-helix	trans	-57	-44	167.3	-177.6	-179.5	178.3	-179.2	0	111	S698 N699 L705 C706	S698-K702 PolarHBondContact O-N 3.2Å; N699-K702 WeakPolarHBondContact O-CB 3.24Å; N699-K702 PolarHBondContact O-N 3.16Å; K702-L705 PolarHBondContact O-N 2.87Å; K702-C706 PolarHBondContact O-N 3.32Å; K702-C706 VanDerWaalsContact O-N 3.1Å; K702-C706 PolarHBondContact O-SG 3.26Å; K702-C706 VanDerWaalsContact O-SG 3.38Å
703	Q	87.3	Confident	84.5	Confident	82 Å²	82	54 Å²	54	38%	0.383	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-38.5	174.5	-66.6	172.4	8.3	0	0	112.6	N699 L700 W701 C706 A707 N814	N699-Q703 WeakPolarHBondContact O-CG 3.47Å; N699-Q703 PolarHBondContact O-N 2.96Å; L700-Q703 CarbonylContact O-C 3.46Å; L700-Q703 WeakPolarHBondContact O-CA 3.49Å; L700-Q703 WeakPolarHBondContact O-CB 3.4Å; L700-Q703 PolarHBondContact O-N 3.47Å; L700-Q703 VanDerWaalsContact O-N 3.11Å; W701-Q703 VanDerWaalsContact C-N 3.29Å; W701-Q703 PolarHBondContact O-N 3.35Å; Q703-C706 WeakPolarHBondContact O-CB 3.36Å; Q703-C706 PolarHBondContact O-N 2.99Å; Q703-A707 WeakPolarHBondContact O-CB 3.47Å; Q703-A707 PolarHBondContact O-N 3.31Å; Q703-N814 PolarHBondContact OE1-ND2 3.1Å
704	Q	86.3	Confident	83.7	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.019	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-44.8	173.7	-69.3	177.9	-12.8	0	0	112	L700 W701 C706 A707 T708 L725 Y806 H810	L700-Q704 WeakPolarHBondContact O-CG 3.31Å; L700-Q704 PolarHBondContact O-N 3.01Å; W701-Q704 WeakPolarHBondContact O-CB 3.5Å; W701-Q704 PolarHBondContact O-N 3.19Å; Q704-C706 PolarHBondContact O-N 2.85Å; Q704-A707 PolarHBondContact O-N 3.17Å; Q704-A707 VanDerWaalsContact O-N 3.13Å; Q704-T708 WeakPolarHBondContact O-CG2 3.22Å; Q704-T708 PolarHBondContact O-N 3.44Å; Q704-L725 PolarHBondContact NE2-O 2.97Å; Q704-Y806 PolarHBondContact NE2-OH 3.38Å; Q704-H810 WeakPolarHBondContact CG-NE2 3.46Å; Q704-H810 PolarHBondContact NE2-CD2 3.49Å; Q704-H810 PolarHBondContact NE2-NE2 3.25Å
705	L	85.7	Confident	82.7	Confident	64 Å²	64	57.2 Å²	57.2	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-23	176.7	-72.1	165.9	0	0	0	113.1	W701 K702 T708 R709	W701-L705 HydrophobicContact CD2-CD1 3.83Å; W701-L705 HydrophobicContact CE3-CD1 4.18Å; W701-L705 HydrophobicContact CG-CD1 4.34Å; W701-L705 HydrophobicContact CH2-CD1 4.2Å; W701-L705 HydrophobicContact CZ2-CD1 3.84Å; W701-L705 HydrophobicContact CZ3-CD1 4.36Å; W701-L705 WeakPolarHBondContact O-CB 3.44Å; W701-L705 WeakPolarHBondContact O-CG 3.09Å; W701-L705 PolarHBondContact O-N 3.48Å; K702-L705 PolarHBondContact O-N 2.87Å; L705-T708 PolarHBondContact O-OG1 3.38Å; L705-T708 VanDerWaalsContact O-OG1 3.04Å; L705-R709 WeakPolarHBondContact O-CD 3.47Å; L705-R709 WeakPolarHBondContact O-CG 3.38Å; L705-R709 PolarHBondContact O-NE 2.77Å
706	C	84.8	Confident	81.8	Confident	77 Å²	77	63 Å²	63	52%	0.52	32%	0.32	S	S	.	.	H	α-helix	trans	-81.1	-42.6	168	-68.1	0	0	0	0	111.6	K702 Q703 Q704 T708 R709	K702-C706 PolarHBondContact O-N 3.32Å; K702-C706 VanDerWaalsContact O-N 3.1Å; K702-C706 PolarHBondContact O-SG 3.26Å; K702-C706 VanDerWaalsContact O-SG 3.38Å; Q703-C706 WeakPolarHBondContact O-CB 3.36Å; Q703-C706 PolarHBondContact O-N 2.99Å; Q704-C706 PolarHBondContact O-N 2.85Å; C706-T708 VanDerWaalsContact C-N 3.32Å; C706-T708 PolarHBondContact O-N 3.25Å; C706-R709 WeakPolarHBondContact O-CB 3.39Å; C706-R709 PolarHBondContact O-N 2.78Å
707	A	82.9	Confident	81.3	Confident	9 Å²	9	64.2 Å²	64.2	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-34.3	179.7	0	0	0	0	0	113	Q703 Q704 R709 L710 L722 F813	Q703-A707 WeakPolarHBondContact O-CB 3.47Å; Q703-A707 PolarHBondContact O-N 3.31Å; Q704-A707 PolarHBondContact O-N 3.17Å; Q704-A707 VanDerWaalsContact O-N 3.13Å; A707-R709 PolarHBondContact O-N 2.98Å; A707-L710 WeakPolarHBondContact O-CG 3.41Å; A707-L710 PolarHBondContact O-N 3.14Å; A707-L722 HydrophobicContact CB-CD1 4.5Å; A707-F813 HydrophobicContact CB-CE1 4.37Å
708	T	81	Confident	80.8	Confident	49 Å²	49	64.2 Å²	64.2	30%	0.301	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.2	172.4	57.5	0	0	0	0	113.4	Q704 L705 C706 L722 Q726	Q704-T708 WeakPolarHBondContact O-CG2 3.22Å; Q704-T708 PolarHBondContact O-N 3.44Å; L705-T708 PolarHBondContact O-OG1 3.38Å; L705-T708 VanDerWaalsContact O-OG1 3.04Å; C706-T708 VanDerWaalsContact C-N 3.32Å; C706-T708 PolarHBondContact O-N 3.25Å; T708-L722 HydrophobicContact CG2-CD1 4.36Å; T708-L722 HydrophobicContact CG2-CD2 3.53Å; T708-L722 HydrophobicContact CG2-CG 4.17Å; T708-Q726 VanDerWaalsContact CG2-NE2 3.3Å
709	R	82.8	Confident	80.5	Confident	195 Å²	195	65.6 Å²	65.6	74%	0.736	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	1.9	-175.1	-58.5	176.8	-170.5	-167	-1	113.5	L705 C706 A707	L705-R709 WeakPolarHBondContact O-CD 3.47Å; L705-R709 WeakPolarHBondContact O-CG 3.38Å; L705-R709 PolarHBondContact O-NE 2.77Å; C706-R709 WeakPolarHBondContact O-CB 3.39Å; C706-R709 PolarHBondContact O-N 2.78Å; A707-R709 PolarHBondContact O-N 2.98Å
710	L	77.3	Confident	80.2	Confident	26 Å²	26	68 Å²	68	14%	0.136	35%	0.347	C	S	.	.			trans	-61.1	148.7	176.8	-66.2	174.5	0	0	0	111.2	A707 L714 Q715 A817 M818	A707-L710 WeakPolarHBondContact O-CG 3.41Å; A707-L710 PolarHBondContact O-N 3.14Å; L710-L714 HydrophobicContact CB-CD2 4.5Å; L710-L714 HydrophobicContact CD1-CD2 4.35Å; L710-Q715 WeakPolarHBondContact O-CG 3.45Å; L710-Q715 PolarHBondContact O-NE2 3.45Å; L710-A817 HydrophobicContact CD1-CB 4.31Å; L710-M818 HydrophobicContact CD1-SD 4.36Å; L710-M818 HydrophobicContact CD2-SD 3.79Å
711	G	68.9	Low	80.1	Confident	28 Å²	28	67.6 Å²	67.6	29%	0.289	35%	0.345	S	S	.	.			trans	-95.7	-156.2	-167.7	0	0	0	0	0	115	G713 L714	G711-G713 VanDerWaalsContact C-N 3.28Å; G711-G713 PolarHBondContact O-N 3.48Å; G711-G713 VanDerWaalsContact O-N 3.07Å; G711-L714 WeakPolarHBondContact O-CB 3.2Å; G711-L714 PolarHBondContact O-N 2.83Å
712	Y	67.9	Low	79.9	Confident	106 Å²	106	62.2 Å²	62.2	42%	0.416	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	36.5	163.7	-49.9	-72.8	0	0	0	116	L714 E825 A828	Y712-L714 PolarHBondContact O-N 3.07Å; Y712-E825 HydrophobicContact CD2-CB 4.13Å; Y712-E825 HydrophobicContact CE2-CB 3.77Å; Y712-E825 HydrophobicContact CE2-CG 3.95Å; Y712-A828 HydrophobicContact CD1-CB 3.84Å; Y712-A828 HydrophobicContact CE1-CB 3.94Å
713	G	68.1	Low	79.9	Confident	43 Å²	43	60.7 Å²	60.7	44%	0.443	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	-1.2	177.9	0	0	0	0	0	115.3	G711 Q715 I716	G711-G713 VanDerWaalsContact C-N 3.28Å; G711-G713 PolarHBondContact O-N 3.48Å; G711-G713 VanDerWaalsContact O-N 3.07Å; G713-Q715 PolarHBondContact O-N 3.02Å; G713-I716 PolarHBondContact O-N 3.22Å
714	L	73.8	Confident	80.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.9	-22.3	-178.2	-171.4	62.8	0	0	0	113	L710 G711 Y712 I716 D717 L718 E820 N821 F857	L710-L714 HydrophobicContact CB-CD2 4.5Å; L710-L714 HydrophobicContact CD1-CD2 4.35Å; G711-L714 WeakPolarHBondContact O-CB 3.2Å; G711-L714 PolarHBondContact O-N 2.83Å; Y712-L714 PolarHBondContact O-N 3.07Å; L714-I716 VanDerWaalsContact C-N 3.27Å; L714-I716 PolarHBondContact O-N 2.93Å; L714-D717 PolarHBondContact O-N 2.93Å; L714-L718 HydrophobicContact CD1-CD1 4.15Å; L714-L718 HydrophobicContact CD1-CG 3.97Å; L714-L718 HydrophobicContact CD2-CD1 3.83Å; L714-L718 HydrophobicContact CG-CD1 3.58Å; L714-L718 HydrophobicContact CG-CG 3.84Å; L714-L718 WeakPolarHBondContact O-CB 3.49Å; L714-L718 WeakPolarHBondContact O-CG 3.42Å; L714-L718 PolarHBondContact O-N 3.23Å; L714-E820 HydrophobicContact CD1-CG 3.7Å; L714-N821 HydrophobicContact CD2-CB 3.86Å; L714-F857 HydrophobicContact CD1-CE1 4.29Å
715	Q	68.9	Low	80.2	Confident	111 Å²	111	58.2 Å²	58.2	52%	0.519	31%	0.31	S	S	.	.	H	α-helix	trans	-56.8	-37.4	177.5	-60.4	179.7	-2.2	0	0	113.1	L710 G713 S719	L710-Q715 WeakPolarHBondContact O-CG 3.45Å; L710-Q715 PolarHBondContact O-NE2 3.45Å; G713-Q715 PolarHBondContact O-N 3.02Å; Q715-S719 WeakPolarHBondContact O-CB 3.49Å; Q715-S719 PolarHBondContact O-N 3.43Å; Q715-S719 VanDerWaalsContact O-N 3.16Å
716	I	72.6	Confident	80.3	Confident	133 Å²	133	58.4 Å²	58.4	68%	0.682	31%	0.309	S	S	*	.	H	α-helix	trans	-70.5	-52.1	-178.1	-59.3	173.4	0	0	0	109.1	G713 L714 L718 S719	G713-I716 PolarHBondContact O-N 3.22Å; L714-I716 VanDerWaalsContact C-N 3.27Å; L714-I716 PolarHBondContact O-N 2.93Å; I716-L718 PolarHBondContact O-N 3.29Å; I716-S719 WeakPolarHBondContact O-CB 3.42Å; I716-S719 PolarHBondContact O-N 3.02Å; I716-S719 PolarHBondContact O-OG 3.37Å
717	D	78.2	Confident	80.6	Confident	52 Å²	52	59 Å²	59	28%	0.278	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-40.2	-177.7	-54	-24.4	0	0	0	112.3	L714 R824 V858 L862	L714-D717 PolarHBondContact O-N 2.93Å; D717-R824 IonicContact OD2-CZ 3.21Å; D717-R824 IonicContact OD2-NH1 2.99Å; D717-R824 PolarHBondContact OD2-NH1 2.85Å; D717-R824 IonicContact OD2-NH2 2.73Å; D717-R824 PolarHBondContact OD2-NH2 3.49Å; D717-V858 HydrophobicContact CB-CG2 4.26Å; D717-L862 HydrophobicContact CB-CD1 4.33Å; D717-L862 WeakPolarHBondContact O-CD1 3.23Å
718	L	81.1	Confident	81	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-80.4	-17	-179.6	-67.1	-176.7	0	0	0	114.2	L714 I716 L720 V721 L722 F813 A817 F857 L862	L714-L718 HydrophobicContact CD1-CD1 4.15Å; L714-L718 HydrophobicContact CD1-CG 3.97Å; L714-L718 HydrophobicContact CD2-CD1 3.83Å; L714-L718 HydrophobicContact CG-CD1 3.58Å; L714-L718 HydrophobicContact CG-CG 3.84Å; L714-L718 WeakPolarHBondContact O-CB 3.49Å; L714-L718 WeakPolarHBondContact O-CG 3.42Å; L714-L718 PolarHBondContact O-N 3.23Å; I716-L718 PolarHBondContact O-N 3.29Å; L718-L720 VanDerWaalsContact C-N 3.3Å; L718-L720 PolarHBondContact O-N 3.4Å; L718-L720 VanDerWaalsContact O-N 3.14Å; L718-V721 PolarHBondContact O-N 3.01Å; L718-V721 VanDerWaalsContact O-N 3.08Å; L718-L722 VanDerWaalsContact O-CB 3.26Å; L718-L722 WeakPolarHBondContact O-CB 3.18Å; L718-L722 PolarHBondContact O-N 2.97Å; L718-F813 HydrophobicContact CD1-CZ 4.31Å; L718-F813 HydrophobicContact CD2-CE2 4Å; L718-F813 HydrophobicContact CD2-CZ 4.32Å; L718-A817 HydrophobicContact CD1-CB 3.94Å; L718-F857 HydrophobicContact CD2-CE1 4.43Å; L718-L862 HydrophobicContact CD2-CD1 4.26Å; L718-L862 HydrophobicContact CD2-CD2 3.62Å
719	S	84.1	Confident	81.5	Confident	66 Å²	66	56.5 Å²	56.5	46%	0.462	29%	0.291	S	S	.	.	H	α-helix	trans	-48.5	-46.7	-169.4	59.8	0	0	0	0	113.9	Q715 I716 H723	Q715-S719 WeakPolarHBondContact O-CB 3.49Å; Q715-S719 PolarHBondContact O-N 3.43Å; Q715-S719 VanDerWaalsContact O-N 3.16Å; I716-S719 WeakPolarHBondContact O-CB 3.42Å; I716-S719 PolarHBondContact O-N 3.02Å; I716-S719 PolarHBondContact O-OG 3.37Å; S719-H723 VanDerWaalsContact O-CB 3.26Å; S719-H723 WeakPolarHBondContact O-CB 3.4Å; S719-H723 PolarHBondContact O-N 3.26Å
720	L	84	Confident	81.9	Confident	96 Å²	96	49.8 Å²	49.8	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-68.9	-42.2	-178.4	-177	59	0	0	0	113.1	L718 L724	L718-L720 VanDerWaalsContact C-N 3.3Å; L718-L720 PolarHBondContact O-N 3.4Å; L718-L720 VanDerWaalsContact O-N 3.14Å; L720-L724 WeakPolarHBondContact O-CG 3.2Å; L720-L724 PolarHBondContact O-N 3.3Å; L720-L724 VanDerWaalsContact O-N 3.16Å
721	V	86.8	Confident	82.5	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.03	27%	0.274	C	S	.	.	H	α-helix	trans	-69	-44	178.6	-179.5	0	0	0	0	109.7	L718 L724 L725 F813 L862 Q866 I869	L718-V721 PolarHBondContact O-N 3.01Å; L718-V721 VanDerWaalsContact O-N 3.08Å; V721-L724 PolarHBondContact O-N 2.76Å; V721-L725 WeakPolarHBondContact O-CB 3.33Å; V721-L725 PolarHBondContact O-N 3.32Å; V721-F813 HydrophobicContact CB-CE2 4.19Å; V721-F813 HydrophobicContact CG1-CD2 3.8Å; V721-F813 HydrophobicContact CG1-CE2 3.58Å; V721-L862 HydrophobicContact CG2-CB 4.15Å; V721-L862 HydrophobicContact CG2-CD2 4.46Å; V721-Q866 HydrophobicContact CG2-CB 4.5Å; V721-I869 HydrophobicContact CG1-CD1 3.69Å
722	L	86.3	Confident	83.6	Confident	17 Å²	17	48 Å²	48	9%	0.089	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-41.1	177.8	-176.1	58.1	0	0	0	112.2	A707 T708 L718 L725 Q726 F813	A707-L722 HydrophobicContact CB-CD1 4.5Å; T708-L722 HydrophobicContact CG2-CD1 4.36Å; T708-L722 HydrophobicContact CG2-CD2 3.53Å; T708-L722 HydrophobicContact CG2-CG 4.17Å; L718-L722 VanDerWaalsContact O-CB 3.26Å; L718-L722 WeakPolarHBondContact O-CB 3.18Å; L718-L722 PolarHBondContact O-N 2.97Å; L722-L725 PolarHBondContact O-N 3.48Å; L722-Q726 WeakPolarHBondContact O-CB 3.46Å; L722-Q726 VanDerWaalsContact O-CG 3.24Å; L722-Q726 WeakPolarHBondContact O-CG 3.44Å; L722-Q726 PolarHBondContact O-N 3.35Å; L722-F813 HydrophobicContact CD1-CE1 4.45Å; L722-F813 HydrophobicContact CD1-CZ 4.5Å
723	H	89.4	Confident	84.7	Confident	108 Å²	108	45 Å²	45	50%	0.5	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-44.3	174.2	177.4	62.8	0	0	0	112.2	S719 L725 Q726 L727	S719-H723 VanDerWaalsContact O-CB 3.26Å; S719-H723 WeakPolarHBondContact O-CB 3.4Å; S719-H723 PolarHBondContact O-N 3.26Å; H723-L725 VanDerWaalsContact C-N 3.34Å; H723-L725 PolarHBondContact O-N 3.37Å; H723-Q726 PolarHBondContact O-N 3.43Å; H723-L727 WeakPolarHBondContact O-CB 3.35Å; H723-L727 PolarHBondContact O-N 3.43Å
724	L	90	Very high	85.8	Confident	34 Å²	34	45.9 Å²	45.9	18%	0.178	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-40.3	175.6	-71.7	166.8	0	0	0	112	L720 V721 L727 F728 Q866 I869	L720-L724 WeakPolarHBondContact O-CG 3.2Å; L720-L724 PolarHBondContact O-N 3.3Å; L720-L724 VanDerWaalsContact O-N 3.16Å; V721-L724 PolarHBondContact O-N 2.76Å; L724-L727 PolarHBondContact O-N 3.46Å; L724-F728 WeakPolarHBondContact O-CB 3.48Å; L724-F728 PolarHBondContact O-N 3.3Å; L724-Q866 HydrophobicContact CD1-CG 3.58Å; L724-I869 HydrophobicContact CB-CG2 4.21Å
725	L	88.8	Confident	86.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-39.5	177.2	-158.3	73	0	0	0	111.7	Q704 V721 L722 H723 G729 Y806 L809 H810 F813 I869	Q704-L725 PolarHBondContact NE2-O 2.97Å; V721-L725 WeakPolarHBondContact O-CB 3.33Å; V721-L725 PolarHBondContact O-N 3.32Å; L722-L725 PolarHBondContact O-N 3.48Å; H723-L725 VanDerWaalsContact C-N 3.34Å; H723-L725 PolarHBondContact O-N 3.37Å; L725-G729 PolarHBondContact O-N 3.06Å; L725-Y806 HydrophobicContact CD1-CE2 3.84Å; L725-Y806 HydrophobicContact CG-CE2 4.28Å; L725-Y806 PolarHBondContact O-OH 3.42Å; L725-L809 HydrophobicContact CD1-CD2 3.68Å; L725-H810 WeakPolarHBondContact CD2-CD2 3.36Å; L725-H810 WeakPolarHBondContact CD2-NE2 3.28Å; L725-F813 HydrophobicContact CD2-CD1 3.66Å; L725-F813 HydrophobicContact CD2-CE1 3.94Å; L725-F813 HydrophobicContact CD2-CG 4.07Å; L725-I869 HydrophobicContact CD1-CD1 3.88Å; L725-I869 HydrophobicContact CD1-CG1 4.13Å
726	Q	89.1	Confident	87.8	Confident	68 Å²	68	40.8 Å²	40.8	32%	0.318	22%	0.217	S	C	.	.	H	α-helix	trans	-68.6	-42.1	174.4	-75.4	172.1	-2.1	0	0	112.4	T708 L722 H723 G729 A730	T708-Q726 VanDerWaalsContact CG2-NE2 3.3Å; L722-Q726 WeakPolarHBondContact O-CB 3.46Å; L722-Q726 VanDerWaalsContact O-CG 3.24Å; L722-Q726 WeakPolarHBondContact O-CG 3.44Å; L722-Q726 PolarHBondContact O-N 3.35Å; H723-Q726 PolarHBondContact O-N 3.43Å; Q726-G729 PolarHBondContact O-N 3.08Å; Q726-A730 WeakPolarHBondContact O-CB 3.41Å; Q726-A730 PolarHBondContact O-N 3.21Å
727	L	90.8	Very high	88.7	Confident	89 Å²	89	38.2 Å²	38.2	47%	0.466	20%	0.202	S	C	.	.	H	α-helix	trans	-62	-47	176.7	-179.8	63.9	0	0	0	111	H723 L724 A730 E731	H723-L727 WeakPolarHBondContact O-CB 3.35Å; H723-L727 PolarHBondContact O-N 3.43Å; L724-L727 PolarHBondContact O-N 3.46Å; L727-A730 PolarHBondContact O-N 3.11Å; L727-E731 PolarHBondContact O-N 2.73Å
728	F	91	Very high	89.3	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-42.8	176.5	-175.5	-150.1	0	0	0	111.6	L724 A730 E731 I732 Y806 Q872 A873 Y876	L724-F728 WeakPolarHBondContact O-CB 3.48Å; L724-F728 PolarHBondContact O-N 3.3Å; F728-A730 VanDerWaalsContact C-N 3.3Å; F728-A730 PolarHBondContact O-N 2.86Å; F728-E731 PolarHBondContact O-N 3.4Å; F728-I732 HydrophobicContact CD2-CD1 4.01Å; F728-I732 HydrophobicContact CD2-CG1 4.11Å; F728-I732 HydrophobicContact CE1-CD1 4.23Å; F728-I732 HydrophobicContact CE2-CD1 3.66Å; F728-I732 HydrophobicContact CE2-CG1 3.87Å; F728-I732 HydrophobicContact CG-CD1 4.42Å; F728-I732 HydrophobicContact CZ-CD1 3.79Å; F728-I732 HydrophobicContact CZ-CG1 4.46Å; F728-I732 WeakPolarHBondContact O-CG1 3.19Å; F728-I732 PolarHBondContact O-N 2.79Å; F728-Y806 AromaticContact CD1-CD2 3.39Å; F728-Y806 HydrophobicContact CD1-CD2 3.39Å; F728-Y806 AromaticContact CD1-CE2 3.58Å; F728-Y806 HydrophobicContact CD1-CE2 3.58Å; F728-Y806 HydrophobicContact CD1-CG 4.32Å; F728-Y806 AromaticContact CE1-CD2 3.42Å; F728-Y806 HydrophobicContact CE1-CD2 3.42Å; F728-Y806 VanDerWaalsContact CE1-CD2 3.42Å; F728-Y806 HydrophobicContact CE1-CE2 4.11Å; F728-Y806 HydrophobicContact CE1-CG 4.03Å; F728-Y806 HydrophobicContact CG-CD2 4.39Å; F728-Y806 HydrophobicContact CG-CE2 4.29Å; F728-Y806 HydrophobicContact CZ-CD2 4.43Å; F728-Q872 HydrophobicContact CE1-CB 4.36Å; F728-Q872 HydrophobicContact CE1-CG 4.03Å; F728-Q872 HydrophobicContact CZ-CG 4.1Å; F728-A873 HydrophobicContact CD1-CB 4.35Å; F728-A873 HydrophobicContact CD2-CB 3.89Å; F728-A873 HydrophobicContact CE2-CB 4.08Å; F728-A873 HydrophobicContact CG-CB 4.05Å; F728-A873 HydrophobicContact CZ-CB 4.39Å; F728-Y876 AromaticContact CE2-CD1 3.9Å; F728-Y876 HydrophobicContact CE2-CD1 3.9Å; F728-Y876 HydrophobicContact CE2-CD2 4.4Å; F728-Y876 AromaticContact CE2-CG 3.73Å; F728-Y876 HydrophobicContact CE2-CG 3.73Å; F728-Y876 HydrophobicContact CZ-CG 4.32Å
729	G	91.7	Very high	89.8	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-31.7	174.4	0	0	0	0	0	114.3	L725 Q726 R733 Y806	L725-G729 PolarHBondContact O-N 3.06Å; Q726-G729 PolarHBondContact O-N 3.08Å; G729-R733 WeakPolarHBondContact O-CB 3.3Å; G729-R733 PolarHBondContact O-N 3.49Å; G729-Y806 VanDerWaalsContact CA-OH 3.24Å; G729-Y806 WeakPolarHBondContact CA-OH 3.2Å
730	A	90.4	Very high	90.1	Very high	54 Å²	54	36.2 Å²	36.2	45%	0.446	18%	0.183	S	C	.	.	H	α-helix	trans	-71.8	-40.2	174.3	0	0	0	0	0	111.9	Q726 L727 F728 R733 H734	Q726-A730 WeakPolarHBondContact O-CB 3.41Å; Q726-A730 PolarHBondContact O-N 3.21Å; L727-A730 PolarHBondContact O-N 3.11Å; F728-A730 VanDerWaalsContact C-N 3.3Å; F728-A730 PolarHBondContact O-N 2.86Å; A730-R733 PolarHBondContact O-N 3.18Å; A730-H734 WeakPolarHBondContact O-CB 3.3Å; A730-H734 PolarHBondContact O-N 3.37Å
731	E	90.3	Very high	90.4	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.075	18%	0.183	C	C	.	.	H	α-helix	trans	-62.2	-46.3	176	-165.8	179.5	151.1	0	0	111.7	L727 F728 F735 Y876 R877	L727-E731 PolarHBondContact O-N 2.73Å; F728-E731 PolarHBondContact O-N 3.4Å; E731-F735 PolarHBondContact O-N 3.09Å; E731-Y876 HydrophobicContact CG-CE1 4.08Å; E731-R877 WeakPolarHBondContact OE1-CG 3.31Å; E731-R877 IonicContact OE1-NE 3.93Å; E731-R877 PolarHBondContact OE1-NE 3.23Å; E731-R877 VanDerWaalsContact OE1-NE 3.07Å; E731-R877 IonicContact OE2-CZ 2.71Å; E731-R877 IonicContact OE2-NE 3.71Å; E731-R877 PolarHBondContact OE2-NE 3.38Å; E731-R877 IonicContact OE2-NH2 3.99Å; E731-R877 PolarHBondContact OE2-NH2 3.19Å
732	I	92.2	Very high	90.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.1	-44.8	174.9	-58.6	169	0	0	0	111.1	L697 F728 H734 F735 I736 I803 Y806 Y876	L697-I732 HydrophobicContact CD1-CG2 3.56Å; L697-I732 HydrophobicContact CD2-CB 4.14Å; L697-I732 HydrophobicContact CD2-CG2 3.69Å; L697-I732 HydrophobicContact CG-CG2 4.25Å; F728-I732 HydrophobicContact CD2-CD1 4.01Å; F728-I732 HydrophobicContact CD2-CG1 4.11Å; F728-I732 HydrophobicContact CE1-CD1 4.23Å; F728-I732 HydrophobicContact CE2-CD1 3.66Å; F728-I732 HydrophobicContact CE2-CG1 3.87Å; F728-I732 HydrophobicContact CG-CD1 4.42Å; F728-I732 HydrophobicContact CZ-CD1 3.79Å; F728-I732 HydrophobicContact CZ-CG1 4.46Å; F728-I732 WeakPolarHBondContact O-CG1 3.19Å; F728-I732 PolarHBondContact O-N 2.79Å; I732-H734 VanDerWaalsContact C-N 3.32Å; I732-H734 PolarHBondContact O-N 3.43Å; I732-F735 PolarHBondContact O-N 2.91Å; I732-I736 HydrophobicContact CG2-CG1 4.36Å; I732-I736 PolarHBondContact O-N 3.43Å; I732-I803 HydrophobicContact CG2-CD1 3.56Å; I732-I803 HydrophobicContact CG2-CG1 3.58Å; I732-I803 HydrophobicContact CG2-CG2 4.3Å; I732-Y806 HydrophobicContact CD1-CD1 3.73Å; I732-Y806 HydrophobicContact CD1-CD2 4.39Å; I732-Y806 HydrophobicContact CD1-CE1 4.16Å; I732-Y806 HydrophobicContact CD1-CG 3.84Å; I732-Y876 HydrophobicContact CG1-CD2 4.23Å; I732-Y876 HydrophobicContact CG1-CE1 4.26Å; I732-Y876 HydrophobicContact CG1-CE2 3.83Å
733	R	91.6	Very high	90.7	Very high	43 Å²	43	37.1 Å²	37.1	16%	0.162	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-42.5	179.7	-176.8	-178.4	-52.2	-73.9	-30.1	111.5	L697 G729 A730 I736 Q737	L697-R733 PolarHBondContact O-NH2 2.94Å; G729-R733 WeakPolarHBondContact O-CB 3.3Å; G729-R733 PolarHBondContact O-N 3.49Å; A730-R733 PolarHBondContact O-N 3.18Å; R733-I736 PolarHBondContact O-N 3.16Å; R733-Q737 HydrophobicContact CG-CG 4.27Å; R733-Q737 VanDerWaalsContact O-CB 3.31Å; R733-Q737 WeakPolarHBondContact O-CB 3.3Å; R733-Q737 VanDerWaalsContact O-CG 3.23Å; R733-Q737 WeakPolarHBondContact O-CG 3.38Å; R733-Q737 PolarHBondContact O-N 3.44Å
734	H	91	Very high	90.7	Very high	62 Å²	62	35.6 Å²	35.6	29%	0.287	18%	0.175	S	C	.	.	H	α-helix	trans	-58.6	-49.3	176	176.2	70.6	0	0	0	111.2	A730 I732 I736 Q737 Q738	A730-H734 WeakPolarHBondContact O-CB 3.3Å; A730-H734 PolarHBondContact O-N 3.37Å; I732-H734 VanDerWaalsContact C-N 3.32Å; I732-H734 PolarHBondContact O-N 3.43Å; H734-I736 PolarHBondContact O-N 3Å; H734-Q737 PolarHBondContact O-N 2.89Å; H734-Q738 WeakPolarHBondContact O-CG 3.5Å; H734-Q738 PolarHBondContact O-N 3.4Å
735	F	91.8	Very high	90.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.2	-50.5	176.7	170.2	-102.5	0	0	0	112.7	E731 I732 Q737 Q738 L739 L796 I799 Y876 L880 F883 I902	E731-F735 PolarHBondContact O-N 3.09Å; I732-F735 PolarHBondContact O-N 2.91Å; F735-Q737 VanDerWaalsContact C-N 3.32Å; F735-Q737 PolarHBondContact O-N 3.27Å; F735-Q738 PolarHBondContact O-N 3.41Å; F735-L739 HydrophobicContact CE1-CD2 4.37Å; F735-L739 HydrophobicContact CZ-CD2 4.41Å; F735-L739 WeakPolarHBondContact O-CB 3.25Å; F735-L739 PolarHBondContact O-N 2.83Å; F735-L796 HydrophobicContact CE1-CD1 4.19Å; F735-L796 HydrophobicContact CZ-CD1 3.82Å; F735-I799 HydrophobicContact CD1-CG2 4.15Å; F735-I799 HydrophobicContact CE1-CG2 3.59Å; F735-I799 HydrophobicContact CZ-CD1 4.08Å; F735-I799 HydrophobicContact CZ-CG2 4.12Å; F735-Y876 VanDerWaalsContact CB-OH 3.22Å; F735-Y876 WeakPolarHBondContact CB-OH 3.28Å; F735-L880 HydrophobicContact CD2-CD1 3.51Å; F735-L880 HydrophobicContact CE2-CD1 3.66Å; F735-L880 HydrophobicContact CG-CD1 4.31Å; F735-F883 HydrophobicContact CE2-CD1 4.02Å; F735-F883 AromaticContact CE2-CE1 3.87Å; F735-F883 HydrophobicContact CE2-CE1 3.87Å; F735-F883 HydrophobicContact CZ-CD1 4.37Å; F735-F883 HydrophobicContact CZ-CE1 4.08Å; F735-I902 HydrophobicContact CD2-CD1 4.08Å; F735-I902 HydrophobicContact CD2-CG1 4.27Å; F735-I902 HydrophobicContact CD2-CG2 4.33Å; F735-I902 HydrophobicContact CE2-CD1 3.85Å
736	I	92.7	Very high	90.5	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.015	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-36	-179.8	-66.8	-62.5	0	0	0	111.8	M693 E694 L697 I732 R733 H734 L739 Q740 F800 I803	M693-I736 HydrophobicContact CB-CD1 4.24Å; E694-I736 HydrophobicContact CB-CG2 3.77Å; E694-I736 HydrophobicContact CG-CG2 4.35Å; L697-I736 HydrophobicContact CD1-CB 4.21Å; L697-I736 HydrophobicContact CD1-CG1 3.73Å; I732-I736 HydrophobicContact CG2-CG1 4.36Å; I732-I736 PolarHBondContact O-N 3.43Å; R733-I736 PolarHBondContact O-N 3.16Å; H734-I736 PolarHBondContact O-N 3Å; I736-L739 HydrophobicContact CD1-CD2 4.46Å; I736-L739 PolarHBondContact O-N 2.75Å; I736-Q740 WeakPolarHBondContact O-CB 3.46Å; I736-Q740 WeakPolarHBondContact O-CG 3.34Å; I736-Q740 PolarHBondContact O-N 3.28Å; I736-F800 HydrophobicContact CD1-CD1 4.44Å; I736-F800 HydrophobicContact CD1-CE1 3.92Å; I736-I803 HydrophobicContact CD1-CD1 3.79Å; I736-I803 HydrophobicContact CG1-CD1 3.94Å
737	Q	91.7	Very high	90.5	Very high	79 Å²	79	39.3 Å²	39.3	37%	0.369	19%	0.19	S	C	.	.	H	α-helix	trans	-63.4	-49.2	173.7	-77	173.6	-21.8	0	0	111.6	R733 H734 F735 L739 Q740 Y741	R733-Q737 HydrophobicContact CG-CG 4.27Å; R733-Q737 VanDerWaalsContact O-CB 3.31Å; R733-Q737 WeakPolarHBondContact O-CB 3.3Å; R733-Q737 VanDerWaalsContact O-CG 3.23Å; R733-Q737 WeakPolarHBondContact O-CG 3.38Å; R733-Q737 PolarHBondContact O-N 3.44Å; H734-Q737 PolarHBondContact O-N 2.89Å; F735-Q737 VanDerWaalsContact C-N 3.32Å; F735-Q737 PolarHBondContact O-N 3.27Å; Q737-L739 VanDerWaalsContact C-N 3.31Å; Q737-L739 PolarHBondContact O-N 3.02Å; Q737-Q740 PolarHBondContact O-N 2.95Å; Q737-Y741 HydrophobicContact CB-CD2 4.42Å; Q737-Y741 HydrophobicContact CB-CE2 4.16Å; Q737-Y741 WeakPolarHBondContact O-CD2 3.38Å; Q737-Y741 PolarHBondContact O-N 2.69Å
738	Q	91.4	Very high	90.4	Very high	35 Å²	35	35.9 Å²	35.9	16%	0.164	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-39.6	177.5	-61.5	-44	-51.1	0	0	112.1	H734 F735 Q740 Y741 Y742 I902	H734-Q738 WeakPolarHBondContact O-CG 3.5Å; H734-Q738 PolarHBondContact O-N 3.4Å; F735-Q738 PolarHBondContact O-N 3.41Å; Q738-Q740 PolarHBondContact O-N 3.11Å; Q738-Y741 PolarHBondContact O-N 3.13Å; Q738-Y742 WeakPolarHBondContact O-CB 3.34Å; Q738-Y742 PolarHBondContact O-N 2.7Å; Q738-I902 HydrophobicContact CB-CG1 4.27Å
739	L	90.6	Very high	90.4	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-42.1	174.5	-177.6	62.6	0	0	0	112.1	F735 I736 Q737 I743 L796 F800 L898	F735-L739 HydrophobicContact CE1-CD2 4.37Å; F735-L739 HydrophobicContact CZ-CD2 4.41Å; F735-L739 WeakPolarHBondContact O-CB 3.25Å; F735-L739 PolarHBondContact O-N 2.83Å; I736-L739 HydrophobicContact CD1-CD2 4.46Å; I736-L739 PolarHBondContact O-N 2.75Å; Q737-L739 VanDerWaalsContact C-N 3.31Å; Q737-L739 PolarHBondContact O-N 3.02Å; L739-I743 HydrophobicContact CD1-CD1 4.11Å; L739-I743 HydrophobicContact CG-CD1 3.98Å; L739-I743 WeakPolarHBondContact O-CB 3.46Å; L739-I743 VanDerWaalsContact O-CG1 3.25Å; L739-I743 WeakPolarHBondContact O-CG1 3.41Å; L739-I743 PolarHBondContact O-N 3.5Å; L739-L796 HydrophobicContact CD2-CD1 4.16Å; L739-F800 HydrophobicContact CD2-CE1 4.24Å; L739-F800 HydrophobicContact CD2-CZ 4.24Å; L739-L898 HydrophobicContact CD1-CD1 4.38Å; L739-L898 HydrophobicContact CD1-CD2 4.22Å
740	Q	90.1	Very high	90.3	Very high	41 Å²	41	41.3 Å²	41.3	19%	0.192	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-38.6	175.4	-76.3	-175.9	-14.9	0	0	112.9	I736 Q737 Q738 I743 N744	I736-Q740 WeakPolarHBondContact O-CB 3.46Å; I736-Q740 WeakPolarHBondContact O-CG 3.34Å; I736-Q740 PolarHBondContact O-N 3.28Å; Q737-Q740 PolarHBondContact O-N 2.95Å; Q738-Q740 PolarHBondContact O-N 3.11Å; Q740-I743 PolarHBondContact O-N 3.17Å; Q740-N744 WeakPolarHBondContact O-CB 3.48Å; Q740-N744 VanDerWaalsContact O-CG 3.31Å; Q740-N744 PolarHBondContact O-N 3.39Å; Q740-N744 PolarHBondContact O-ND2 3.43Å
741	Y	89.7	Confident	90.3	Very high	127 Å²	127	38.8 Å²	38.8	50%	0.498	18%	0.181	S	C	.	.	H	α-helix	trans	-61	-46.9	174.3	-75.5	-59.9	0	0	0	111.2	Q737 Q738 N744 F745	Q737-Y741 HydrophobicContact CB-CD2 4.42Å; Q737-Y741 HydrophobicContact CB-CE2 4.16Å; Q737-Y741 WeakPolarHBondContact O-CD2 3.38Å; Q737-Y741 PolarHBondContact O-N 2.69Å; Q738-Y741 PolarHBondContact O-N 3.13Å; Y741-N744 PolarHBondContact O-N 2.88Å; Y741-F745 HydrophobicContact CD1-CD2 4.02Å; Y741-F745 AromaticContact CD1-CE2 3.77Å; Y741-F745 HydrophobicContact CD1-CE2 3.77Å; Y741-F745 HydrophobicContact CE1-CE2 4.29Å; Y741-F745 WeakPolarHBondContact O-CB 3.4Å; Y741-F745 WeakPolarHBondContact O-CD2 3.42Å; Y741-F745 PolarHBondContact O-N 2.81Å
742	Y	91	Very high	90.4	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.016	19%	0.185	C	C	.	.	I	π-helix	trans	-57.5	-52.1	174.4	172.7	-103.6	0	0	0	112.2	Q738 N744 E746 V747 S894 L895 L898	Q738-Y742 WeakPolarHBondContact O-CB 3.34Å; Q738-Y742 PolarHBondContact O-N 2.7Å; Y742-N744 PolarHBondContact O-N 3.28Å; Y742-E746 HydrophobicContact CD2-CB 3.75Å; Y742-E746 HydrophobicContact CD2-CG 4.04Å; Y742-E746 HydrophobicContact CE2-CB 3.94Å; Y742-E746 WeakPolarHBondContact O-CA 3.28Å; Y742-E746 WeakPolarHBondContact O-CB 3.45Å; Y742-E746 PolarHBondContact O-N 2.89Å; Y742-V747 HydrophobicContact CD1-CG2 4.06Å; Y742-V747 HydrophobicContact CE1-CG2 3.56Å; Y742-V747 HydrophobicContact CE2-CG2 4.29Å; Y742-V747 PolarHBondContact O-N 3.27Å; Y742-V747 VanDerWaalsContact O-N 3.13Å; Y742-S894 WeakPolarHBondContact CE2-O 3.25Å; Y742-L895 HydrophobicContact CE1-CD2 4.4Å; Y742-L898 HydrophobicContact CD1-CB 4.44Å; Y742-L898 HydrophobicContact CD1-CD1 4.14Å; Y742-L898 HydrophobicContact CD1-CD2 4.05Å; Y742-L898 HydrophobicContact CD1-CG 4.44Å; Y742-L898 HydrophobicContact CD2-CB 4.01Å; Y742-L898 HydrophobicContact CD2-CD1 4.49Å; Y742-L898 HydrophobicContact CE1-CD2 4.21Å; Y742-L898 HydrophobicContact CE2-CB 4.17Å; Y742-L898 HydrophobicContact CG-CB 4.15Å; Y742-L898 HydrophobicContact CG-CD1 3.87Å; Y742-L898 HydrophobicContact CG-CD2 4.48Å; Y742-L898 HydrophobicContact CG-CG 4.38Å
743	I	90	Very high	90.4	Very high	6 Å²	6	45 Å²	45	3%	0.031	21%	0.208	C	C	.	.	I	π-helix	trans	-59.4	-47	-179.4	-73.1	168	0	0	0	111.5	F686 L687 L739 Q740 V747 L748	F686-I743 HydrophobicContact CE1-CD1 3.75Å; F686-I743 HydrophobicContact CE1-CG1 4.49Å; F686-I743 HydrophobicContact CZ-CD1 4.27Å; L687-I743 HydrophobicContact CD2-CD1 4.46Å; L687-I743 HydrophobicContact CD2-CG2 3.37Å; L739-I743 HydrophobicContact CD1-CD1 4.11Å; L739-I743 HydrophobicContact CG-CD1 3.98Å; L739-I743 WeakPolarHBondContact O-CB 3.46Å; L739-I743 VanDerWaalsContact O-CG1 3.25Å; L739-I743 WeakPolarHBondContact O-CG1 3.41Å; L739-I743 PolarHBondContact O-N 3.5Å; Q740-I743 PolarHBondContact O-N 3.17Å; I743-V747 WeakPolarHBondContact O-CB 3.43Å; I743-L748 HydrophobicContact CG2-CD1 4.02Å; I743-L748 HydrophobicContact CG2-CG 4.47Å; I743-L748 WeakPolarHBondContact O-CG 3.49Å; I743-L748 PolarHBondContact O-N 2.85Å
744	N	88.3	Confident	90.5	Very high	76 Å²	76	46.7 Å²	46.7	41%	0.406	22%	0.22	S	C	.	.	I	π-helix	trans	-71.5	-52.9	-175.7	-69.4	-17.5	0	0	0	111.6	Q740 Y741 Y742 L748 E749	Q740-N744 WeakPolarHBondContact O-CB 3.48Å; Q740-N744 VanDerWaalsContact O-CG 3.31Å; Q740-N744 PolarHBondContact O-N 3.39Å; Q740-N744 PolarHBondContact O-ND2 3.43Å; Y741-N744 PolarHBondContact O-N 2.88Å; Y742-N744 PolarHBondContact O-N 3.28Å; N744-L748 PolarHBondContact O-N 3.13Å; N744-E749 WeakPolarHBondContact O-CG 3.16Å; N744-E749 PolarHBondContact O-N 3.42Å
745	F	87.5	Confident	90.5	Very high	115 Å²	115	43.9 Å²	43.9	50%	0.504	21%	0.207	S	C	.	.	I	π-helix	trans	-86.7	-50.9	-170.1	-64.8	-78.4	0	0	0	112.9	Y741 E749 C750	Y741-F745 HydrophobicContact CD1-CD2 4.02Å; Y741-F745 AromaticContact CD1-CE2 3.77Å; Y741-F745 HydrophobicContact CD1-CE2 3.77Å; Y741-F745 HydrophobicContact CE1-CE2 4.29Å; Y741-F745 WeakPolarHBondContact O-CB 3.4Å; Y741-F745 WeakPolarHBondContact O-CD2 3.42Å; Y741-F745 PolarHBondContact O-N 2.81Å; F745-E749 HydrophobicContact CD1-CG 4.47Å; F745-C750 PolarHBondContact O-N 2.97Å; F745-C750 PolarHBondContact O-SG 3.37Å; F745-C750 VanDerWaalsContact O-SG 3.33Å
746	E	87.2	Confident	90.5	Very high	66 Å²	66	46.2 Å²	46.2	31%	0.308	22%	0.222	S	C	.	.	I	π-helix	trans	-79.4	-28.6	-175.6	-63.4	-61.1	141.8	0	0	113.3	Y742 R782	Y742-E746 HydrophobicContact CD2-CB 3.75Å; Y742-E746 HydrophobicContact CD2-CG 4.04Å; Y742-E746 HydrophobicContact CE2-CB 3.94Å; Y742-E746 WeakPolarHBondContact O-CA 3.28Å; Y742-E746 WeakPolarHBondContact O-CB 3.45Å; Y742-E746 PolarHBondContact O-N 2.89Å; E746-R782 PolarHBondContact O-NH1 2.69Å
747	V	89.4	Confident	90.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-97.5	-64.3	-179.8	-174.5	0	0	0	0	111.5	Y742 I743 A751 V779 R782	Y742-V747 HydrophobicContact CD1-CG2 4.06Å; Y742-V747 HydrophobicContact CE1-CG2 3.56Å; Y742-V747 HydrophobicContact CE2-CG2 4.29Å; Y742-V747 PolarHBondContact O-N 3.27Å; Y742-V747 VanDerWaalsContact O-N 3.13Å; I743-V747 WeakPolarHBondContact O-CB 3.43Å; V747-A751 WeakPolarHBondContact O-CB 3.36Å; V747-A751 PolarHBondContact O-N 2.68Å; V747-V779 HydrophobicContact CG1-CG1 4.44Å; V747-V779 HydrophobicContact CG1-CG2 4.46Å; V747-R782 HydrophobicContact CB-CB 4.18Å; V747-R782 HydrophobicContact CG1-CB 3.62Å; V747-R782 HydrophobicContact CG1-CG 4.49Å; V747-R782 HydrophobicContact CG2-CB 3.58Å; V747-R782 HydrophobicContact CG2-CG 4.4Å
748	L	89.6	Confident	90.4	Very high	17 Å²	17	52 Å²	52	9%	0.089	25%	0.247	C	C	.	.	I	π-helix	trans	-75.1	-49.3	-169.1	-66.4	173.1	0	0	0	113	L586 I743 N744 W752 V779	L586-L748 HydrophobicContact CB-CD2 4.31Å; L586-L748 HydrophobicContact CD1-CD2 4.08Å; L586-L748 HydrophobicContact CD2-CD2 4.37Å; L586-L748 HydrophobicContact CG-CD2 4.5Å; I743-L748 HydrophobicContact CG2-CD1 4.02Å; I743-L748 HydrophobicContact CG2-CG 4.47Å; I743-L748 WeakPolarHBondContact O-CG 3.49Å; I743-L748 PolarHBondContact O-N 2.85Å; N744-L748 PolarHBondContact O-N 3.13Å; L748-W752 WeakPolarHBondContact O-CB 3.48Å; L748-W752 PolarHBondContact O-N 2.92Å; L748-V779 HydrophobicContact CD2-CG1 4.08Å; L748-V779 HydrophobicContact CD2-CG2 4.27Å
749	E	90.2	Very high	90.3	Very high	76 Å²	76	50.8 Å²	50.8	36%	0.355	24%	0.241	S	C	.	.	I	π-helix	trans	-66.1	-50.1	-179.6	-68	-66.8	-179.6	0	0	112.2	R582 N744 F745 A751 W752 E753	R582-E749 IonicContact CZ-OE1 2.86Å; R582-E749 IonicContact CZ-OE2 2.9Å; R582-E749 IonicContact NH1-OE1 3.67Å; R582-E749 IonicContact NH1-OE2 2.69Å; R582-E749 PolarHBondContact NH1-OE2 3.29Å; R582-E749 IonicContact NH2-OE1 3.82Å; R582-E749 PolarHBondContact NH2-OE1 2.98Å; R582-E749 IonicContact NH2-OE2 2.63Å; R582-E749 PolarHBondContact NH2-OE2 2.81Å; R582-E749 VanDerWaalsContact NH2-OE2 3.13Å; N744-E749 WeakPolarHBondContact O-CG 3.16Å; N744-E749 PolarHBondContact O-N 3.42Å; F745-E749 HydrophobicContact CD1-CG 4.47Å; E749-A751 VanDerWaalsContact C-N 3.32Å; E749-A751 PolarHBondContact O-N 3.13Å; E749-W752 PolarHBondContact O-N 3.48Å; E749-W752 VanDerWaalsContact O-N 3.15Å; E749-E753 PolarHBondContact O-N 3.49Å
750	C	90	Very high	90.1	Very high	43 Å²	43	57.1 Å²	57.1	29%	0.291	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-38.3	178.4	-65.9	0	0	0	0	113.1	F745 N754	F745-C750 PolarHBondContact O-N 2.97Å; F745-C750 PolarHBondContact O-SG 3.37Å; F745-C750 VanDerWaalsContact O-SG 3.33Å; C750-N754 PolarHBondContact O-N 2.95Å; C750-N754 PolarHBondContact O-ND2 3.35Å
751	A	90.8	Very high	90	Very high	2 Å²	2	59.5 Å²	59.5	2%	0.017	29%	0.292	C	S	.	.	H	α-helix	trans	-69.2	-40.5	175.4	0	0	0	0	0	111.3	V747 E749 N754 L755 F775 V779	V747-A751 WeakPolarHBondContact O-CB 3.36Å; V747-A751 PolarHBondContact O-N 2.68Å; E749-A751 VanDerWaalsContact C-N 3.32Å; E749-A751 PolarHBondContact O-N 3.13Å; A751-N754 PolarHBondContact O-N 3.22Å; A751-L755 PolarHBondContact O-N 3.33Å; A751-F775 HydrophobicContact CB-CD2 3.63Å; A751-F775 HydrophobicContact CB-CE2 3.73Å; A751-F775 WeakPolarHBondContact O-CD2 3.44Å; A751-V779 HydrophobicContact CB-CG2 3.92Å
752	W	92.7	Very high	89.8	Confident	44 Å²	44	54 Å²	54	17%	0.167	27%	0.273	C	S	.	.	H	α-helix	trans	-66	-43.9	178.8	179.7	-97.4	0	0	0	112.9	L578 R582 L748 E749 N754 L755 V756 F775	L578-W752 HydrophobicContact CB-CH2 4.07Å; L578-W752 HydrophobicContact CB-CZ3 4.46Å; R582-W752 HydrophobicContact CB-CE3 4.14Å; R582-W752 HydrophobicContact CB-CH2 4.24Å; R582-W752 HydrophobicContact CB-CZ3 3.88Å; R582-W752 VanDerWaalsContact CD-CD2 3.43Å; R582-W752 HydrophobicContact CG-CE3 4.31Å; L748-W752 WeakPolarHBondContact O-CB 3.48Å; L748-W752 PolarHBondContact O-N 2.92Å; E749-W752 PolarHBondContact O-N 3.48Å; E749-W752 VanDerWaalsContact O-N 3.15Å; W752-N754 VanDerWaalsContact C-N 3.27Å; W752-N754 PolarHBondContact O-N 3.42Å; W752-L755 HydrophobicContact CE3-CD2 4.05Å; W752-L755 HydrophobicContact CZ3-CD2 4.05Å; W752-L755 WeakPolarHBondContact O-CB 3.44Å; W752-L755 PolarHBondContact O-N 3.43Å; W752-L755 VanDerWaalsContact O-N 3.16Å; W752-V756 HydrophobicContact CD2-CG2 4.12Å; W752-V756 HydrophobicContact CG-CG2 4.31Å; W752-V756 HydrophobicContact CZ2-CG2 3.95Å; W752-V756 WeakPolarHBondContact O-CG2 3.38Å; W752-V756 PolarHBondContact O-N 2.86Å; W752-F775 HydrophobicContact CB-CE2 4.41Å; W752-F775 HydrophobicContact CE3-CE2 4.48Å; W752-F775 HydrophobicContact CE3-CZ 4.45Å
753	E	92.3	Very high	89.4	Confident	103 Å²	103	58.1 Å²	58.1	48%	0.481	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-41.1	177.4	-166.1	-168.6	160.5	0	0	111.1	E749 V756 K757	E749-E753 PolarHBondContact O-N 3.49Å; E753-V756 PolarHBondContact O-N 3.04Å; E753-K757 HydrophobicContact CG-CD 4.34Å; E753-K757 WeakPolarHBondContact O-CB 3.33Å; E753-K757 VanDerWaalsContact O-CG 3.3Å; E753-K757 WeakPolarHBondContact O-CG 3.47Å; E753-K757 PolarHBondContact O-N 3.21Å; E753-K757 VanDerWaalsContact OE1-CE 3.25Å; E753-K757 WeakPolarHBondContact OE1-CE 3.4Å; E753-K757 IonicContact OE1-NZ 3.14Å; E753-K757 PolarHBondContact OE1-NZ 2.99Å
754	N	92.3	Very high	89.2	Confident	77 Å²	77	58.9 Å²	58.9	41%	0.412	30%	0.296	S	S	.	.	H	α-helix	trans	-65.8	-42.7	174.7	-72.6	-33.1	0	0	0	112.3	C750 A751 W752 K757 Q758	C750-N754 PolarHBondContact O-N 2.95Å; C750-N754 PolarHBondContact O-ND2 3.35Å; A751-N754 PolarHBondContact O-N 3.22Å; W752-N754 VanDerWaalsContact C-N 3.27Å; W752-N754 PolarHBondContact O-N 3.42Å; N754-K757 PolarHBondContact O-N 3.13Å; N754-Q758 WeakPolarHBondContact O-CB 3.47Å; N754-Q758 VanDerWaalsContact O-CG 3.31Å; N754-Q758 WeakPolarHBondContact O-CG 3.49Å; N754-Q758 PolarHBondContact O-N 2.95Å
755	L	92.1	Very high	89.1	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-49.2	174.5	177.9	64.7	0	0	0	111.1	A751 W752 K757 Q758 V759 A771 F775	A751-L755 PolarHBondContact O-N 3.33Å; W752-L755 HydrophobicContact CE3-CD2 4.05Å; W752-L755 HydrophobicContact CZ3-CD2 4.05Å; W752-L755 WeakPolarHBondContact O-CB 3.44Å; W752-L755 PolarHBondContact O-N 3.43Å; W752-L755 VanDerWaalsContact O-N 3.16Å; L755-K757 PolarHBondContact O-N 2.6Å; L755-Q758 PolarHBondContact O-N 2.92Å; L755-V759 HydrophobicContact CD1-CG2 3.92Å; L755-V759 HydrophobicContact CG-CG2 4.26Å; L755-V759 WeakPolarHBondContact O-CB 3.48Å; L755-V759 VanDerWaalsContact O-CG2 3.3Å; L755-V759 WeakPolarHBondContact O-CG2 3.2Å; L755-V759 PolarHBondContact O-N 3.05Å; L755-A771 HydrophobicContact CD1-CB 4.1Å; L755-F775 HydrophobicContact CB-CB 4.15Å; L755-F775 HydrophobicContact CB-CD2 4.01Å; L755-F775 HydrophobicContact CB-CG 4.21Å; L755-F775 HydrophobicContact CD1-CB 4.04Å; L755-F775 HydrophobicContact CD2-CB 4.2Å; L755-F775 HydrophobicContact CD2-CD1 3.99Å; L755-F775 HydrophobicContact CD2-CD2 4.07Å; L755-F775 HydrophobicContact CD2-CE1 4.43Å; L755-F775 HydrophobicContact CD2-CE2 4.5Å; L755-F775 HydrophobicContact CD2-CG 3.81Å; L755-F775 HydrophobicContact CG-CB 4.35Å; L755-F775 HydrophobicContact CG-CG 4.41Å
756	V	91.3	Very high	89.1	Confident	49 Å²	49	51.3 Å²	51.3	30%	0.297	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-45.1	-179.4	170.8	0	0	0	0	110.8	W752 E753 Q758 V759 H760	W752-V756 HydrophobicContact CD2-CG2 4.12Å; W752-V756 HydrophobicContact CG-CG2 4.31Å; W752-V756 HydrophobicContact CZ2-CG2 3.95Å; W752-V756 WeakPolarHBondContact O-CG2 3.38Å; W752-V756 PolarHBondContact O-N 2.86Å; E753-V756 PolarHBondContact O-N 3.04Å; V756-Q758 PolarHBondContact O-N 3.06Å; V756-V759 PolarHBondContact O-N 3.19Å; V756-H760 PolarHBondContact O-N 3.18Å; V756-H760 VanDerWaalsContact O-N 3.07Å; V756-H760 PolarHBondContact O-ND1 3.01Å
757	K	92	Very high	89.1	Confident	117 Å²	117	51.2 Å²	51.2	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-47.6	174.3	-76.2	166.6	172.4	170.4	0	111.7	E753 N754 L755 H760 S761	E753-K757 HydrophobicContact CG-CD 4.34Å; E753-K757 WeakPolarHBondContact O-CB 3.33Å; E753-K757 VanDerWaalsContact O-CG 3.3Å; E753-K757 WeakPolarHBondContact O-CG 3.47Å; E753-K757 PolarHBondContact O-N 3.21Å; E753-K757 VanDerWaalsContact OE1-CE 3.25Å; E753-K757 WeakPolarHBondContact OE1-CE 3.4Å; E753-K757 IonicContact OE1-NZ 3.14Å; E753-K757 PolarHBondContact OE1-NZ 2.99Å; N754-K757 PolarHBondContact O-N 3.13Å; L755-K757 PolarHBondContact O-N 2.6Å; K757-H760 PolarHBondContact O-N 3.14Å; K757-S761 WeakPolarHBondContact O-CB 3.38Å; K757-S761 PolarHBondContact O-N 3Å; K757-S761 VanDerWaalsContact O-N 3.09Å; K757-S761 PolarHBondContact O-OG 3.34Å
758	Q	90.7	Very high	89.1	Confident	87 Å²	87	51.3 Å²	51.3	41%	0.407	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-43.9	-179.9	-74.1	177	3.8	0	0	112.4	N754 L755 V756 H760 S761 A762 A771	N754-Q758 WeakPolarHBondContact O-CB 3.47Å; N754-Q758 VanDerWaalsContact O-CG 3.31Å; N754-Q758 WeakPolarHBondContact O-CG 3.49Å; N754-Q758 PolarHBondContact O-N 2.95Å; L755-Q758 PolarHBondContact O-N 2.92Å; V756-Q758 PolarHBondContact O-N 3.06Å; Q758-H760 PolarHBondContact O-N 3.08Å; Q758-S761 WeakPolarHBondContact CA-OG 3.37Å; Q758-S761 CarbonylContact O-C 3.59Å; Q758-S761 PolarHBondContact O-N 2.75Å; Q758-S761 VanDerWaalsContact O-N 3.14Å; Q758-S761 PolarHBondContact O-OG 3.01Å; Q758-A762 WeakPolarHBondContact O-CB 3.4Å; Q758-A762 PolarHBondContact O-N 3.49Å; Q758-A771 HydrophobicContact CB-CB 3.74Å
759	V	88.2	Confident	89.2	Confident	8 Å²	8	51 Å²	51	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-37.5	178.6	172.1	0	0	0	0	112.1	F574 L575 L755 V756 S761 I768	F574-V759 HydrophobicContact CE1-CG1 4.46Å; L575-V759 HydrophobicContact CD2-CG1 3.8Å; L755-V759 HydrophobicContact CD1-CG2 3.92Å; L755-V759 HydrophobicContact CG-CG2 4.26Å; L755-V759 WeakPolarHBondContact O-CB 3.48Å; L755-V759 VanDerWaalsContact O-CG2 3.3Å; L755-V759 WeakPolarHBondContact O-CG2 3.2Å; L755-V759 PolarHBondContact O-N 3.05Å; V756-V759 PolarHBondContact O-N 3.19Å; V759-S761 VanDerWaalsContact C-N 3.34Å; V759-I768 HydrophobicContact CG2-CG2 4.45Å
760	H	86.2	Confident	89.2	Confident	138 Å²	138	53.5 Å²	53.5	64%	0.639	28%	0.277	S	S	*	.	H	α-helix	trans	-73.8	-23.7	174.6	-72.3	82.5	0	0	0	113.4	V756 K757 Q758	V756-H760 PolarHBondContact O-N 3.18Å; V756-H760 VanDerWaalsContact O-N 3.07Å; V756-H760 PolarHBondContact O-ND1 3.01Å; K757-H760 PolarHBondContact O-N 3.14Å; Q758-H760 PolarHBondContact O-N 3.08Å
761	S	88.4	Confident	89.3	Confident	91 Å²	91	51.7 Å²	51.7	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-88.9	-11.3	176.4	66.3	0	0	0	0	114.7	K757 Q758 V759 E763	K757-S761 WeakPolarHBondContact O-CB 3.38Å; K757-S761 PolarHBondContact O-N 3Å; K757-S761 VanDerWaalsContact O-N 3.09Å; K757-S761 PolarHBondContact O-OG 3.34Å; Q758-S761 WeakPolarHBondContact CA-OG 3.37Å; Q758-S761 CarbonylContact O-C 3.59Å; Q758-S761 PolarHBondContact O-N 2.75Å; Q758-S761 VanDerWaalsContact O-N 3.14Å; Q758-S761 PolarHBondContact O-OG 3.01Å; V759-S761 VanDerWaalsContact C-N 3.34Å; S761-E763 PolarHBondContact O-N 3.4Å
762	A	85.6	Confident	89.3	Confident	11 Å²	11	51.7 Å²	51.7	9%	0.091	26%	0.264	C	S	.	.			trans	-79.3	121.1	-174.3	0	0	0	0	0	111.4	Q758 D764 D767 I768	Q758-A762 WeakPolarHBondContact O-CB 3.4Å; Q758-A762 PolarHBondContact O-N 3.49Å; A762-D764 VanDerWaalsContact C-N 3.29Å; A762-D767 HydrophobicContact CB-CB 4.15Å; A762-I768 HydrophobicContact CB-CD1 4.44Å; A762-I768 HydrophobicContact CB-CG1 3.69Å
763	E	82.7	Confident	89.2	Confident	91 Å²	91	53.4 Å²	53.4	43%	0.425	27%	0.274	S	S	.	.	S	Bend	trans	-76.3	-21.2	168.7	-58.6	-159.1	138.2	0	0	111.8	K558 S561 S761	K558-E763 IonicContact NZ-OE1 2.9Å; K558-E763 PolarHBondContact NZ-OE1 3.46Å; K558-E763 IonicContact NZ-OE2 2.75Å; S561-E763 VanDerWaalsContact CB-O 3.23Å; S561-E763 WeakPolarHBondContact CB-O 3.33Å; S561-E763 PolarHBondContact OG-O 3.34Å; S561-E763 VanDerWaalsContact OG-O 3.12Å; S761-E763 PolarHBondContact O-N 3.4Å
764	D	85.1	Confident	89.2	Confident	21 Å²	21	50.8 Å²	50.8	11%	0.112	27%	0.27	C	S	.	.	S	Bend	trans	-129	143.4	-167.3	-62.1	-47.7	0	0	0	114.6	Y557 S561 A762 G766 D767 I768	Y557-D764 WeakPolarHBondContact CE1-OD1 3.36Å; Y557-D764 VanDerWaalsContact CE1-OD2 3.26Å; Y557-D764 WeakPolarHBondContact CE1-OD2 3.45Å; Y557-D764 VanDerWaalsContact CZ-OD1 3.3Å; Y557-D764 VanDerWaalsContact CZ-OD2 3.26Å; Y557-D764 PolarHBondContact OH-OD1 3.3Å; Y557-D764 PolarHBondContact OH-OD2 3.01Å; S561-D764 WeakPolarHBondContact CB-OD1 3.23Å; S561-D764 PolarHBondContact OG-OD1 3.43Å; A762-D764 VanDerWaalsContact C-N 3.29Å; D764-G766 PolarHBondContact O-N 3.13Å; D764-G766 VanDerWaalsContact O-N 3.16Å; D764-D767 PolarHBondContact O-N 3.33Å; D764-I768 PolarHBondContact O-N 3.49Å
765	L	86.5	Confident	89.2	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-32.8	173.1	-178.6	59.7	0	0	0	112.6	W480 L564 L568 I671 D767 I768 I769	W480-L765 HydrophobicContact CD2-CD2 4.32Å; W480-L765 HydrophobicContact CE3-CD2 4.28Å; W480-L765 HydrophobicContact CH2-CB 4.31Å; W480-L765 HydrophobicContact CH2-CD2 3.89Å; W480-L765 HydrophobicContact CH2-CG 4.48Å; W480-L765 HydrophobicContact CZ2-CB 4.1Å; W480-L765 HydrophobicContact CZ2-CD2 3.92Å; W480-L765 HydrophobicContact CZ2-CG 4.14Å; W480-L765 HydrophobicContact CZ3-CD2 4.06Å; L564-L765 HydrophobicContact CD2-CB 3.99Å; L564-L765 HydrophobicContact CD2-CD2 3.96Å; L568-L765 HydrophobicContact CD1-CD1 3.8Å; L568-L765 HydrophobicContact CD1-CD2 4.3Å; I671-L765 HydrophobicContact CD1-CD1 3.71Å; I671-L765 HydrophobicContact CG1-CD1 3.87Å; L765-D767 VanDerWaalsContact C-N 3.29Å; L765-D767 PolarHBondContact O-N 3.43Å; L765-I768 PolarHBondContact O-N 3.18Å; L765-I769 HydrophobicContact CD1-CD1 4.43Å; L765-I769 HydrophobicContact CD1-CG1 4.49Å; L765-I769 HydrophobicContact CG-CD1 4.07Å; L765-I769 WeakPolarHBondContact O-CG1 3.26Å; L765-I769 PolarHBondContact O-N 3.44Å
766	G	86.9	Confident	89.2	Confident	24 Å²	24	47.5 Å²	47.5	25%	0.247	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-34.9	176.7	0	0	0	0	0	113.3	D764 K770	D764-G766 PolarHBondContact O-N 3.13Å; D764-G766 VanDerWaalsContact O-N 3.16Å; G766-K770 WeakPolarHBondContact O-CG 3.24Å; G766-K770 PolarHBondContact O-N 3.1Å
767	D	88.2	Confident	89.1	Confident	65 Å²	65	47.9 Å²	47.9	35%	0.348	26%	0.257	S	S	.	.	H	α-helix	trans	-82.7	-31.2	179.7	-69.8	-20.3	0	0	0	111.9	A762 D764 L765 I769 K770 A771	A762-D767 HydrophobicContact CB-CB 4.15Å; D764-D767 PolarHBondContact O-N 3.33Å; L765-D767 VanDerWaalsContact C-N 3.29Å; L765-D767 PolarHBondContact O-N 3.43Å; D767-I769 VanDerWaalsContact C-N 3.34Å; D767-I769 PolarHBondContact O-N 3.5Å; D767-K770 PolarHBondContact O-N 2.9Å; D767-K770 WeakPolarHBondContact OD1-CE 3.19Å; D767-K770 IonicContact OD1-NZ 3.21Å; D767-K770 PolarHBondContact OD1-NZ 3.24Å; D767-A771 VanDerWaalsContact O-CB 3.28Å; D767-A771 WeakPolarHBondContact O-CB 3.48Å; D767-A771 PolarHBondContact O-N 3.22Å
768	I	90.3	Very high	89	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-44.3	168	-65.7	175.6	0	0	0	110.9	L565 F574 V759 A762 D764 L765 A771 H772	L565-I768 HydrophobicContact CD1-CD1 3.4Å; L565-I768 VanDerWaalsContact CD1-CD1 3.4Å; F574-I768 HydrophobicContact CE1-CG2 3.61Å; F574-I768 HydrophobicContact CZ-CG2 3.63Å; V759-I768 HydrophobicContact CG2-CG2 4.45Å; A762-I768 HydrophobicContact CB-CD1 4.44Å; A762-I768 HydrophobicContact CB-CG1 3.69Å; D764-I768 PolarHBondContact O-N 3.49Å; L765-I768 PolarHBondContact O-N 3.18Å; I768-A771 PolarHBondContact O-N 2.84Å; I768-H772 WeakPolarHBondContact O-CB 3.49Å; I768-H772 PolarHBondContact O-N 3.25Å
769	I	89.8	Confident	88.9	Confident	10 Å²	10	40.1 Å²	40.1	5%	0.051	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-43.6	177	-69	166.7	0	0	0	110.9	I671 L765 D767 H772 Q773	I671-I769 HydrophobicContact CG1-CG1 4.49Å; I671-I769 HydrophobicContact CG2-CG1 4.29Å; L765-I769 HydrophobicContact CD1-CD1 4.43Å; L765-I769 HydrophobicContact CD1-CG1 4.49Å; L765-I769 HydrophobicContact CG-CD1 4.07Å; L765-I769 WeakPolarHBondContact O-CG1 3.26Å; L765-I769 PolarHBondContact O-N 3.44Å; D767-I769 VanDerWaalsContact C-N 3.34Å; D767-I769 PolarHBondContact O-N 3.5Å; I769-H772 PolarHBondContact O-N 3.14Å; I769-Q773 WeakPolarHBondContact O-CB 3.19Å; I769-Q773 VanDerWaalsContact O-CG 3.31Å; I769-Q773 WeakPolarHBondContact O-CG 3.25Å; I769-Q773 PolarHBondContact O-N 3.15Å
770	K	90.5	Very high	89	Confident	128 Å²	128	41.6 Å²	41.6	56%	0.557	23%	0.23	S	C	*	.	H	α-helix	trans	-62.4	-44.9	175.2	-68.6	168.8	-157.2	160.9	0	111.9	G766 D767 H772 Q773 A774	G766-K770 WeakPolarHBondContact O-CG 3.24Å; G766-K770 PolarHBondContact O-N 3.1Å; D767-K770 PolarHBondContact O-N 2.9Å; D767-K770 WeakPolarHBondContact OD1-CE 3.19Å; D767-K770 IonicContact OD1-NZ 3.21Å; D767-K770 PolarHBondContact OD1-NZ 3.24Å; K770-H772 VanDerWaalsContact C-N 3.34Å; K770-H772 PolarHBondContact O-N 3.37Å; K770-Q773 PolarHBondContact O-N 2.89Å; K770-A774 VanDerWaalsContact O-CB 3.3Å; K770-A774 WeakPolarHBondContact O-CB 3.33Å; K770-A774 PolarHBondContact O-N 2.83Å
771	A	92.1	Very high	89	Confident	5 Å²	5	37.2 Å²	37.2	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-61.4	-42.8	178.4	0	0	0	0	0	111.6	L755 Q758 D767 I768 A774 F775	L755-A771 HydrophobicContact CD1-CB 4.1Å; Q758-A771 HydrophobicContact CB-CB 3.74Å; D767-A771 VanDerWaalsContact O-CB 3.28Å; D767-A771 WeakPolarHBondContact O-CB 3.48Å; D767-A771 PolarHBondContact O-N 3.22Å; I768-A771 PolarHBondContact O-N 2.84Å; A771-A774 PolarHBondContact O-N 3.11Å; A771-F775 WeakPolarHBondContact O-CB 3.48Å; A771-F775 PolarHBondContact O-N 3.28Å
772	H	91.1	Very high	88.8	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-43.7	175.7	-176.3	-111.9	0	0	0	112.8	Y680 I768 I769 K770 F775 L776	Y680-H772 AromaticContact CE2-CE1 3.88Å; Y680-H772 AromaticContact CE2-NE2 3.69Å; Y680-H772 AromaticContact CZ-NE2 3.66Å; Y680-H772 PolarHBondContact OH-NE2 3.12Å; I768-H772 WeakPolarHBondContact O-CB 3.49Å; I768-H772 PolarHBondContact O-N 3.25Å; I769-H772 PolarHBondContact O-N 3.14Å; K770-H772 VanDerWaalsContact C-N 3.34Å; K770-H772 PolarHBondContact O-N 3.37Å; H772-F775 WeakPolarHBondContact O-CB 3.43Å; H772-F775 PolarHBondContact O-N 3.14Å; H772-L776 PolarHBondContact O-N 3.29Å
773	Q	91.6	Very high	88.7	Confident	81 Å²	81	35 Å²	35	38%	0.379	19%	0.188	S	C	.	.	H	α-helix	trans	-65.2	-40.4	174.8	-72.8	176.6	-8.5	0	0	112	I769 K770 L776 S777	I769-Q773 WeakPolarHBondContact O-CB 3.19Å; I769-Q773 VanDerWaalsContact O-CG 3.31Å; I769-Q773 WeakPolarHBondContact O-CG 3.25Å; I769-Q773 PolarHBondContact O-N 3.15Å; K770-Q773 PolarHBondContact O-N 2.89Å; Q773-L776 PolarHBondContact O-N 3.13Å; Q773-S777 PolarHBondContact O-N 3.28Å; Q773-S777 PolarHBondContact O-OG 2.9Å
774	A	91.4	Very high	88.7	Confident	47 Å²	47	30.8 Å²	30.8	39%	0.388	17%	0.169	S	C	.	.	H	α-helix	trans	-65.3	-41.7	176	0	0	0	0	0	112.2	K770 A771 S777 N778	K770-A774 VanDerWaalsContact O-CB 3.3Å; K770-A774 WeakPolarHBondContact O-CB 3.33Å; K770-A774 PolarHBondContact O-N 2.83Å; A771-A774 PolarHBondContact O-N 3.11Å; A774-S777 WeakPolarHBondContact CA-OG 3.43Å; A774-S777 PolarHBondContact O-N 3.25Å; A774-S777 PolarHBondContact O-OG 3.45Å; A774-N778 VanDerWaalsContact O-CB 3.25Å; A774-N778 WeakPolarHBondContact O-CB 3.38Å; A774-N778 PolarHBondContact O-N 3.02Å
775	F	92.6	Very high	88.6	Confident	10 Å²	10	31.4 Å²	31.4	4%	0.044	17%	0.171	C	C	.	.	H	α-helix	trans	-56.2	-52.1	170.8	165	-98.9	0	0	0	111	L586 Y680 A751 W752 L755 A771 H772 S777 N778 V779	L586-F775 HydrophobicContact CD1-CE1 4.17Å; L586-F775 HydrophobicContact CD1-CZ 3.75Å; Y680-F775 HydrophobicContact CE1-CE1 4.28Å; A751-F775 HydrophobicContact CB-CD2 3.63Å; A751-F775 HydrophobicContact CB-CE2 3.73Å; A751-F775 WeakPolarHBondContact O-CD2 3.44Å; W752-F775 HydrophobicContact CB-CE2 4.41Å; W752-F775 HydrophobicContact CE3-CE2 4.48Å; W752-F775 HydrophobicContact CE3-CZ 4.45Å; L755-F775 HydrophobicContact CB-CB 4.15Å; L755-F775 HydrophobicContact CB-CD2 4.01Å; L755-F775 HydrophobicContact CB-CG 4.21Å; L755-F775 HydrophobicContact CD1-CB 4.04Å; L755-F775 HydrophobicContact CD2-CB 4.2Å; L755-F775 HydrophobicContact CD2-CD1 3.99Å; L755-F775 HydrophobicContact CD2-CD2 4.07Å; L755-F775 HydrophobicContact CD2-CE1 4.43Å; L755-F775 HydrophobicContact CD2-CE2 4.5Å; L755-F775 HydrophobicContact CD2-CG 3.81Å; L755-F775 HydrophobicContact CG-CB 4.35Å; L755-F775 HydrophobicContact CG-CG 4.41Å; A771-F775 WeakPolarHBondContact O-CB 3.48Å; A771-F775 PolarHBondContact O-N 3.28Å; H772-F775 WeakPolarHBondContact O-CB 3.43Å; H772-F775 PolarHBondContact O-N 3.14Å; F775-S777 PolarHBondContact O-N 3Å; F775-N778 PolarHBondContact O-N 2.94Å; F775-V779 HydrophobicContact CD2-CG2 4.28Å; F775-V779 HydrophobicContact CE1-CG2 4.41Å; F775-V779 HydrophobicContact CE2-CG2 3.87Å; F775-V779 HydrophobicContact CZ-CG2 3.94Å; F775-V779 WeakPolarHBondContact O-CG2 3.49Å; F775-V779 PolarHBondContact O-N 3.03Å
776	L	91.5	Very high	88.3	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-43.5	179.5	-83.1	173.7	0	0	0	112.8	C676 M679 Y680 H772 Q773 N778 V779 F780	C676-L776 HydrophobicContact CB-CD1 3.52Å; M679-L776 HydrophobicContact CB-CD2 4.33Å; M679-L776 HydrophobicContact CE-CB 4.48Å; M679-L776 HydrophobicContact SD-CB 4.35Å; Y680-L776 HydrophobicContact CD1-CD2 3.73Å; Y680-L776 HydrophobicContact CD2-CD1 4.4Å; Y680-L776 HydrophobicContact CD2-CD2 4.11Å; Y680-L776 HydrophobicContact CE1-CD2 3.56Å; Y680-L776 HydrophobicContact CE2-CD1 4.01Å; Y680-L776 HydrophobicContact CE2-CD2 3.95Å; Y680-L776 HydrophobicContact CE2-CG 4.39Å; Y680-L776 HydrophobicContact CG-CD2 4Å; H772-L776 PolarHBondContact O-N 3.29Å; Q773-L776 PolarHBondContact O-N 3.13Å; L776-N778 VanDerWaalsContact C-N 3.33Å; L776-N778 PolarHBondContact O-N 3.18Å; L776-V779 PolarHBondContact O-N 3.37Å; L776-F780 VanDerWaalsContact O-CB 3.23Å; L776-F780 WeakPolarHBondContact O-CB 3.23Å; L776-F780 PolarHBondContact O-N 3Å
777	S	90.1	Very high	87.9	Confident	57 Å²	57	36.6 Å²	36.6	40%	0.399	21%	0.205	S	C	.	.	H	α-helix	trans	-63	-40.6	176.2	59.3	0	0	0	0	111.9	Q773 A774 F775 F780 T781	Q773-S777 PolarHBondContact O-N 3.28Å; Q773-S777 PolarHBondContact O-OG 2.9Å; A774-S777 WeakPolarHBondContact CA-OG 3.43Å; A774-S777 PolarHBondContact O-N 3.25Å; A774-S777 PolarHBondContact O-OG 3.45Å; F775-S777 PolarHBondContact O-N 3Å; S777-F780 PolarHBondContact O-N 3.42Å; S777-T781 WeakPolarHBondContact O-CG2 3.4Å; S777-T781 PolarHBondContact O-N 3.2Å; S777-T781 PolarHBondContact O-OG1 3.47Å; S777-T781 VanDerWaalsContact O-OG1 3.13Å
778	N	89.6	Confident	87.3	Confident	40 Å²	40	40.2 Å²	40.2	21%	0.214	22%	0.22	C	C	.	.	H	α-helix	trans	-70.2	-34.3	-179.9	-175	44.7	0	0	0	112.6	A774 F775 L776 T781 R782	A774-N778 VanDerWaalsContact O-CB 3.25Å; A774-N778 WeakPolarHBondContact O-CB 3.38Å; A774-N778 PolarHBondContact O-N 3.02Å; F775-N778 PolarHBondContact O-N 2.94Å; L776-N778 VanDerWaalsContact C-N 3.33Å; L776-N778 PolarHBondContact O-N 3.18Å; N778-T781 PolarHBondContact O-OG1 3.37Å; N778-R782 WeakPolarHBondContact O-CB 3.37Å; N778-R782 VanDerWaalsContact O-CG 3.22Å; N778-R782 WeakPolarHBondContact O-CG 3.47Å; N778-R782 PolarHBondContact O-N 2.93Å; N778-R782 PolarHBondContact OD1-NE 3.31Å; N778-R782 PolarHBondContact OD1-NH2 2.74Å; N778-R782 VanDerWaalsContact OD1-NH2 3.17Å
779	V	89.1	Confident	86.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-68.5	-43.8	170.1	172.9	0	0	0	0	110.3	V747 L748 A751 F775 L776 C783	V747-V779 HydrophobicContact CG1-CG1 4.44Å; V747-V779 HydrophobicContact CG1-CG2 4.46Å; L748-V779 HydrophobicContact CD2-CG1 4.08Å; L748-V779 HydrophobicContact CD2-CG2 4.27Å; A751-V779 HydrophobicContact CB-CG2 3.92Å; F775-V779 HydrophobicContact CD2-CG2 4.28Å; F775-V779 HydrophobicContact CE1-CG2 4.41Å; F775-V779 HydrophobicContact CE2-CG2 3.87Å; F775-V779 HydrophobicContact CZ-CG2 3.94Å; F775-V779 WeakPolarHBondContact O-CG2 3.49Å; F775-V779 PolarHBondContact O-N 3.03Å; L776-V779 PolarHBondContact O-N 3.37Å; V779-C783 WeakPolarHBondContact O-CB 3.33Å; V779-C783 PolarHBondContact O-N 3.44Å; V779-C783 PolarHBondContact O-SG 2.74Å
780	F	88.8	Confident	86.4	Confident	40 Å²	40	48.5 Å²	48.5	18%	0.175	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-43.5	-177.1	-168.5	-94.5	0	0	0	113.2	M679 F682 L776 S777 L785	M679-F780 HydrophobicContact CE-CB 3.59Å; M679-F780 HydrophobicContact CE-CD1 4.17Å; M679-F780 HydrophobicContact CE-CD2 3.96Å; M679-F780 HydrophobicContact CE-CG 3.66Å; F682-F780 HydrophobicContact CB-CE2 4.04Å; F682-F780 HydrophobicContact CD2-CE2 4.46Å; L776-F780 VanDerWaalsContact O-CB 3.23Å; L776-F780 WeakPolarHBondContact O-CB 3.23Å; L776-F780 PolarHBondContact O-N 3Å; S777-F780 PolarHBondContact O-N 3.42Å; F780-L785 HydrophobicContact CD1-CB 4.06Å; F780-L785 HydrophobicContact CD2-CB 3.75Å; F780-L785 HydrophobicContact CD2-CD1 3.89Å; F780-L785 HydrophobicContact CD2-CG 4.49Å; F780-L785 VanDerWaalsContact CE1-C 3.49Å; F780-L785 HydrophobicContact CE1-CB 3.89Å; F780-L785 WeakPolarHBondContact CE1-O 3.49Å; F780-L785 HydrophobicContact CE2-CB 3.56Å; F780-L785 HydrophobicContact CE2-CD1 4Å; F780-L785 HydrophobicContact CE2-CG 4.4Å; F780-L785 HydrophobicContact CG-CB 4Å; F780-L785 HydrophobicContact CZ-CB 3.63Å; F780-L785 VanDerWaalsContact CZ-O 3.27Å; F780-L785 WeakPolarHBondContact CZ-O 3.41Å; F780-L785 WeakPolarHBondContact O-CB 3.41Å; F780-L785 PolarHBondContact O-N 2.81Å
781	T	86.1	Confident	86.1	Confident	45 Å²	45	49.6 Å²	49.6	28%	0.276	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-50.5	176	54.5	0	0	0	0	111.6	S777 N778 C783 L784 D786	S777-T781 WeakPolarHBondContact O-CG2 3.4Å; S777-T781 PolarHBondContact O-N 3.2Å; S777-T781 PolarHBondContact O-OG1 3.47Å; S777-T781 VanDerWaalsContact O-OG1 3.13Å; N778-T781 PolarHBondContact O-OG1 3.37Å; T781-C783 VanDerWaalsContact C-N 3.3Å; T781-C783 PolarHBondContact O-N 3.35Å; T781-L784 PolarHBondContact O-N 2.81Å; T781-L784 VanDerWaalsContact O-N 3.09Å; T781-D786 HydrophobicContact CG2-CB 4.31Å
782	R	85.6	Confident	85.9	Confident	55 Å²	55	49.6 Å²	49.6	21%	0.208	26%	0.258	C	S	.	.	H	α-helix	trans	-66.2	-27.6	179.7	-65.7	-178.3	-165.7	-152.8	-1.7	113.8	E746 V747 N778 L784	E746-R782 PolarHBondContact O-NH1 2.69Å; V747-R782 HydrophobicContact CB-CB 4.18Å; V747-R782 HydrophobicContact CG1-CB 3.62Å; V747-R782 HydrophobicContact CG1-CG 4.49Å; V747-R782 HydrophobicContact CG2-CB 3.58Å; V747-R782 HydrophobicContact CG2-CG 4.4Å; N778-R782 WeakPolarHBondContact O-CB 3.37Å; N778-R782 VanDerWaalsContact O-CG 3.22Å; N778-R782 WeakPolarHBondContact O-CG 3.47Å; N778-R782 PolarHBondContact O-N 2.93Å; N778-R782 PolarHBondContact OD1-NE 3.31Å; N778-R782 PolarHBondContact OD1-NH2 2.74Å; N778-R782 VanDerWaalsContact OD1-NH2 3.17Å; R782-L784 PolarHBondContact O-N 3.25Å
783	C	83.8	Confident	85.7	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	11.8	172.9	-73.5	0	0	0	0	114.3	F686 V779 T781 L785	F686-C783 HydrophobicContact CD1-CB 3.99Å; F686-C783 HydrophobicContact CE1-CB 4.02Å; F686-C783 WeakPolarHBondContact CZ-O 3.43Å; V779-C783 WeakPolarHBondContact O-CB 3.33Å; V779-C783 PolarHBondContact O-N 3.44Å; V779-C783 PolarHBondContact O-SG 2.74Å; T781-C783 VanDerWaalsContact C-N 3.3Å; T781-C783 PolarHBondContact O-N 3.35Å; C783-L785 VanDerWaalsContact C-N 3.25Å; C783-L785 HydrophobicContact CB-CD1 4.24Å; C783-L785 HydrophobicContact CB-CG 4.31Å; C783-L785 PolarHBondContact O-N 3.11Å
784	L	82.9	Confident	85.6	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	29.8	178.6	-58.1	168.3	0	0	0	113.7	T781 R782 S789 L792 L796 F883 L895	T781-L784 PolarHBondContact O-N 2.81Å; T781-L784 VanDerWaalsContact O-N 3.09Å; R782-L784 PolarHBondContact O-N 3.25Å; L784-S789 VanDerWaalsContact C-OG 3.31Å; L784-S789 WeakPolarHBondContact CA-OG 3.36Å; L784-L792 HydrophobicContact CD2-CB 4.03Å; L784-L792 HydrophobicContact CD2-CD1 3.7Å; L784-L792 HydrophobicContact CD2-CG 4.5Å; L784-L796 HydrophobicContact CD1-CD2 4.25Å; L784-F883 HydrophobicContact CD1-CZ 4.29Å; L784-L895 HydrophobicContact CD2-CD1 3.63Å; L784-L895 HydrophobicContact CD2-CD2 3.59Å; L784-L895 HydrophobicContact CD2-CG 4.28Å; L784-L895 HydrophobicContact CG-CD2 4.16Å
785	L	82	Confident	85.5	Confident	33 Å²	33	46.9 Å²	46.9	17%	0.173	25%	0.248	C	C	.	.			trans	-98	-5.4	179.6	-65.6	174	0	0	0	113.5	F682 F686 F780 C783 L793	F682-L785 HydrophobicContact CB-CD1 4.26Å; F686-L785 HydrophobicContact CB-CD1 4.28Å; F686-L785 HydrophobicContact CB-CD2 4.16Å; F686-L785 HydrophobicContact CD2-CD2 4.47Å; F686-L785 HydrophobicContact CG-CD2 4.44Å; F780-L785 HydrophobicContact CD1-CB 4.06Å; F780-L785 HydrophobicContact CD2-CB 3.75Å; F780-L785 HydrophobicContact CD2-CD1 3.89Å; F780-L785 HydrophobicContact CD2-CG 4.49Å; F780-L785 VanDerWaalsContact CE1-C 3.49Å; F780-L785 HydrophobicContact CE1-CB 3.89Å; F780-L785 WeakPolarHBondContact CE1-O 3.49Å; F780-L785 HydrophobicContact CE2-CB 3.56Å; F780-L785 HydrophobicContact CE2-CD1 4Å; F780-L785 HydrophobicContact CE2-CG 4.4Å; F780-L785 HydrophobicContact CG-CB 4Å; F780-L785 HydrophobicContact CZ-CB 3.63Å; F780-L785 VanDerWaalsContact CZ-O 3.27Å; F780-L785 WeakPolarHBondContact CZ-O 3.41Å; F780-L785 WeakPolarHBondContact O-CB 3.41Å; F780-L785 PolarHBondContact O-N 2.81Å; C783-L785 VanDerWaalsContact C-N 3.25Å; C783-L785 HydrophobicContact CB-CD1 4.24Å; C783-L785 HydrophobicContact CB-CG 4.31Å; C783-L785 PolarHBondContact O-N 3.11Å; L785-L793 HydrophobicContact CD2-CD2 4.2Å
786	D	81.1	Confident	85.5	Confident	57 Å²	57	46.4 Å²	46.4	31%	0.305	25%	0.246	S	C	.	.	S	Bend	trans	-73.4	160.3	-179.6	-163.5	15.8	0	0	0	112.9	T781 E788 S789 R790	T781-D786 HydrophobicContact CG2-CB 4.31Å; D786-E788 VanDerWaalsContact C-N 3.28Å; D786-E788 PolarHBondContact O-N 2.89Å; D786-S789 PolarHBondContact N-OG 3.45Å; D786-S789 PolarHBondContact O-N 2.83Å; D786-S789 PolarHBondContact O-OG 3.02Å; D786-R790 PolarHBondContact O-N 3.43Å
787	A	77.3	Confident	85.4	Confident	84 Å²	84	53.7 Å²	53.7	69%	0.694	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-38.8	-179.6	0	0	0	0	0	112.3	R790	A787-R790 WeakPolarHBondContact O-CB 3.43Å; A787-R790 PolarHBondContact O-N 2.9Å
788	E	75.3	Confident	85.4	Confident	141 Å²	141	52.5 Å²	52.5	66%	0.659	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-41.3	178.6	-57.1	-167.2	171.8	0	0	111.8	D786 R790	D786-E788 VanDerWaalsContact C-N 3.28Å; D786-E788 PolarHBondContact O-N 2.89Å; E788-R790 VanDerWaalsContact C-N 3.28Å; E788-R790 PolarHBondContact O-N 3.03Å
789	S	79.3	Confident	85.5	Confident	5 Å²	5	50.6 Å²	50.6	4%	0.035	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	4.2	-179.4	52	0	0	0	0	114.3	L784 D786 Q791 L792 L793	L784-S789 VanDerWaalsContact C-OG 3.31Å; L784-S789 WeakPolarHBondContact CA-OG 3.36Å; D786-S789 PolarHBondContact N-OG 3.45Å; D786-S789 PolarHBondContact O-N 2.83Å; D786-S789 PolarHBondContact O-OG 3.02Å; S789-Q791 PolarHBondContact O-N 3.4Å; S789-Q791 VanDerWaalsContact O-N 3.09Å; S789-L792 WeakPolarHBondContact O-CA 3.01Å; S789-L792 WeakPolarHBondContact O-CB 3.49Å; S789-L792 PolarHBondContact O-N 3.49Å; S789-L793 PolarHBondContact O-N 2.97Å
790	R	82.2	Confident	85.6	Confident	181 Å²	181	51.1 Å²	51.1	68%	0.683	26%	0.259	S	S	*	.	H	α-helix	trans	-55.8	-30.4	177.9	-172.1	172	-179.3	159.8	-1	113.6	D786 A787 E788 G794	D786-R790 PolarHBondContact O-N 3.43Å; A787-R790 WeakPolarHBondContact O-CB 3.43Å; A787-R790 PolarHBondContact O-N 2.9Å; E788-R790 VanDerWaalsContact C-N 3.28Å; E788-R790 PolarHBondContact O-N 3.03Å; R790-G794 PolarHBondContact O-N 2.86Å
791	Q	84.9	Confident	85.7	Confident	152 Å²	152	53.7 Å²	53.7	71%	0.71	28%	0.275	S	S	*	.	H	α-helix	trans	-70.3	-42.7	174	-60.3	-170.5	9.1	0	0	112.2	S789 G794 Q795 M886	S789-Q791 PolarHBondContact O-N 3.4Å; S789-Q791 VanDerWaalsContact O-N 3.09Å; Q791-G794 PolarHBondContact O-N 3.42Å; Q791-Q795 PolarHBondContact O-N 2.94Å; Q791-M886 HydrophobicContact CB-CE 3.69Å
792	L	87.5	Confident	85.9	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-43.4	173.8	-72.8	167.5	0	0	0	110.9	L784 S789 G794 Q795 L796 F883 M886 L887 L895	L784-L792 HydrophobicContact CD2-CB 4.03Å; L784-L792 HydrophobicContact CD2-CD1 3.7Å; L784-L792 HydrophobicContact CD2-CG 4.5Å; S789-L792 WeakPolarHBondContact O-CA 3.01Å; S789-L792 WeakPolarHBondContact O-CB 3.49Å; S789-L792 PolarHBondContact O-N 3.49Å; L792-G794 VanDerWaalsContact C-N 3.32Å; L792-G794 PolarHBondContact O-N 2.96Å; L792-Q795 PolarHBondContact O-N 3.48Å; L792-L796 WeakPolarHBondContact O-CB 3.22Å; L792-L796 PolarHBondContact O-N 2.87Å; L792-F883 HydrophobicContact CB-CE2 4.35Å; L792-F883 HydrophobicContact CD2-CD2 4.07Å; L792-F883 HydrophobicContact CD2-CE2 3.99Å; L792-M886 HydrophobicContact CD2-CB 3.49Å; L792-M886 VanDerWaalsContact CD2-CB 3.49Å; L792-M886 HydrophobicContact CD2-CE 4.27Å; L792-M886 HydrophobicContact CG-CE 4.47Å; L792-L887 HydrophobicContact CD1-CD2 4Å; L792-L887 HydrophobicContact CD2-CD2 3.9Å; L792-L887 HydrophobicContact CD2-CG 4.02Å; L792-L895 HydrophobicContact CD1-CD1 4.37Å
793	L	88.1	Confident	86.2	Confident	20 Å²	20	49.5 Å²	49.5	11%	0.105	26%	0.256	C	S	.	.	H	α-helix	trans	-62.9	-37.4	175	-172.6	63.8	0	0	0	112.2	F686 L785 S789 L796 R797	F686-L793 HydrophobicContact CD2-CD1 4.08Å; F686-L793 HydrophobicContact CE2-CD1 4.04Å; L785-L793 HydrophobicContact CD2-CD2 4.2Å; S789-L793 PolarHBondContact O-N 2.97Å; L793-L796 PolarHBondContact O-N 3.29Å; L793-R797 VanDerWaalsContact O-CG 3.27Å; L793-R797 WeakPolarHBondContact O-CG 3.25Å; L793-R797 PolarHBondContact O-N 3.36Å
794	G	88.7	Confident	86.5	Confident	40 Å²	40	51.4 Å²	51.4	41%	0.412	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-44.8	172.6	0	0	0	0	0	112.6	R790 Q791 L792 R797 A798	R790-G794 PolarHBondContact O-N 2.86Å; Q791-G794 PolarHBondContact O-N 3.42Å; L792-G794 VanDerWaalsContact C-N 3.32Å; L792-G794 PolarHBondContact O-N 2.96Å; G794-R797 PolarHBondContact O-N 2.91Å; G794-A798 PolarHBondContact O-N 3.18Å; G794-A798 VanDerWaalsContact O-N 3.14Å
795	Q	89.7	Confident	86.9	Confident	13 Å²	13	55 Å²	55	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-67.6	-39.4	176.4	-168.9	63.4	30.3	0	0	111.8	Q791 L792 R797 A798 I799 N879 F883 M886	Q791-Q795 PolarHBondContact O-N 2.94Å; L792-Q795 PolarHBondContact O-N 3.48Å; Q795-R797 PolarHBondContact O-N 2.8Å; Q795-A798 WeakPolarHBondContact O-CB 3.32Å; Q795-A798 PolarHBondContact O-N 3.43Å; Q795-A798 VanDerWaalsContact O-N 3.14Å; Q795-I799 WeakPolarHBondContact O-CG1 3.46Å; Q795-I799 PolarHBondContact O-N 3.43Å; Q795-N879 VanDerWaalsContact NE2-CA 3.27Å; Q795-N879 PolarHBondContact NE2-O 3.33Å; Q795-N879 PolarHBondContact NE2-OD1 2.86Å; Q795-N879 VanDerWaalsContact NE2-OD1 3.07Å; Q795-F883 HydrophobicContact CB-CD2 4.2Å; Q795-F883 HydrophobicContact CG-CB 3.91Å; Q795-F883 HydrophobicContact CG-CD2 4.12Å; Q795-F883 HydrophobicContact CG-CG 4.48Å; Q795-M886 HydrophobicContact CB-SD 4.48Å; Q795-M886 HydrophobicContact CG-SD 4.5Å
796	L	91.2	Very high	87.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-36.5	175.1	-177.5	60.1	0	0	0	112.3	F686 F735 L739 L784 L792 L793 A798 I799 F800 F883	F686-L796 HydrophobicContact CE2-CD2 3.69Å; F686-L796 HydrophobicContact CZ-CD2 4.04Å; F735-L796 HydrophobicContact CE1-CD1 4.19Å; F735-L796 HydrophobicContact CZ-CD1 3.82Å; L739-L796 HydrophobicContact CD2-CD1 4.16Å; L784-L796 HydrophobicContact CD1-CD2 4.25Å; L792-L796 WeakPolarHBondContact O-CB 3.22Å; L792-L796 PolarHBondContact O-N 2.87Å; L793-L796 PolarHBondContact O-N 3.29Å; L796-A798 VanDerWaalsContact C-N 3.35Å; L796-I799 WeakPolarHBondContact O-CB 3.45Å; L796-I799 PolarHBondContact O-N 3.44Å; L796-F800 HydrophobicContact CD1-CD1 4.25Å; L796-F800 HydrophobicContact CD1-CE1 3.73Å; L796-F800 HydrophobicContact CD1-CE2 4.44Å; L796-F800 HydrophobicContact CD1-CZ 3.84Å; L796-F800 HydrophobicContact CD2-CE2 4.32Å; L796-F800 HydrophobicContact CD2-CZ 4.1Å; L796-F800 HydrophobicContact CG-CD2 4.46Å; L796-F800 HydrophobicContact CG-CE1 4.17Å; L796-F800 HydrophobicContact CG-CE2 3.98Å; L796-F800 HydrophobicContact CG-CZ 3.83Å; L796-F800 WeakPolarHBondContact O-CG 3.44Å; L796-F800 PolarHBondContact O-N 2.96Å; L796-F883 HydrophobicContact CB-CE2 4.17Å; L796-F883 HydrophobicContact CD1-CZ 4.38Å
797	R	89.3	Confident	87.8	Confident	155 Å²	155	51.7 Å²	51.7	59%	0.585	27%	0.27	S	S	*	.	H	α-helix	trans	-63.3	-38.4	170.3	-72.9	172.5	-170.3	-161.2	3.2	112.1	L793 G794 Q795 I799 F800 N801	L793-R797 VanDerWaalsContact O-CG 3.27Å; L793-R797 WeakPolarHBondContact O-CG 3.25Å; L793-R797 PolarHBondContact O-N 3.36Å; G794-R797 PolarHBondContact O-N 2.91Å; Q795-R797 PolarHBondContact O-N 2.8Å; R797-I799 VanDerWaalsContact C-N 3.33Å; R797-F800 PolarHBondContact O-N 2.75Å; R797-N801 WeakPolarHBondContact O-CB 3.03Å; R797-N801 VanDerWaalsContact O-CG 3.29Å; R797-N801 PolarHBondContact O-N 3.49Å; R797-N801 PolarHBondContact O-OD1 3.4Å
798	A	90.7	Very high	88.5	Confident	32 Å²	32	53.4 Å²	53.4	26%	0.264	26%	0.263	S	S	.	.	H	α-helix	trans	-64.9	-36.8	173.5	0	0	0	0	0	112.1	G794 Q795 L796 S802	G794-A798 PolarHBondContact O-N 3.18Å; G794-A798 VanDerWaalsContact O-N 3.14Å; Q795-A798 WeakPolarHBondContact O-CB 3.32Å; Q795-A798 PolarHBondContact O-N 3.43Å; Q795-A798 VanDerWaalsContact O-N 3.14Å; L796-A798 VanDerWaalsContact C-N 3.35Å; A798-S802 PolarHBondContact O-N 3.48Å; A798-S802 PolarHBondContact O-OG 2.99Å
799	I	92.3	Very high	89.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.7	-49.7	171.1	-65	169.5	0	0	0	110.3	F735 Q795 L796 R797 N801 S802 I803 Y876 N879 F883	F735-I799 HydrophobicContact CD1-CG2 4.15Å; F735-I799 HydrophobicContact CE1-CG2 3.59Å; F735-I799 HydrophobicContact CZ-CD1 4.08Å; F735-I799 HydrophobicContact CZ-CG2 4.12Å; Q795-I799 WeakPolarHBondContact O-CG1 3.46Å; Q795-I799 PolarHBondContact O-N 3.43Å; L796-I799 WeakPolarHBondContact O-CB 3.45Å; L796-I799 PolarHBondContact O-N 3.44Å; R797-I799 VanDerWaalsContact C-N 3.33Å; I799-N801 VanDerWaalsContact C-N 3.34Å; I799-N801 PolarHBondContact O-N 3.25Å; I799-S802 WeakPolarHBondContact O-CA 3.42Å; I799-S802 VanDerWaalsContact O-CB 3.28Å; I799-S802 WeakPolarHBondContact O-CB 3.32Å; I799-S802 PolarHBondContact O-N 2.95Å; I799-I803 HydrophobicContact CG2-CD1 4.4Å; I799-I803 WeakPolarHBondContact O-CG1 3.38Å; I799-I803 PolarHBondContact O-N 3.3Å; I799-I803 VanDerWaalsContact O-N 3.08Å; I799-Y876 HydrophobicContact CG2-CD2 4.44Å; I799-Y876 HydrophobicContact CG2-CE2 3.83Å; I799-N879 HydrophobicContact CG1-CB 4.16Å; I799-F883 HydrophobicContact CD1-CB 3.82Å; I799-F883 HydrophobicContact CD1-CD1 4.01Å; I799-F883 HydrophobicContact CD1-CD2 4.45Å; I799-F883 HydrophobicContact CD1-CG 3.86Å
800	F	91.2	Very high	89.7	Confident	12 Å²	12	46.5 Å²	46.5	5%	0.053	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-39.7	177.4	-69.6	-15.4	0	0	0	113.1	A690 M693 I736 L739 L796 R797 S802 I803 L804	A690-F800 HydrophobicContact CB-CZ 4.23Å; M693-F800 HydrophobicContact CE-CB 4.03Å; M693-F800 HydrophobicContact CE-CG 4.45Å; M693-F800 HydrophobicContact CG-CB 4.39Å; M693-F800 HydrophobicContact CG-CD1 3.79Å; M693-F800 HydrophobicContact CG-CE1 4.21Å; M693-F800 HydrophobicContact CG-CG 4.06Å; M693-F800 HydrophobicContact SD-CB 4.28Å; I736-F800 HydrophobicContact CD1-CD1 4.44Å; I736-F800 HydrophobicContact CD1-CE1 3.92Å; L739-F800 HydrophobicContact CD2-CE1 4.24Å; L739-F800 HydrophobicContact CD2-CZ 4.24Å; L796-F800 HydrophobicContact CD1-CD1 4.25Å; L796-F800 HydrophobicContact CD1-CE1 3.73Å; L796-F800 HydrophobicContact CD1-CE2 4.44Å; L796-F800 HydrophobicContact CD1-CZ 3.84Å; L796-F800 HydrophobicContact CD2-CE2 4.32Å; L796-F800 HydrophobicContact CD2-CZ 4.1Å; L796-F800 HydrophobicContact CG-CD2 4.46Å; L796-F800 HydrophobicContact CG-CE1 4.17Å; L796-F800 HydrophobicContact CG-CE2 3.98Å; L796-F800 HydrophobicContact CG-CZ 3.83Å; L796-F800 WeakPolarHBondContact O-CG 3.44Å; L796-F800 PolarHBondContact O-N 2.96Å; R797-F800 PolarHBondContact O-N 2.75Å; F800-S802 VanDerWaalsContact C-N 3.34Å; F800-S802 PolarHBondContact O-N 3.31Å; F800-I803 HydrophobicContact CD1-CD1 4.3Å; F800-I803 WeakPolarHBondContact O-CB 3.5Å; F800-I803 PolarHBondContact O-N 2.89Å; F800-I803 VanDerWaalsContact O-N 3.14Å; F800-L804 PolarHBondContact O-N 3.3Å
801	N	91.4	Very high	90	Very high	93 Å²	93	43.9 Å²	43.9	50%	0.497	23%	0.226	S	C	.	.	H	α-helix	trans	-62.7	-41.8	172.7	-70.7	-5.5	0	0	0	111.2	R797 I799 I803 L804 D805	R797-N801 WeakPolarHBondContact O-CB 3.03Å; R797-N801 VanDerWaalsContact O-CG 3.29Å; R797-N801 PolarHBondContact O-N 3.49Å; R797-N801 PolarHBondContact O-OD1 3.4Å; I799-N801 VanDerWaalsContact C-N 3.34Å; I799-N801 PolarHBondContact O-N 3.25Å; N801-I803 PolarHBondContact O-N 3.41Å; N801-L804 PolarHBondContact O-N 3Å; N801-D805 VanDerWaalsContact O-CG 3.25Å; N801-D805 PolarHBondContact O-N 3.01Å
802	S	90	Very high	90.2	Very high	12 Å²	12	39.6 Å²	39.6	8%	0.084	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-27.2	174.9	-53.7	0	0	0	0	113	A798 I799 F800 Y806 Q872	A798-S802 PolarHBondContact O-N 3.48Å; A798-S802 PolarHBondContact O-OG 2.99Å; I799-S802 WeakPolarHBondContact O-CA 3.42Å; I799-S802 VanDerWaalsContact O-CB 3.28Å; I799-S802 WeakPolarHBondContact O-CB 3.32Å; I799-S802 PolarHBondContact O-N 2.95Å; F800-S802 VanDerWaalsContact C-N 3.34Å; F800-S802 PolarHBondContact O-N 3.31Å; S802-Y806 WeakPolarHBondContact O-CB 3.31Å; S802-Y806 PolarHBondContact O-N 2.96Å; S802-Q872 PolarHBondContact O-NE2 3.42Å
803	I	92.1	Very high	90.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-77.3	-39.1	174	-59.8	174.5	0	0	0	111.3	M693 L697 I732 I736 I799 F800 N801 Y806 A807	M693-I803 HydrophobicContact CB-CD1 4.44Å; M693-I803 HydrophobicContact SD-CB 4.08Å; M693-I803 HydrophobicContact SD-CG2 3.97Å; L697-I803 HydrophobicContact CD1-CG2 4.14Å; L697-I803 HydrophobicContact CD2-CG2 4.2Å; L697-I803 HydrophobicContact CG-CG2 4.07Å; I732-I803 HydrophobicContact CG2-CD1 3.56Å; I732-I803 HydrophobicContact CG2-CG1 3.58Å; I732-I803 HydrophobicContact CG2-CG2 4.3Å; I736-I803 HydrophobicContact CD1-CD1 3.79Å; I736-I803 HydrophobicContact CG1-CD1 3.94Å; I799-I803 HydrophobicContact CG2-CD1 4.4Å; I799-I803 WeakPolarHBondContact O-CG1 3.38Å; I799-I803 PolarHBondContact O-N 3.3Å; I799-I803 VanDerWaalsContact O-N 3.08Å; F800-I803 HydrophobicContact CD1-CD1 4.3Å; F800-I803 WeakPolarHBondContact O-CB 3.5Å; F800-I803 PolarHBondContact O-N 2.89Å; F800-I803 VanDerWaalsContact O-N 3.14Å; N801-I803 PolarHBondContact O-N 3.41Å; I803-Y806 WeakPolarHBondContact O-CB 3.41Å; I803-Y806 PolarHBondContact O-N 2.96Å; I803-A807 PolarHBondContact O-N 2.87Å
804	L	89.1	Confident	90.2	Very high	42 Å²	42	39.9 Å²	39.9	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-41.6	173.6	-66.9	177.1	0	0	0	111.5	M693 F800 N801 Y806 A807 Q808	M693-L804 HydrophobicContact CE-CD1 4.09Å; M693-L804 HydrophobicContact CE-CD2 3.92Å; M693-L804 HydrophobicContact CE-CG 3.89Å; M693-L804 HydrophobicContact SD-CD2 4.11Å; M693-L804 HydrophobicContact SD-CG 4.16Å; F800-L804 PolarHBondContact O-N 3.3Å; N801-L804 PolarHBondContact O-N 3Å; L804-Y806 PolarHBondContact O-N 3.43Å; L804-A807 WeakPolarHBondContact O-CB 3.24Å; L804-A807 PolarHBondContact O-N 3Å; L804-A807 VanDerWaalsContact O-N 3.13Å; L804-Q808 WeakPolarHBondContact O-CG 3.36Å; L804-Q808 PolarHBondContact O-N 3.35Å
805	D	91.1	Very high	90.2	Very high	79 Å²	79	41.9 Å²	41.9	42%	0.422	21%	0.214	S	C	.	.	H	α-helix	trans	-58.8	-34.9	172	-64	-22.8	0	0	0	110.9	N801 Q808 L809 Q872	N801-D805 VanDerWaalsContact O-CG 3.25Å; N801-D805 PolarHBondContact O-N 3.01Å; D805-Q808 PolarHBondContact O-N 3.04Å; D805-L809 WeakPolarHBondContact O-CB 3.43Å; D805-L809 PolarHBondContact O-N 3.49Å; D805-Q872 VanDerWaalsContact CB-NE2 3.32Å
806	Y	92.1	Very high	90.1	Very high	2 Å²	2	43 Å²	43	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-72.3	-37.6	178.1	167.7	-107.2	0	0	0	110.8	L697 L700 Q704 L725 F728 G729 I732 S802 I803 L804 Q808 L809 H810	L697-Y806 HydrophobicContact CD2-CD1 4.23Å; L697-Y806 HydrophobicContact CD2-CE1 4.02Å; L700-Y806 HydrophobicContact CD1-CD1 3.75Å; L700-Y806 HydrophobicContact CD1-CE1 3.69Å; Q704-Y806 PolarHBondContact NE2-OH 3.38Å; L725-Y806 HydrophobicContact CD1-CE2 3.84Å; L725-Y806 HydrophobicContact CG-CE2 4.28Å; L725-Y806 PolarHBondContact O-OH 3.42Å; F728-Y806 AromaticContact CD1-CD2 3.39Å; F728-Y806 HydrophobicContact CD1-CD2 3.39Å; F728-Y806 AromaticContact CD1-CE2 3.58Å; F728-Y806 HydrophobicContact CD1-CE2 3.58Å; F728-Y806 HydrophobicContact CD1-CG 4.32Å; F728-Y806 AromaticContact CE1-CD2 3.42Å; F728-Y806 HydrophobicContact CE1-CD2 3.42Å; F728-Y806 VanDerWaalsContact CE1-CD2 3.42Å; F728-Y806 HydrophobicContact CE1-CE2 4.11Å; F728-Y806 HydrophobicContact CE1-CG 4.03Å; F728-Y806 HydrophobicContact CG-CD2 4.39Å; F728-Y806 HydrophobicContact CG-CE2 4.29Å; F728-Y806 HydrophobicContact CZ-CD2 4.43Å; G729-Y806 VanDerWaalsContact CA-OH 3.24Å; G729-Y806 WeakPolarHBondContact CA-OH 3.2Å; I732-Y806 HydrophobicContact CD1-CD1 3.73Å; I732-Y806 HydrophobicContact CD1-CD2 4.39Å; I732-Y806 HydrophobicContact CD1-CE1 4.16Å; I732-Y806 HydrophobicContact CD1-CG 3.84Å; S802-Y806 WeakPolarHBondContact O-CB 3.31Å; S802-Y806 PolarHBondContact O-N 2.96Å; I803-Y806 WeakPolarHBondContact O-CB 3.41Å; I803-Y806 PolarHBondContact O-N 2.96Å; L804-Y806 PolarHBondContact O-N 3.43Å; Y806-Q808 VanDerWaalsContact C-N 3.35Å; Y806-L809 PolarHBondContact O-N 3.15Å; Y806-H810 WeakPolarHBondContact O-CB 3.37Å; Y806-H810 PolarHBondContact O-N 3.37Å
807	A	90.8	Very high	89.8	Confident	18 Å²	18	43.1 Å²	43.1	15%	0.149	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-42.2	171.3	0	0	0	0	0	112	T696 L700 I803 L804 H810 Q811	T696-A807 HydrophobicContact CG2-CB 3.81Å; L700-A807 HydrophobicContact CD1-CB 3.83Å; L700-A807 HydrophobicContact CD2-CB 4.27Å; I803-A807 PolarHBondContact O-N 2.87Å; L804-A807 WeakPolarHBondContact O-CB 3.24Å; L804-A807 PolarHBondContact O-N 3Å; L804-A807 VanDerWaalsContact O-N 3.13Å; A807-H810 WeakPolarHBondContact O-CB 3.28Å; A807-H810 PolarHBondContact O-N 3.02Å; A807-Q811 PolarHBondContact O-N 2.87Å
808	Q	90.6	Very high	89.7	Confident	119 Å²	119	40.9 Å²	40.9	56%	0.556	22%	0.22	S	C	*	.	H	α-helix	trans	-64.2	-48.7	175	-67.8	179	15.1	0	0	111.7	L804 D805 Y806 H810 Q811 D812	L804-Q808 WeakPolarHBondContact O-CG 3.36Å; L804-Q808 PolarHBondContact O-N 3.35Å; D805-Q808 PolarHBondContact O-N 3.04Å; Y806-Q808 VanDerWaalsContact C-N 3.35Å; Q808-H810 PolarHBondContact O-N 3.01Å; Q808-Q811 WeakPolarHBondContact O-CA 3.29Å; Q808-Q811 WeakPolarHBondContact O-CB 3.44Å; Q808-Q811 PolarHBondContact O-N 3.25Å; Q808-D812 PolarHBondContact O-N 3.46Å
809	L	90	Very high	89.5	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-36.7	175.9	-177.1	148.7	0	0	0	111.9	L725 D805 Y806 Q811 D812 F813 R868 I869	L725-L809 HydrophobicContact CD1-CD2 3.68Å; D805-L809 WeakPolarHBondContact O-CB 3.43Å; D805-L809 PolarHBondContact O-N 3.49Å; Y806-L809 PolarHBondContact O-N 3.15Å; L809-Q811 VanDerWaalsContact C-N 3.34Å; L809-D812 WeakPolarHBondContact O-CB 3.22Å; L809-D812 PolarHBondContact O-N 3.37Å; L809-F813 WeakPolarHBondContact O-CB 2.99Å; L809-F813 PolarHBondContact O-N 3Å; L809-R868 HydrophobicContact CD1-CB 3.72Å; L809-I869 HydrophobicContact CD1-CG1 3.98Å; L809-I869 HydrophobicContact CD2-CD1 4.1Å; L809-I869 HydrophobicContact CD2-CG1 3.43Å; L809-I869 VanDerWaalsContact CD2-CG1 3.43Å; L809-I869 HydrophobicContact CG-CG1 4.35Å
810	H	89.9	Confident	89.2	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.5	-36.2	175.3	-163.9	-79.4	0	0	0	112.4	L700 Q704 L725 Y806 A807 Q808 F813 N814	L700-H810 HydrophobicContact CD2-CB 3.79Å; Q704-H810 WeakPolarHBondContact CG-NE2 3.46Å; Q704-H810 PolarHBondContact NE2-CD2 3.49Å; Q704-H810 PolarHBondContact NE2-NE2 3.25Å; L725-H810 WeakPolarHBondContact CD2-CD2 3.36Å; L725-H810 WeakPolarHBondContact CD2-NE2 3.28Å; Y806-H810 WeakPolarHBondContact O-CB 3.37Å; Y806-H810 PolarHBondContact O-N 3.37Å; A807-H810 WeakPolarHBondContact O-CB 3.28Å; A807-H810 PolarHBondContact O-N 3.02Å; Q808-H810 PolarHBondContact O-N 3.01Å; H810-F813 PolarHBondContact O-N 3.48Å; H810-N814 PolarHBondContact CE1-ND2 2.87Å; H810-N814 VanDerWaalsContact CE1-ND2 3.27Å; H810-N814 PolarHBondContact ND1-ND2 3Å; H810-N814 VanDerWaalsContact ND1-ND2 3.14Å; H810-N814 WeakPolarHBondContact O-CB 3.36Å; H810-N814 PolarHBondContact O-N 3.05Å
811	Q	89.1	Confident	89	Confident	126 Å²	126	45.2 Å²	45.2	59%	0.589	24%	0.235	S	C	*	.	H	α-helix	trans	-69.9	-40.3	174.5	-169.6	172	-0.2	0	0	111.7	A807 Q808 L809 F813 N814 T815	A807-Q811 PolarHBondContact O-N 2.87Å; Q808-Q811 WeakPolarHBondContact O-CA 3.29Å; Q808-Q811 WeakPolarHBondContact O-CB 3.44Å; Q808-Q811 PolarHBondContact O-N 3.25Å; L809-Q811 VanDerWaalsContact C-N 3.34Å; Q811-F813 VanDerWaalsContact C-N 3.34Å; Q811-F813 PolarHBondContact O-N 2.98Å; Q811-N814 PolarHBondContact O-N 2.98Å; Q811-T815 WeakPolarHBondContact O-CB 3.23Å; Q811-T815 WeakPolarHBondContact O-CG2 3.38Å; Q811-T815 PolarHBondContact O-N 3.37Å; Q811-T815 PolarHBondContact O-OG1 2.85Å
812	D	89.4	Confident	88.9	Confident	62 Å²	62	42.7 Å²	42.7	33%	0.332	23%	0.225	S	C	.	.	H	α-helix	trans	-58	-45.5	170.2	-72.6	-8.8	0	0	0	111.4	Q808 L809 T815 T816 R868	Q808-D812 PolarHBondContact O-N 3.46Å; L809-D812 WeakPolarHBondContact O-CB 3.22Å; L809-D812 PolarHBondContact O-N 3.37Å; D812-T815 PolarHBondContact O-OG1 3.39Å; D812-T816 VanDerWaalsContact O-CB 3.28Å; D812-T816 WeakPolarHBondContact O-CB 3.37Å; D812-T816 PolarHBondContact O-N 2.85Å; D812-T816 PolarHBondContact O-OG1 3.14Å; D812-R868 IonicContact OD2-CZ 3.33Å; D812-R868 VanDerWaalsContact OD2-CZ 3.26Å; D812-R868 IonicContact OD2-NH1 3.75Å; D812-R868 PolarHBondContact OD2-NH1 3.23Å; D812-R868 IonicContact OD2-NH2 2.96Å; D812-R868 PolarHBondContact OD2-NH2 3.21Å
813	F	88.7	Confident	88.7	Confident	3 Å²	3	44.5 Å²	44.5	1%	0.013	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-50.6	176.6	171.1	-97.5	0	0	0	111.4	A707 L718 V721 L722 L725 L809 H810 Q811 T815 T816 A817 L865	A707-F813 HydrophobicContact CB-CE1 4.37Å; L718-F813 HydrophobicContact CD1-CZ 4.31Å; L718-F813 HydrophobicContact CD2-CE2 4Å; L718-F813 HydrophobicContact CD2-CZ 4.32Å; V721-F813 HydrophobicContact CB-CE2 4.19Å; V721-F813 HydrophobicContact CG1-CD2 3.8Å; V721-F813 HydrophobicContact CG1-CE2 3.58Å; L722-F813 HydrophobicContact CD1-CE1 4.45Å; L722-F813 HydrophobicContact CD1-CZ 4.5Å; L725-F813 HydrophobicContact CD2-CD1 3.66Å; L725-F813 HydrophobicContact CD2-CE1 3.94Å; L725-F813 HydrophobicContact CD2-CG 4.07Å; L809-F813 WeakPolarHBondContact O-CB 2.99Å; L809-F813 PolarHBondContact O-N 3Å; H810-F813 PolarHBondContact O-N 3.48Å; Q811-F813 VanDerWaalsContact C-N 3.34Å; Q811-F813 PolarHBondContact O-N 2.98Å; F813-T815 PolarHBondContact O-N 2.87Å; F813-T816 PolarHBondContact O-N 3.27Å; F813-A817 VanDerWaalsContact O-CB 3.29Å; F813-A817 WeakPolarHBondContact O-CB 3.5Å; F813-A817 PolarHBondContact O-N 2.87Å; F813-L865 HydrophobicContact CD2-CD1 4.42Å
814	N	86.7	Confident	88.4	Confident	27 Å²	27	44.7 Å²	44.7	14%	0.144	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-43.6	-179.6	-81.2	-15.2	0	0	0	112.4	Q703 H810 Q811 T816 A817 M818	Q703-N814 PolarHBondContact OE1-ND2 3.1Å; H810-N814 PolarHBondContact CE1-ND2 2.87Å; H810-N814 VanDerWaalsContact CE1-ND2 3.27Å; H810-N814 PolarHBondContact ND1-ND2 3Å; H810-N814 VanDerWaalsContact ND1-ND2 3.14Å; H810-N814 WeakPolarHBondContact O-CB 3.36Å; H810-N814 PolarHBondContact O-N 3.05Å; Q811-N814 PolarHBondContact O-N 2.98Å; N814-T816 VanDerWaalsContact C-N 3.35Å; N814-A817 PolarHBondContact O-N 3.05Å; N814-M818 VanDerWaalsContact O-CB 3.28Å; N814-M818 WeakPolarHBondContact O-CB 3.4Å; N814-M818 WeakPolarHBondContact O-CG 3.41Å; N814-M818 PolarHBondContact O-N 3.11Å
815	T	89.4	Confident	88.4	Confident	83 Å²	83	46.5 Å²	46.5	51%	0.509	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-41.6	177.5	50.3	0	0	0	0	111.2	Q811 D812 F813 H819	Q811-T815 WeakPolarHBondContact O-CB 3.23Å; Q811-T815 WeakPolarHBondContact O-CG2 3.38Å; Q811-T815 PolarHBondContact O-N 3.37Å; Q811-T815 PolarHBondContact O-OG1 2.85Å; D812-T815 PolarHBondContact O-OG1 3.39Å; F813-T815 PolarHBondContact O-N 2.87Å; T815-H819 VanDerWaalsContact O-CB 3.24Å; T815-H819 WeakPolarHBondContact O-CB 3.18Å; T815-H819 PolarHBondContact O-N 2.98Å
816	T	86.7	Confident	88.2	Confident	36 Å²	36	48.7 Å²	48.7	22%	0.221	25%	0.247	C	C	.	.	H	α-helix	trans	-63.2	-45.9	174.5	-58.8	0	0	0	0	112.1	D812 F813 N814 H819 E820 F857 K861 L865	D812-T816 VanDerWaalsContact O-CB 3.28Å; D812-T816 WeakPolarHBondContact O-CB 3.37Å; D812-T816 PolarHBondContact O-N 2.85Å; D812-T816 PolarHBondContact O-OG1 3.14Å; F813-T816 PolarHBondContact O-N 3.27Å; N814-T816 VanDerWaalsContact C-N 3.35Å; T816-H819 PolarHBondContact O-N 2.97Å; T816-E820 WeakPolarHBondContact O-CB 3.31Å; T816-E820 PolarHBondContact O-N 3.46Å; T816-F857 HydrophobicContact CG2-CE2 3.77Å; T816-F857 HydrophobicContact CG2-CZ 4.2Å; T816-K861 HydrophobicContact CG2-CD 4.3Å; T816-L865 HydrophobicContact CG2-CD1 4.34Å
817	A	86	Confident	87.9	Confident	2 Å²	2	50.2 Å²	50.2	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-41.9	179.9	0	0	0	0	0	112.5	L710 L718 F813 N814 E820 N821	L710-A817 HydrophobicContact CD1-CB 4.31Å; L718-A817 HydrophobicContact CD1-CB 3.94Å; F813-A817 VanDerWaalsContact O-CB 3.29Å; F813-A817 WeakPolarHBondContact O-CB 3.5Å; F813-A817 PolarHBondContact O-N 2.87Å; N814-A817 PolarHBondContact O-N 3.05Å; A817-E820 PolarHBondContact O-N 3.01Å; A817-N821 VanDerWaalsContact O-CB 3.3Å; A817-N821 WeakPolarHBondContact O-CB 3.24Å; A817-N821 PolarHBondContact O-N 3.3Å
818	M	86.4	Confident	87.6	Confident	109 Å²	109	50.4 Å²	50.4	54%	0.537	25%	0.254	S	S	.	.	H	α-helix	trans	-68.6	-37.1	176.8	-70.8	-63.7	-69.4	0	0	112.1	L710 N814 N821 S822	L710-M818 HydrophobicContact CD1-SD 4.36Å; L710-M818 HydrophobicContact CD2-SD 3.79Å; N814-M818 VanDerWaalsContact O-CB 3.28Å; N814-M818 WeakPolarHBondContact O-CB 3.4Å; N814-M818 WeakPolarHBondContact O-CG 3.41Å; N814-M818 PolarHBondContact O-N 3.11Å; M818-N821 PolarHBondContact O-N 3.04Å; M818-S822 WeakPolarHBondContact O-CB 3.41Å; M818-S822 PolarHBondContact O-N 3.48Å
819	H	87.5	Confident	87.4	Confident	114 Å²	114	47.6 Å²	47.6	53%	0.528	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-47.3	173.8	-177.8	73.8	0	0	0	111.4	T815 T816 S822 I823	T815-H819 VanDerWaalsContact O-CB 3.24Å; T815-H819 WeakPolarHBondContact O-CB 3.18Å; T815-H819 PolarHBondContact O-N 2.98Å; T816-H819 PolarHBondContact O-N 2.97Å; H819-S822 PolarHBondContact O-N 3.34Å; H819-I823 WeakPolarHBondContact O-CG1 3.07Å; H819-I823 PolarHBondContact O-N 2.82Å; H819-I823 VanDerWaalsContact O-N 3.09Å
820	E	86.2	Confident	87.2	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.014	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-42.5	175.5	-179.6	59.6	-157.6	0	0	112.2	L714 T816 A817 S822 I823 R824 R853 F857	L714-E820 HydrophobicContact CD1-CG 3.7Å; T816-E820 WeakPolarHBondContact O-CB 3.31Å; T816-E820 PolarHBondContact O-N 3.46Å; A817-E820 PolarHBondContact O-N 3.01Å; E820-S822 VanDerWaalsContact C-N 3.32Å; E820-S822 PolarHBondContact O-N 2.88Å; E820-I823 PolarHBondContact O-N 2.94Å; E820-I823 VanDerWaalsContact O-N 3.17Å; E820-R824 WeakPolarHBondContact O-CG 3.39Å; E820-R824 PolarHBondContact O-N 3.24Å; E820-R824 IonicContact OE1-CZ 3.17Å; E820-R824 IonicContact OE1-NE 2.72Å; E820-R824 PolarHBondContact OE1-NE 3.41Å; E820-R824 IonicContact OE1-NH2 2.72Å; E820-R824 PolarHBondContact OE1-NH2 2.76Å; E820-R853 VanDerWaalsContact CD-NH1 3.31Å; E820-R853 IonicContact OE1-CZ 3.51Å; E820-R853 IonicContact OE1-NH1 3.76Å; E820-R853 PolarHBondContact OE1-NH1 3.38Å; E820-R853 VanDerWaalsContact OE1-NH1 3.13Å; E820-R853 IonicContact OE1-NH2 2.84Å; E820-R853 PolarHBondContact OE1-NH2 3.17Å; E820-R853 IonicContact OE2-CZ 3.77Å; E820-R853 IonicContact OE2-NH1 2.74Å; E820-R853 PolarHBondContact OE2-NH1 2.91Å; E820-R853 IonicContact OE2-NH2 3.41Å; E820-F857 HydrophobicContact CB-CD2 4.29Å; E820-F857 HydrophobicContact CB-CE1 4.46Å; E820-F857 HydrophobicContact CB-CE2 3.62Å; E820-F857 HydrophobicContact CB-CZ 3.73Å; E820-F857 HydrophobicContact CG-CD1 4.25Å; E820-F857 HydrophobicContact CG-CD2 4.09Å; E820-F857 HydrophobicContact CG-CE1 3.92Å; E820-F857 HydrophobicContact CG-CE2 3.77Å; E820-F857 HydrophobicContact CG-CG 4.34Å; E820-F857 HydrophobicContact CG-CZ 3.68Å
821	N	86.8	Confident	86.9	Confident	17 Å²	17	53.9 Å²	53.9	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-42.8	175.6	-173.1	76.6	0	0	0	111.4	L714 A817 M818 I823 R824 E825	L714-N821 HydrophobicContact CD2-CB 3.86Å; A817-N821 VanDerWaalsContact O-CB 3.3Å; A817-N821 WeakPolarHBondContact O-CB 3.24Å; A817-N821 PolarHBondContact O-N 3.3Å; M818-N821 PolarHBondContact O-N 3.04Å; N821-I823 VanDerWaalsContact C-N 3.33Å; N821-I823 PolarHBondContact O-N 3.46Å; N821-R824 PolarHBondContact O-N 3.43Å; N821-E825 VanDerWaalsContact O-CB 3.24Å; N821-E825 WeakPolarHBondContact O-CB 3.47Å; N821-E825 PolarHBondContact O-N 2.77Å
822	S	88.9	Confident	86.6	Confident	41 Å²	41	52 Å²	52	29%	0.287	27%	0.27	S	S	.	.	H	α-helix	trans	-64.4	-34.4	176.1	-173	0	0	0	0	113	M818 H819 E820 K826	M818-S822 WeakPolarHBondContact O-CB 3.41Å; M818-S822 PolarHBondContact O-N 3.48Å; H819-S822 PolarHBondContact O-N 3.34Å; E820-S822 VanDerWaalsContact C-N 3.32Å; E820-S822 PolarHBondContact O-N 2.88Å; S822-K826 WeakPolarHBondContact O-CB 3.31Å; S822-K826 WeakPolarHBondContact O-CD 3.42Å; S822-K826 VanDerWaalsContact O-CG 3.24Å; S822-K826 WeakPolarHBondContact O-CG 3.32Å; S822-K826 PolarHBondContact O-N 2.91Å
823	I	85.9	Confident	86.3	Confident	50 Å²	50	56.9 Å²	56.9	26%	0.256	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-46.6	174.6	-65.3	165.2	0	0	0	110.5	H819 E820 N821 E825 K826 Y827	H819-I823 WeakPolarHBondContact O-CG1 3.07Å; H819-I823 PolarHBondContact O-N 2.82Å; H819-I823 VanDerWaalsContact O-N 3.09Å; E820-I823 PolarHBondContact O-N 2.94Å; E820-I823 VanDerWaalsContact O-N 3.17Å; N821-I823 VanDerWaalsContact C-N 3.33Å; N821-I823 PolarHBondContact O-N 3.46Å; I823-E825 VanDerWaalsContact C-N 3.34Å; I823-E825 PolarHBondContact O-N 2.99Å; I823-K826 PolarHBondContact O-N 2.84Å; I823-Y827 PolarHBondContact O-N 3.38Å
824	R	86.3	Confident	86	Confident	3 Å²	3	58.1 Å²	58.1	1%	0.011	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-37.1	178.3	-67.2	-176.1	-173	-157	4.1	112.6	D717 E820 N821 Y827 A828	D717-R824 IonicContact OD2-CZ 3.21Å; D717-R824 IonicContact OD2-NH1 2.99Å; D717-R824 PolarHBondContact OD2-NH1 2.85Å; D717-R824 IonicContact OD2-NH2 2.73Å; D717-R824 PolarHBondContact OD2-NH2 3.49Å; E820-R824 WeakPolarHBondContact O-CG 3.39Å; E820-R824 PolarHBondContact O-N 3.24Å; E820-R824 IonicContact OE1-CZ 3.17Å; E820-R824 IonicContact OE1-NE 2.72Å; E820-R824 PolarHBondContact OE1-NE 3.41Å; E820-R824 IonicContact OE1-NH2 2.72Å; E820-R824 PolarHBondContact OE1-NH2 2.76Å; N821-R824 PolarHBondContact O-N 3.43Å; R824-Y827 PolarHBondContact O-N 3.23Å; R824-A828 VanDerWaalsContact O-CB 3.31Å; R824-A828 WeakPolarHBondContact O-CB 3.38Å; R824-A828 PolarHBondContact O-N 2.9Å
825	E	87.2	Confident	85.7	Confident	80 Å²	80	60.4 Å²	60.4	37%	0.374	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-42.8	173.6	178.6	173.9	-139.9	0	0	111.9	Y712 N821 I823 A828 S829	Y712-E825 HydrophobicContact CD2-CB 4.13Å; Y712-E825 HydrophobicContact CE2-CB 3.77Å; Y712-E825 HydrophobicContact CE2-CG 3.95Å; N821-E825 VanDerWaalsContact O-CB 3.24Å; N821-E825 WeakPolarHBondContact O-CB 3.47Å; N821-E825 PolarHBondContact O-N 2.77Å; I823-E825 VanDerWaalsContact C-N 3.34Å; I823-E825 PolarHBondContact O-N 2.99Å; E825-A828 PolarHBondContact O-N 3Å; E825-S829 VanDerWaalsContact O-CB 3.28Å; E825-S829 WeakPolarHBondContact O-CB 3.48Å; E825-S829 PolarHBondContact O-N 3.48Å; E825-S829 PolarHBondContact O-OG 3.05Å
826	K	87.8	Confident	85.4	Confident	126 Å²	126	66 Å²	66	55%	0.548	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-48	173	-75.6	167.7	-175.3	173.2	0	111.4	S822 I823 A828 S829 E830	S822-K826 WeakPolarHBondContact O-CB 3.31Å; S822-K826 WeakPolarHBondContact O-CD 3.42Å; S822-K826 VanDerWaalsContact O-CG 3.24Å; S822-K826 WeakPolarHBondContact O-CG 3.32Å; S822-K826 PolarHBondContact O-N 2.91Å; I823-K826 PolarHBondContact O-N 2.84Å; K826-A828 PolarHBondContact O-N 3.29Å; K826-S829 PolarHBondContact O-N 3.37Å; K826-S829 VanDerWaalsContact O-N 3.16Å; K826-E830 WeakPolarHBondContact O-CB 3.29Å; K826-E830 WeakPolarHBondContact O-CG 3.5Å; K826-E830 PolarHBondContact O-N 3Å
827	Y	85.9	Confident	85.2	Confident	34 Å²	34	68.8 Å²	68.8	13%	0.133	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-45.7	176.7	-177.2	-94.5	0	0	0	112	I823 R824 S829 E830 L831 R846 E850	I823-Y827 PolarHBondContact O-N 3.38Å; R824-Y827 PolarHBondContact O-N 3.23Å; Y827-S829 VanDerWaalsContact C-N 3.34Å; Y827-S829 PolarHBondContact O-N 3.47Å; Y827-E830 PolarHBondContact O-N 3.5Å; Y827-L831 WeakPolarHBondContact O-CB 3.43Å; Y827-L831 PolarHBondContact O-N 3.46Å; Y827-R846 HydrophobicContact CE2-CG 4.2Å; Y827-E850 HydrophobicContact CD1-CG 4.36Å; Y827-E850 HydrophobicContact CD2-CG 4.31Å; Y827-E850 HydrophobicContact CE1-CG 4.17Å; Y827-E850 HydrophobicContact CE2-CB 4.06Å; Y827-E850 HydrophobicContact CE2-CG 4.12Å; Y827-E850 HydrophobicContact CG-CG 4.43Å
828	A	85.3	Confident	84.6	Confident	21 Å²	21	70.9 Å²	70.9	17%	0.174	36%	0.355	C	S	.	.	H	α-helix	trans	-64	-37.5	175.7	0	0	0	0	0	112.5	Y712 R824 E825 K826 L831 Q832	Y712-A828 HydrophobicContact CD1-CB 3.84Å; Y712-A828 HydrophobicContact CE1-CB 3.94Å; R824-A828 VanDerWaalsContact O-CB 3.31Å; R824-A828 WeakPolarHBondContact O-CB 3.38Å; R824-A828 PolarHBondContact O-N 2.9Å; E825-A828 PolarHBondContact O-N 3Å; K826-A828 PolarHBondContact O-N 3.29Å; A828-L831 PolarHBondContact O-N 2.94Å; A828-Q832 WeakPolarHBondContact O-CG 3.4Å; A828-Q832 PolarHBondContact O-N 3.37Å
829	S	85.9	Confident	83.8	Confident	60 Å²	60	72.4 Å²	72.4	42%	0.42	36%	0.36	S	S	.	.	H	α-helix	trans	-69.7	-36.3	176.2	-59.7	0	0	0	0	112.3	E825 K826 Y827 R833	E825-S829 VanDerWaalsContact O-CB 3.28Å; E825-S829 WeakPolarHBondContact O-CB 3.48Å; E825-S829 PolarHBondContact O-N 3.48Å; E825-S829 PolarHBondContact O-OG 3.05Å; K826-S829 PolarHBondContact O-N 3.37Å; K826-S829 VanDerWaalsContact O-N 3.16Å; Y827-S829 VanDerWaalsContact C-N 3.34Å; Y827-S829 PolarHBondContact O-N 3.47Å; S829-R833 VanDerWaalsContact O-CB 3.3Å; S829-R833 WeakPolarHBondContact O-CB 3.3Å; S829-R833 PolarHBondContact O-N 3.34Å
830	E	84.9	Confident	82.5	Confident	78 Å²	78	76.5 Å²	76.5	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-66.6	-40.6	173	-73.9	-179.7	151.1	0	0	111.7	K826 Y827 R833 A834 R846	K826-E830 WeakPolarHBondContact O-CB 3.29Å; K826-E830 WeakPolarHBondContact O-CG 3.5Å; K826-E830 PolarHBondContact O-N 3Å; Y827-E830 PolarHBondContact O-N 3.5Å; E830-R833 PolarHBondContact O-N 3.4Å; E830-A834 PolarHBondContact O-N 2.83Å; E830-R846 IonicContact OE1-NH2 2.86Å; E830-R846 IonicContact OE2-CZ 2.8Å; E830-R846 IonicContact OE2-NH2 3.24Å; E830-R846 PolarHBondContact OE2-NH2 3.35Å
831	L	83.3	Confident	81.3	Confident	57 Å²	57	79.3 Å²	79.3	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-50.6	173.9	-176.4	56.5	0	0	0	111.4	Y827 A828 R833 A834 E835 T842	Y827-L831 WeakPolarHBondContact O-CB 3.43Å; Y827-L831 PolarHBondContact O-N 3.46Å; A828-L831 PolarHBondContact O-N 2.94Å; L831-R833 PolarHBondContact O-N 2.88Å; L831-A834 WeakPolarHBondContact O-CB 3.47Å; L831-A834 PolarHBondContact O-N 3.06Å; L831-E835 WeakPolarHBondContact O-CG 3.44Å; L831-E835 PolarHBondContact O-N 3.26Å; L831-T842 HydrophobicContact CD1-CG2 3.63Å
832	Q	82.7	Confident	80.2	Confident	87 Å²	87	80.4 Å²	80.4	41%	0.407	41%	0.408	S	S	.	.	H	α-helix	trans	-59.6	-32	174.1	-73.5	-178	17.7	0	0	112.8	A828 R836	A828-Q832 WeakPolarHBondContact O-CG 3.4Å; A828-Q832 PolarHBondContact O-N 3.37Å; Q832-R836 WeakPolarHBondContact O-CB 3.44Å; Q832-R836 WeakPolarHBondContact O-CG 3.45Å; Q832-R836 PolarHBondContact O-N 3.36Å; Q832-R836 VanDerWaalsContact O-N 3.09Å
833	R	84.8	Confident	79.4	Confident	164 Å²	164	83.8 Å²	83.8	62%	0.619	42%	0.423	S	S	*	.	H	α-helix	trans	-70.8	-42.3	174.2	-173.6	173.5	65.7	120.6	-2.5	111.3	S829 E830 L831 R836 T837	S829-R833 VanDerWaalsContact O-CB 3.3Å; S829-R833 WeakPolarHBondContact O-CB 3.3Å; S829-R833 PolarHBondContact O-N 3.34Å; E830-R833 PolarHBondContact O-N 3.4Å; L831-R833 PolarHBondContact O-N 2.88Å; R833-R836 PolarHBondContact O-N 3.44Å; R833-T837 WeakPolarHBondContact O-CG2 3.45Å; R833-T837 PolarHBondContact O-N 2.94Å; R833-T837 PolarHBondContact O-OG1 3.07Å; R833-T837 VanDerWaalsContact O-OG1 3.11Å
834	A	82.5	Confident	78.9	Confident	28 Å²	28	90.9 Å²	90.9	23%	0.231	45%	0.447	C	S	.	.	H	α-helix	trans	-59.4	-49.5	175.6	0	0	0	0	0	111.2	E830 L831 R836 T837 G838 H839	E830-A834 PolarHBondContact O-N 2.83Å; L831-A834 WeakPolarHBondContact O-CB 3.47Å; L831-A834 PolarHBondContact O-N 3.06Å; A834-R836 PolarHBondContact O-N 3.24Å; A834-T837 WeakPolarHBondContact CA-OG1 3.33Å; A834-T837 CarbonylContact O-C 3.52Å; A834-T837 WeakPolarHBondContact O-CA 3.49Å; A834-T837 PolarHBondContact O-N 3.13Å; A834-T837 PolarHBondContact O-OG1 3.21Å; A834-G838 PolarHBondContact O-N 3.07Å; A834-H839 CarbonylContact C-O 3.37Å; A834-H839 HydrophobicContact CB-CB 4.4Å; A834-H839 PolarHBondContact O-N 3.47Å
835	E	79.7	Confident	78.5	Confident	76 Å²	76	96.5 Å²	96.5	36%	0.355	48%	0.476	S	S	.	.	H	α-helix	trans	-53.5	-49.2	173.7	-69.7	171.6	171.2	0	0	111.7	L831 T837 G838 W840	L831-E835 WeakPolarHBondContact O-CG 3.44Å; L831-E835 PolarHBondContact O-N 3.26Å; E835-T837 VanDerWaalsContact C-N 3.29Å; E835-T837 PolarHBondContact O-N 2.68Å; E835-G838 PolarHBondContact O-N 3.38Å; E835-W840 HydrophobicContact CB-CE3 4.4Å; E835-W840 HydrophobicContact CB-CH2 4.33Å; E835-W840 HydrophobicContact CB-CZ3 4.01Å; E835-W840 HydrophobicContact CG-CE3 4.1Å; E835-W840 HydrophobicContact CG-CZ3 3.89Å
836	R	82.4	Confident	78	Confident	201 Å²	201	97.5 Å²	97.5	76%	0.758	48%	0.477	S	S	*	.	H	α-helix	trans	-63.3	-30.7	176.6	-72.6	172.8	-161.7	177.5	10.1	113.5	Q832 R833 A834 G838	Q832-R836 WeakPolarHBondContact O-CB 3.44Å; Q832-R836 WeakPolarHBondContact O-CG 3.45Å; Q832-R836 PolarHBondContact O-N 3.36Å; Q832-R836 VanDerWaalsContact O-N 3.09Å; R833-R836 PolarHBondContact O-N 3.44Å; A834-R836 PolarHBondContact O-N 3.24Å; R836-G838 PolarHBondContact O-N 3.3Å
837	T	83.4	Confident	77.6	Confident	94 Å²	94	96 Å²	96	58%	0.577	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	6.6	173.9	55.4	0	0	0	0	113.8	R833 A834 E835 H839	R833-T837 WeakPolarHBondContact O-CG2 3.45Å; R833-T837 PolarHBondContact O-N 2.94Å; R833-T837 PolarHBondContact O-OG1 3.07Å; R833-T837 VanDerWaalsContact O-OG1 3.11Å; A834-T837 WeakPolarHBondContact CA-OG1 3.33Å; A834-T837 CarbonylContact O-C 3.52Å; A834-T837 WeakPolarHBondContact O-CA 3.49Å; A834-T837 PolarHBondContact O-N 3.13Å; A834-T837 PolarHBondContact O-OG1 3.21Å; E835-T837 VanDerWaalsContact C-N 3.29Å; E835-T837 PolarHBondContact O-N 2.68Å; T837-H839 PolarHBondContact O-N 2.9Å
838	G	73.9	Confident	77.4	Confident	45 Å²	45	99.7 Å²	99.7	46%	0.464	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	5.2	-180	0	0	0	0	0	114.8	A834 E835 R836 W840	A834-G838 PolarHBondContact O-N 3.07Å; E835-G838 PolarHBondContact O-N 3.38Å; R836-G838 PolarHBondContact O-N 3.3Å; G838-W840 VanDerWaalsContact C-N 3.32Å; G838-W840 PolarHBondContact O-N 2.99Å; G838-W840 VanDerWaalsContact O-N 3.11Å
839	H	68.3	Low	77.3	Confident	141 Å²	141	105 Å²	105	65%	0.653	51%	0.511	S	S	*	.			trans	-81.3	84.9	167.6	-83.9	63.2	0	0	0	108.4	A834 T837	A834-H839 CarbonylContact C-O 3.37Å; A834-H839 HydrophobicContact CB-CB 4.4Å; A834-H839 PolarHBondContact O-N 3.47Å; T837-H839 PolarHBondContact O-N 2.9Å
840	W	60.7	Low	77.1	Confident	200 Å²	200	102.9 Å²	102.9	76%	0.758	50%	0.495	S	S	*	.			trans	-79.5	115.7	173	-61.8	99	0	0	0	109.7	E835 G838	E835-W840 HydrophobicContact CB-CE3 4.4Å; E835-W840 HydrophobicContact CB-CH2 4.33Å; E835-W840 HydrophobicContact CB-CZ3 4.01Å; E835-W840 HydrophobicContact CG-CE3 4.1Å; E835-W840 HydrophobicContact CG-CZ3 3.89Å; G838-W840 VanDerWaalsContact C-N 3.32Å; G838-W840 PolarHBondContact O-N 2.99Å; G838-W840 VanDerWaalsContact O-N 3.11Å
841	G	60.9	Low	76.9	Confident	62 Å²	62	101.8 Å²	101.8	64%	0.639	50%	0.496	S	S	*	.	S	Bend	trans	117.4	131.7	-178.5	0	0	0	0	0	112.3
842	T	64.6	Low	77	Confident	41 Å²	41	104.4 Å²	104.4	25%	0.252	51%	0.51	S	S	.	.			trans	-77	144.4	163.7	32.3	0	0	0	0	110	L831 R844 E847	L831-T842 HydrophobicContact CD1-CG2 3.63Å; T842-R844 PolarHBondContact O-N 2.89Å; T842-E847 VanDerWaalsContact CB-CG 3.48Å; T842-E847 WeakPolarHBondContact CB-OE1 3.48Å; T842-E847 HydrophobicContact CG2-CG 4.07Å; T842-E847 WeakPolarHBondContact OG1-CG 3.5Å; T842-E847 PolarHBondContact OG1-OE1 3.04Å
843	D	70.5	Confident	77.1	Confident	112 Å²	112	103.1 Å²	103.1	60%	0.599	50%	0.501	S	S	*	.			trans	-62.1	128	163.9	-63.9	-54.5	0	0	0	108.8	L845 R846 E847	D843-L845 PolarHBondContact O-N 3.36Å; D843-L845 VanDerWaalsContact O-N 3.14Å; D843-R846 HydrophobicContact CB-CB 4.03Å; D843-R846 WeakPolarHBondContact O-CA 3.4Å; D843-R846 WeakPolarHBondContact O-CB 3.47Å; D843-R846 PolarHBondContact O-N 3.2Å; D843-E847 PolarHBondContact O-N 3.15Å; D843-E847 VanDerWaalsContact O-N 3.11Å
844	R	76.4	Confident	77	Confident	199 Å²	199	99 Å²	99	75%	0.751	49%	0.485	S	S	*	.	H	α-helix	trans	-51.3	-40.6	176.7	-73.5	-175	177.5	174.9	-0.6	112.1	T842 R846 E847 E848	T842-R844 PolarHBondContact O-N 2.89Å; R844-R846 VanDerWaalsContact C-N 3.26Å; R844-R846 PolarHBondContact O-N 3.1Å; R844-E847 PolarHBondContact O-N 3.19Å; R844-E848 WeakPolarHBondContact O-CB 3.34Å; R844-E848 VanDerWaalsContact O-CG 3.3Å; R844-E848 WeakPolarHBondContact O-CG 3.38Å; R844-E848 PolarHBondContact O-N 3.2Å
845	L	78.5	Confident	77	Confident	120 Å²	120	103.4 Å²	103.4	63%	0.628	50%	0.499	S	S	*	.	H	α-helix	trans	-59	-35.6	175.8	-64.2	176.3	0	0	0	112.7	D843 Q849	D843-L845 PolarHBondContact O-N 3.36Å; D843-L845 VanDerWaalsContact O-N 3.14Å; L845-Q849 VanDerWaalsContact O-CB 3.3Å; L845-Q849 WeakPolarHBondContact O-CB 3.33Å; L845-Q849 WeakPolarHBondContact O-CG 3.37Å; L845-Q849 PolarHBondContact O-N 3.3Å
846	R	76	Confident	77.3	Confident	101 Å²	101	106.1 Å²	106.1	38%	0.381	51%	0.512	S	S	.	.	H	α-helix	trans	-76	-36.4	179.2	-165.7	-175.7	-172.9	149.8	0.2	111.5	Y827 E830 D843 R844 E850	Y827-R846 HydrophobicContact CE2-CG 4.2Å; E830-R846 IonicContact OE1-NH2 2.86Å; E830-R846 IonicContact OE2-CZ 2.8Å; E830-R846 IonicContact OE2-NH2 3.24Å; E830-R846 PolarHBondContact OE2-NH2 3.35Å; D843-R846 HydrophobicContact CB-CB 4.03Å; D843-R846 WeakPolarHBondContact O-CA 3.4Å; D843-R846 WeakPolarHBondContact O-CB 3.47Å; D843-R846 PolarHBondContact O-N 3.2Å; R844-R846 VanDerWaalsContact C-N 3.26Å; R844-R846 PolarHBondContact O-N 3.1Å; R846-E850 WeakPolarHBondContact O-CB 3.43Å; R846-E850 PolarHBondContact O-N 3.03Å
847	E	79.6	Confident	77.4	Confident	96 Å²	96	97 Å²	97	45%	0.449	48%	0.478	S	S	.	.	H	α-helix	trans	-67.7	-41.8	171.6	-56.6	-158	132.1	0	0	112.1	T842 D843 R844 E850 S851	T842-E847 VanDerWaalsContact CB-CG 3.48Å; T842-E847 WeakPolarHBondContact CB-OE1 3.48Å; T842-E847 HydrophobicContact CG2-CG 4.07Å; T842-E847 WeakPolarHBondContact OG1-CG 3.5Å; T842-E847 PolarHBondContact OG1-OE1 3.04Å; D843-E847 PolarHBondContact O-N 3.15Å; D843-E847 VanDerWaalsContact O-N 3.11Å; R844-E847 PolarHBondContact O-N 3.19Å; E847-E850 PolarHBondContact O-N 3.09Å; E847-S851 WeakPolarHBondContact O-CB 3.26Å; E847-S851 PolarHBondContact O-N 3.42Å
848	E	82.1	Confident	77.3	Confident	110 Å²	110	95 Å²	95	51%	0.514	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-43.8	175.4	-74.8	169.7	-169.9	0	0	110.8	R844 S851 L852	R844-E848 WeakPolarHBondContact O-CB 3.34Å; R844-E848 VanDerWaalsContact O-CG 3.3Å; R844-E848 WeakPolarHBondContact O-CG 3.38Å; R844-E848 PolarHBondContact O-N 3.2Å; E848-S851 PolarHBondContact O-N 3.37Å; E848-L852 WeakPolarHBondContact O-CB 3.42Å; E848-L852 VanDerWaalsContact O-CG 3.25Å; E848-L852 WeakPolarHBondContact O-CG 3.24Å; E848-L852 PolarHBondContact O-N 3.47Å
849	Q	82.5	Confident	77.7	Confident	132 Å²	132	98.5 Å²	98.5	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-60.2	-47.4	172.7	-77.6	167.8	5	0	0	112.4	L845 S851 L852 R853	L845-Q849 VanDerWaalsContact O-CB 3.3Å; L845-Q849 WeakPolarHBondContact O-CB 3.33Å; L845-Q849 WeakPolarHBondContact O-CG 3.37Å; L845-Q849 PolarHBondContact O-N 3.3Å; Q849-S851 VanDerWaalsContact C-N 3.35Å; Q849-S851 PolarHBondContact O-N 3.38Å; Q849-L852 PolarHBondContact O-N 3.03Å; Q849-R853 VanDerWaalsContact O-CB 3.28Å; Q849-R853 WeakPolarHBondContact O-CB 3.3Å; Q849-R853 PolarHBondContact O-N 3.19Å
850	E	80.6	Confident	78.5	Confident	16 Å²	16	95.4 Å²	95.4	8%	0.075	47%	0.467	C	S	.	.	H	α-helix	trans	-66	-36.4	177.8	176.5	60.7	-168.7	0	0	111.9	Y827 R846 E847 R853 R854	Y827-E850 HydrophobicContact CD1-CG 4.36Å; Y827-E850 HydrophobicContact CD2-CG 4.31Å; Y827-E850 HydrophobicContact CE1-CG 4.17Å; Y827-E850 HydrophobicContact CE2-CB 4.06Å; Y827-E850 HydrophobicContact CE2-CG 4.12Å; Y827-E850 HydrophobicContact CG-CG 4.43Å; R846-E850 WeakPolarHBondContact O-CB 3.43Å; R846-E850 PolarHBondContact O-N 3.03Å; E847-E850 PolarHBondContact O-N 3.09Å; E850-R853 PolarHBondContact O-N 3.1Å; E850-R853 IonicContact OE1-CZ 3.16Å; E850-R853 IonicContact OE1-NE 2.67Å; E850-R853 IonicContact OE1-NH2 2.71Å; E850-R853 PolarHBondContact OE1-NH2 2.83Å; E850-R853 IonicContact OE2-CZ 2.85Å; E850-R853 IonicContact OE2-NE 3.32Å; E850-R853 PolarHBondContact OE2-NE 3.33Å; E850-R853 IonicContact OE2-NH2 2.74Å; E850-R853 PolarHBondContact OE2-NH2 2.97Å; E850-R854 WeakPolarHBondContact O-CB 3.41Å; E850-R854 VanDerWaalsContact O-CG 3.29Å; E850-R854 WeakPolarHBondContact O-CG 3.39Å; E850-R854 PolarHBondContact O-N 3.17Å; E850-R854 IonicContact OE1-CZ 3.5Å; E850-R854 VanDerWaalsContact OE1-CZ 3.24Å; E850-R854 IonicContact OE1-NE 2.77Å; E850-R854 PolarHBondContact OE1-NE 3.44Å; E850-R854 IonicContact OE1-NH2 3.35Å; E850-R854 PolarHBondContact OE1-NH2 3.29Å
851	S	81.6	Confident	79.6	Confident	55 Å²	55	90.6 Å²	90.6	39%	0.385	45%	0.452	S	S	.	.	H	α-helix	trans	-65.8	-45.2	175.1	-176.3	0	0	0	0	111.8	E847 E848 Q849 R854 K855	E847-S851 WeakPolarHBondContact O-CB 3.26Å; E847-S851 PolarHBondContact O-N 3.42Å; E848-S851 PolarHBondContact O-N 3.37Å; Q849-S851 VanDerWaalsContact C-N 3.35Å; Q849-S851 PolarHBondContact O-N 3.38Å; S851-R854 PolarHBondContact O-N 3.48Å; S851-K855 WeakPolarHBondContact O-CG 3.34Å; S851-K855 PolarHBondContact O-N 2.86Å
852	L	85.2	Confident	80.7	Confident	113 Å²	113	88.1 Å²	88.1	59%	0.592	42%	0.424	S	S	*	.	H	α-helix	trans	-62.9	-44.5	173.7	-72.3	170.1	0	0	0	111.3	E848 Q849 R854 K855 E856	E848-L852 WeakPolarHBondContact O-CB 3.42Å; E848-L852 VanDerWaalsContact O-CG 3.25Å; E848-L852 WeakPolarHBondContact O-CG 3.24Å; E848-L852 PolarHBondContact O-N 3.47Å; Q849-L852 PolarHBondContact O-N 3.03Å; L852-R854 VanDerWaalsContact C-N 3.34Å; L852-R854 PolarHBondContact O-N 3.49Å; L852-K855 PolarHBondContact O-N 2.83Å; L852-E856 WeakPolarHBondContact O-CB 3.25Å; L852-E856 PolarHBondContact O-N 3.13Å
853	R	85.3	Confident	81.7	Confident	59 Å²	59	88.3 Å²	88.3	22%	0.223	43%	0.43	C	S	.	.	H	α-helix	trans	-59.9	-40.5	176.5	-168	-166.9	71.5	70.2	6.2	112.4	E820 Q849 E850 F857	E820-R853 VanDerWaalsContact CD-NH1 3.31Å; E820-R853 IonicContact OE1-CZ 3.51Å; E820-R853 IonicContact OE1-NH1 3.76Å; E820-R853 PolarHBondContact OE1-NH1 3.38Å; E820-R853 VanDerWaalsContact OE1-NH1 3.13Å; E820-R853 IonicContact OE1-NH2 2.84Å; E820-R853 PolarHBondContact OE1-NH2 3.17Å; E820-R853 IonicContact OE2-CZ 3.77Å; E820-R853 IonicContact OE2-NH1 2.74Å; E820-R853 PolarHBondContact OE2-NH1 2.91Å; E820-R853 IonicContact OE2-NH2 3.41Å; Q849-R853 VanDerWaalsContact O-CB 3.28Å; Q849-R853 WeakPolarHBondContact O-CB 3.3Å; Q849-R853 PolarHBondContact O-N 3.19Å; E850-R853 PolarHBondContact O-N 3.1Å; E850-R853 IonicContact OE1-CZ 3.16Å; E850-R853 IonicContact OE1-NE 2.67Å; E850-R853 IonicContact OE1-NH2 2.71Å; E850-R853 PolarHBondContact OE1-NH2 2.83Å; E850-R853 IonicContact OE2-CZ 2.85Å; E850-R853 IonicContact OE2-NE 3.32Å; E850-R853 PolarHBondContact OE2-NE 3.33Å; E850-R853 IonicContact OE2-NH2 2.74Å; E850-R853 PolarHBondContact OE2-NH2 2.97Å; R853-F857 WeakPolarHBondContact O-CB 3.49Å; R853-F857 PolarHBondContact O-N 3.11Å
854	R	83	Confident	82.6	Confident	78 Å²	78	88.4 Å²	88.4	29%	0.294	43%	0.426	S	S	.	.	H	α-helix	trans	-67.6	-40.4	175.2	-73.8	178.6	-168.2	-170.1	7.2	112.3	E850 S851 L852 F857 V858	E850-R854 WeakPolarHBondContact O-CB 3.41Å; E850-R854 VanDerWaalsContact O-CG 3.29Å; E850-R854 WeakPolarHBondContact O-CG 3.39Å; E850-R854 PolarHBondContact O-N 3.17Å; E850-R854 IonicContact OE1-CZ 3.5Å; E850-R854 VanDerWaalsContact OE1-CZ 3.24Å; E850-R854 IonicContact OE1-NE 2.77Å; E850-R854 PolarHBondContact OE1-NE 3.44Å; E850-R854 IonicContact OE1-NH2 3.35Å; E850-R854 PolarHBondContact OE1-NH2 3.29Å; S851-R854 PolarHBondContact O-N 3.48Å; L852-R854 VanDerWaalsContact C-N 3.34Å; L852-R854 PolarHBondContact O-N 3.49Å; R854-F857 WeakPolarHBondContact O-CB 3.46Å; R854-F857 PolarHBondContact O-N 3.35Å; R854-V858 WeakPolarHBondContact O-CG2 3.33Å; R854-V858 PolarHBondContact O-N 3.43Å
855	K	82.7	Confident	83.1	Confident	120 Å²	120	79.4 Å²	79.4	52%	0.522	39%	0.393	S	S	.	.	H	α-helix	trans	-62.7	-47.8	173.5	-71.5	173.7	-178.3	-179.8	0	111.3	S851 L852 F857 V858 D859	S851-K855 WeakPolarHBondContact O-CG 3.34Å; S851-K855 PolarHBondContact O-N 2.86Å; L852-K855 PolarHBondContact O-N 2.83Å; K855-F857 VanDerWaalsContact C-N 3.28Å; K855-F857 PolarHBondContact O-N 2.71Å; K855-V858 PolarHBondContact O-N 2.94Å; K855-V858 VanDerWaalsContact O-N 3.09Å; K855-D859 WeakPolarHBondContact O-CB 3.24Å; K855-D859 PolarHBondContact O-N 3.36Å
856	E	84.6	Confident	83.6	Confident	134 Å²	134	75.1 Å²	75.1	63%	0.626	37%	0.37	S	S	*	.	H	α-helix	trans	-57.9	-40.1	175.2	-170.7	-173.5	174.9	0	0	112	L852 S860	L852-E856 WeakPolarHBondContact O-CB 3.25Å; L852-E856 PolarHBondContact O-N 3.13Å; E856-S860 WeakPolarHBondContact O-CA 3.44Å; E856-S860 WeakPolarHBondContact O-CB 3.41Å; E856-S860 PolarHBondContact O-N 3.32Å
857	F	84.9	Confident	84.2	Confident	10 Å²	10	72.4 Å²	72.4	4%	0.044	37%	0.369	C	S	.	.	I	π-helix	trans	-60.8	-45.6	173.7	177.4	-95.7	0	0	0	112.6	L714 L718 T816 E820 R853 R854 K855 K861 L862	L714-F857 HydrophobicContact CD1-CE1 4.29Å; L718-F857 HydrophobicContact CD2-CE1 4.43Å; T816-F857 HydrophobicContact CG2-CE2 3.77Å; T816-F857 HydrophobicContact CG2-CZ 4.2Å; E820-F857 HydrophobicContact CB-CD2 4.29Å; E820-F857 HydrophobicContact CB-CE1 4.46Å; E820-F857 HydrophobicContact CB-CE2 3.62Å; E820-F857 HydrophobicContact CB-CZ 3.73Å; E820-F857 HydrophobicContact CG-CD1 4.25Å; E820-F857 HydrophobicContact CG-CD2 4.09Å; E820-F857 HydrophobicContact CG-CE1 3.92Å; E820-F857 HydrophobicContact CG-CE2 3.77Å; E820-F857 HydrophobicContact CG-CG 4.34Å; E820-F857 HydrophobicContact CG-CZ 3.68Å; R853-F857 WeakPolarHBondContact O-CB 3.49Å; R853-F857 PolarHBondContact O-N 3.11Å; R854-F857 WeakPolarHBondContact O-CB 3.46Å; R854-F857 PolarHBondContact O-N 3.35Å; K855-F857 VanDerWaalsContact C-N 3.28Å; K855-F857 PolarHBondContact O-N 2.71Å; F857-K861 HydrophobicContact CD2-CB 4.39Å; F857-K861 HydrophobicContact CD2-CD 3.95Å; F857-K861 HydrophobicContact CE2-CD 4.24Å; F857-K861 WeakPolarHBondContact O-CA 3.24Å; F857-K861 WeakPolarHBondContact O-CB 3.48Å; F857-K861 PolarHBondContact O-N 3.13Å; F857-K861 VanDerWaalsContact O-N 3.07Å; F857-L862 HydrophobicContact CD1-CD1 4.14Å; F857-L862 HydrophobicContact CD1-CD2 4.44Å; F857-L862 HydrophobicContact CD1-CG 4.07Å; F857-L862 HydrophobicContact CE1-CD1 3.83Å; F857-L862 HydrophobicContact CE1-CD2 3.65Å; F857-L862 HydrophobicContact CE1-CG 3.74Å; F857-L862 HydrophobicContact CZ-CD2 3.85Å; F857-L862 HydrophobicContact CZ-CG 4.35Å; F857-L862 PolarHBondContact O-N 2.94Å; F857-L862 VanDerWaalsContact O-N 3.08Å
858	V	82.2	Confident	84.8	Confident	51 Å²	51	72 Å²	72	31%	0.309	36%	0.363	S	S	.	.	I	π-helix	trans	-66.3	-52.7	177.8	173.2	0	0	0	0	111	D717 R854 K855 L862 A863	D717-V858 HydrophobicContact CB-CG2 4.26Å; R854-V858 WeakPolarHBondContact O-CG2 3.33Å; R854-V858 PolarHBondContact O-N 3.43Å; K855-V858 PolarHBondContact O-N 2.94Å; K855-V858 VanDerWaalsContact O-N 3.09Å; V858-L862 HydrophobicContact CB-CD1 4.41Å; V858-L862 HydrophobicContact CG2-CD1 4.01Å; V858-L862 WeakPolarHBondContact O-CB 3.42Å; V858-L862 PolarHBondContact O-N 3.07Å; V858-A863 PolarHBondContact O-N 2.87Å; V858-A863 VanDerWaalsContact O-N 3.16Å
859	D	82.6	Confident	85.2	Confident	119 Å²	119	66.9 Å²	66.9	64%	0.636	34%	0.339	S	S	*	.	I	π-helix	trans	-73.7	-36.1	-171.6	-64.7	-23.4	0	0	0	112.7	K855 A863	K855-D859 WeakPolarHBondContact O-CB 3.24Å; K855-D859 PolarHBondContact O-N 3.36Å; D859-A863 VanDerWaalsContact O-CB 3.25Å; D859-A863 WeakPolarHBondContact O-CB 3.47Å
860	S	84.8	Confident	85.6	Confident	75 Å²	75	66.9 Å²	66.9	52%	0.524	33%	0.334	S	S	.	.	I	π-helix	trans	-89.4	-57.2	179.7	-170.7	0	0	0	0	112.2	E856 H864	E856-S860 WeakPolarHBondContact O-CA 3.44Å; E856-S860 WeakPolarHBondContact O-CB 3.41Å; E856-S860 PolarHBondContact O-N 3.32Å; S860-H864 VanDerWaalsContact O-CB 3.31Å; S860-H864 WeakPolarHBondContact O-CB 3.3Å; S860-H864 PolarHBondContact O-N 2.92Å
861	K	83.2	Confident	86.1	Confident	100 Å²	100	72 Å²	72	44%	0.435	36%	0.36	S	S	.	.	I	π-helix	trans	-85	-46.7	-169.2	-60.2	-173.6	-176.8	176.8	0	112.6	T816 F857 L865	T816-K861 HydrophobicContact CG2-CD 4.3Å; F857-K861 HydrophobicContact CD2-CB 4.39Å; F857-K861 HydrophobicContact CD2-CD 3.95Å; F857-K861 HydrophobicContact CE2-CD 4.24Å; F857-K861 WeakPolarHBondContact O-CA 3.24Å; F857-K861 WeakPolarHBondContact O-CB 3.48Å; F857-K861 PolarHBondContact O-N 3.13Å; F857-K861 VanDerWaalsContact O-N 3.07Å; K861-L865 WeakPolarHBondContact O-CG 3.45Å; K861-L865 PolarHBondContact O-N 3.08Å
862	L	84.4	Confident	86.6	Confident	9 Å²	9	70.6 Å²	70.6	5%	0.047	35%	0.348	C	S	.	.	I	π-helix	trans	-70.4	-40.4	-178.5	-57.8	-175.3	0	0	0	112	D717 L718 V721 F857 V858 H864 L865 Q866	D717-L862 HydrophobicContact CB-CD1 4.33Å; D717-L862 WeakPolarHBondContact O-CD1 3.23Å; L718-L862 HydrophobicContact CD2-CD1 4.26Å; L718-L862 HydrophobicContact CD2-CD2 3.62Å; V721-L862 HydrophobicContact CG2-CB 4.15Å; V721-L862 HydrophobicContact CG2-CD2 4.46Å; F857-L862 HydrophobicContact CD1-CD1 4.14Å; F857-L862 HydrophobicContact CD1-CD2 4.44Å; F857-L862 HydrophobicContact CD1-CG 4.07Å; F857-L862 HydrophobicContact CE1-CD1 3.83Å; F857-L862 HydrophobicContact CE1-CD2 3.65Å; F857-L862 HydrophobicContact CE1-CG 3.74Å; F857-L862 HydrophobicContact CZ-CD2 3.85Å; F857-L862 HydrophobicContact CZ-CG 4.35Å; F857-L862 PolarHBondContact O-N 2.94Å; F857-L862 VanDerWaalsContact O-N 3.08Å; V858-L862 HydrophobicContact CB-CD1 4.41Å; V858-L862 HydrophobicContact CG2-CD1 4.01Å; V858-L862 WeakPolarHBondContact O-CB 3.42Å; V858-L862 PolarHBondContact O-N 3.07Å; L862-H864 PolarHBondContact O-N 3.29Å; L862-L865 PolarHBondContact O-N 3.35Å; L862-Q866 VanDerWaalsContact O-CB 3.26Å; L862-Q866 WeakPolarHBondContact O-CB 3.28Å; L862-Q866 PolarHBondContact O-N 2.81Å
863	A	85.6	Confident	86.9	Confident	45 Å²	45	66 Å²	66	37%	0.372	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-43	175.7	0	0	0	0	0	112.5	V858 D859 Q866 A867	V858-A863 PolarHBondContact O-N 2.87Å; V858-A863 VanDerWaalsContact O-N 3.16Å; D859-A863 VanDerWaalsContact O-CB 3.25Å; D859-A863 WeakPolarHBondContact O-CB 3.47Å; A863-Q866 PolarHBondContact O-N 3.09Å; A863-A867 PolarHBondContact O-N 3.39Å
864	H	88.9	Confident	87.1	Confident	115 Å²	115	66 Å²	66	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-44.1	176.1	178.6	-110.8	0	0	0	112.5	S860 L862 Q866 A867 R868	S860-H864 VanDerWaalsContact O-CB 3.31Å; S860-H864 WeakPolarHBondContact O-CB 3.3Å; S860-H864 PolarHBondContact O-N 2.92Å; L862-H864 PolarHBondContact O-N 3.29Å; H864-Q866 VanDerWaalsContact C-N 3.35Å; H864-Q866 PolarHBondContact O-N 3.16Å; H864-A867 PolarHBondContact O-N 2.87Å; H864-R868 PolarHBondContact O-N 3.45Å
865	L	86.3	Confident	87.5	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.052	34%	0.343	C	S	.	.	H	α-helix	trans	-62.4	-41.4	174	-73.4	169.5	0	0	0	111.7	F813 T816 K861 L862 A867 R868 I869	F813-L865 HydrophobicContact CD2-CD1 4.42Å; T816-L865 HydrophobicContact CG2-CD1 4.34Å; K861-L865 WeakPolarHBondContact O-CG 3.45Å; K861-L865 PolarHBondContact O-N 3.08Å; L862-L865 PolarHBondContact O-N 3.35Å; L865-A867 VanDerWaalsContact C-N 3.35Å; L865-A867 PolarHBondContact O-N 3.35Å; L865-R868 PolarHBondContact O-N 2.89Å; L865-I869 VanDerWaalsContact O-CG1 3.29Å; L865-I869 WeakPolarHBondContact O-CG1 3.45Å; L865-I869 PolarHBondContact O-N 2.87Å
866	Q	89.2	Confident	88	Confident	30 Å²	30	58.9 Å²	58.9	14%	0.14	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-40.9	176.7	-166.1	-171.8	47.4	0	0	112.1	V721 L724 L862 A863 H864 R870	V721-Q866 HydrophobicContact CG2-CB 4.5Å; L724-Q866 HydrophobicContact CD1-CG 3.58Å; L862-Q866 VanDerWaalsContact O-CB 3.26Å; L862-Q866 WeakPolarHBondContact O-CB 3.28Å; L862-Q866 PolarHBondContact O-N 2.81Å; A863-Q866 PolarHBondContact O-N 3.09Å; H864-Q866 VanDerWaalsContact C-N 3.35Å; H864-Q866 PolarHBondContact O-N 3.16Å; Q866-R870 VanDerWaalsContact NE2-NH2 3.2Å; Q866-R870 WeakPolarHBondContact O-CG 3.38Å; Q866-R870 PolarHBondContact O-N 2.82Å; Q866-R870 VanDerWaalsContact O-N 3.13Å
867	A	89.2	Confident	88.3	Confident	43 Å²	43	56.9 Å²	56.9	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-47.4	174.5	0	0	0	0	0	111.5	A863 H864 L865 I869 R870 I871	A863-A867 PolarHBondContact O-N 3.39Å; H864-A867 PolarHBondContact O-N 2.87Å; L865-A867 VanDerWaalsContact C-N 3.35Å; L865-A867 PolarHBondContact O-N 3.35Å; A867-I869 PolarHBondContact O-N 2.87Å; A867-R870 PolarHBondContact O-N 2.99Å; A867-I871 WeakPolarHBondContact O-CG1 3.29Å; A867-I871 PolarHBondContact O-N 3.03Å
868	R	91.4	Very high	88.5	Confident	87 Å²	87	59.2 Å²	59.2	33%	0.328	33%	0.327	S	S	.	.	H	α-helix	trans	-56.2	-47.7	175.5	-74.6	178	64.6	-163.2	0.3	112.1	L809 D812 H864 L865 R870 I871 Q872	L809-R868 HydrophobicContact CD1-CB 3.72Å; D812-R868 IonicContact OD2-CZ 3.33Å; D812-R868 VanDerWaalsContact OD2-CZ 3.26Å; D812-R868 IonicContact OD2-NH1 3.75Å; D812-R868 PolarHBondContact OD2-NH1 3.23Å; D812-R868 IonicContact OD2-NH2 2.96Å; D812-R868 PolarHBondContact OD2-NH2 3.21Å; H864-R868 PolarHBondContact O-N 3.45Å; L865-R868 PolarHBondContact O-N 2.89Å; R868-R870 PolarHBondContact O-N 3.48Å; R868-I871 PolarHBondContact O-N 3.16Å; R868-Q872 WeakPolarHBondContact O-CB 3.49Å; R868-Q872 PolarHBondContact O-N 3.38Å
869	I	90.5	Very high	88.9	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-46.5	177.8	-67.9	161.7	0	0	0	111.2	V721 L724 L725 L809 L865 A867 Q872 A873	V721-I869 HydrophobicContact CG1-CD1 3.69Å; L724-I869 HydrophobicContact CB-CG2 4.21Å; L725-I869 HydrophobicContact CD1-CD1 3.88Å; L725-I869 HydrophobicContact CD1-CG1 4.13Å; L809-I869 HydrophobicContact CD1-CG1 3.98Å; L809-I869 HydrophobicContact CD2-CD1 4.1Å; L809-I869 HydrophobicContact CD2-CG1 3.43Å; L809-I869 VanDerWaalsContact CD2-CG1 3.43Å; L809-I869 HydrophobicContact CG-CG1 4.35Å; L865-I869 VanDerWaalsContact O-CG1 3.29Å; L865-I869 WeakPolarHBondContact O-CG1 3.45Å; L865-I869 PolarHBondContact O-N 2.87Å; A867-I869 PolarHBondContact O-N 2.87Å; I869-Q872 PolarHBondContact O-N 2.8Å; I869-A873 VanDerWaalsContact O-CB 3.32Å; I869-A873 WeakPolarHBondContact O-CB 3.46Å; I869-A873 PolarHBondContact O-N 2.69Å
870	R	91.2	Very high	89.3	Confident	131 Å²	131	53.2 Å²	53.2	49%	0.494	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-43.8	-179.7	-75.6	179.1	176.7	130.8	-0.3	112.5	Q866 A867 R868 Q872 A873 A874	Q866-R870 VanDerWaalsContact NE2-NH2 3.2Å; Q866-R870 WeakPolarHBondContact O-CG 3.38Å; Q866-R870 PolarHBondContact O-N 2.82Å; Q866-R870 VanDerWaalsContact O-N 3.13Å; A867-R870 PolarHBondContact O-N 2.99Å; R868-R870 PolarHBondContact O-N 3.48Å; R870-Q872 VanDerWaalsContact C-N 3.34Å; R870-A873 PolarHBondContact O-N 3.16Å; R870-A874 WeakPolarHBondContact O-CB 3.38Å; R870-A874 PolarHBondContact O-N 3.44Å
871	I	92.4	Very high	89.6	Confident	123 Å²	123	51.3 Å²	51.3	63%	0.631	28%	0.276	S	S	*	.	H	α-helix	trans	-61.4	-45.7	177.8	-67.7	164.1	0	0	0	110	A867 R868 A874 A875	A867-I871 WeakPolarHBondContact O-CG1 3.29Å; A867-I871 PolarHBondContact O-N 3.03Å; R868-I871 PolarHBondContact O-N 3.16Å; I871-A874 PolarHBondContact O-N 2.8Å; I871-A875 PolarHBondContact O-N 2.85Å
872	Q	90.9	Very high	89.8	Confident	27 Å²	27	51.6 Å²	51.6	13%	0.126	28%	0.278	C	S	.	.	H	α-helix	trans	-68.9	-40.4	-179.4	-168.4	-179.1	-5.7	0	0	113	F728 S802 D805 R868 I869 R870 A874 A875 Y876	F728-Q872 HydrophobicContact CE1-CB 4.36Å; F728-Q872 HydrophobicContact CE1-CG 4.03Å; F728-Q872 HydrophobicContact CZ-CG 4.1Å; S802-Q872 PolarHBondContact O-NE2 3.42Å; D805-Q872 VanDerWaalsContact CB-NE2 3.32Å; R868-Q872 WeakPolarHBondContact O-CB 3.49Å; R868-Q872 PolarHBondContact O-N 3.38Å; I869-Q872 PolarHBondContact O-N 2.8Å; R870-Q872 VanDerWaalsContact C-N 3.34Å; Q872-A874 VanDerWaalsContact C-N 3.31Å; Q872-A874 PolarHBondContact O-N 3.45Å; Q872-A875 PolarHBondContact O-N 2.96Å; Q872-Y876 WeakPolarHBondContact O-CB 3.26Å; Q872-Y876 PolarHBondContact O-N 3.36Å
873	A	91	Very high	90.1	Very high	15 Å²	15	51.2 Å²	51.2	12%	0.124	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-37.9	174.5	0	0	0	0	0	111.8	F728 I869 R870 R877	F728-A873 HydrophobicContact CD1-CB 4.35Å; F728-A873 HydrophobicContact CD2-CB 3.89Å; F728-A873 HydrophobicContact CE2-CB 4.08Å; F728-A873 HydrophobicContact CG-CB 4.05Å; F728-A873 HydrophobicContact CZ-CB 4.39Å; I869-A873 VanDerWaalsContact O-CB 3.32Å; I869-A873 WeakPolarHBondContact O-CB 3.46Å; I869-A873 PolarHBondContact O-N 2.69Å; R870-A873 PolarHBondContact O-N 3.16Å; A873-R877 WeakPolarHBondContact O-CB 3.37Å; A873-R877 VanDerWaalsContact O-CG 3.32Å; A873-R877 WeakPolarHBondContact O-CG 3.26Å; A873-R877 PolarHBondContact O-N 3.27Å
874	A	90.8	Very high	90.2	Very high	59 Å²	59	49.5 Å²	49.5	49%	0.488	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-42.3	173.3	0	0	0	0	0	112.3	R870 I871 Q872 R877 A878	R870-A874 WeakPolarHBondContact O-CB 3.38Å; R870-A874 PolarHBondContact O-N 3.44Å; I871-A874 PolarHBondContact O-N 2.8Å; Q872-A874 VanDerWaalsContact C-N 3.31Å; Q872-A874 PolarHBondContact O-N 3.45Å; A874-R877 PolarHBondContact O-N 2.93Å; A874-A878 PolarHBondContact O-N 3.47Å
875	A	91.3	Very high	90.1	Very high	49 Å²	49	47.5 Å²	47.5	41%	0.405	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-43.2	176.2	0	0	0	0	0	112.4	I871 Q872 A878 N879	I871-A875 PolarHBondContact O-N 2.85Å; Q872-A875 PolarHBondContact O-N 2.96Å; A875-A878 PolarHBondContact O-N 3.32Å; A875-N879 WeakPolarHBondContact O-CB 3.07Å; A875-N879 PolarHBondContact O-N 2.73Å; A875-N879 PolarHBondContact O-ND2 2.95Å
876	Y	92.4	Very high	90.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.1	-47.4	173.4	173.6	-91.8	0	0	0	111.5	F728 E731 I732 F735 I799 Q872 A878 N879 L880	F728-Y876 AromaticContact CE2-CD1 3.9Å; F728-Y876 HydrophobicContact CE2-CD1 3.9Å; F728-Y876 HydrophobicContact CE2-CD2 4.4Å; F728-Y876 AromaticContact CE2-CG 3.73Å; F728-Y876 HydrophobicContact CE2-CG 3.73Å; F728-Y876 HydrophobicContact CZ-CG 4.32Å; E731-Y876 HydrophobicContact CG-CE1 4.08Å; I732-Y876 HydrophobicContact CG1-CD2 4.23Å; I732-Y876 HydrophobicContact CG1-CE1 4.26Å; I732-Y876 HydrophobicContact CG1-CE2 3.83Å; F735-Y876 VanDerWaalsContact CB-OH 3.22Å; F735-Y876 WeakPolarHBondContact CB-OH 3.28Å; I799-Y876 HydrophobicContact CG2-CD2 4.44Å; I799-Y876 HydrophobicContact CG2-CE2 3.83Å; Q872-Y876 WeakPolarHBondContact O-CB 3.26Å; Q872-Y876 PolarHBondContact O-N 3.36Å; Y876-A878 PolarHBondContact O-N 3.04Å; Y876-N879 WeakPolarHBondContact O-CB 3.39Å; Y876-N879 PolarHBondContact O-N 3.22Å; Y876-L880 HydrophobicContact CE1-CB 4.45Å; Y876-L880 HydrophobicContact CE1-CD2 3.79Å; Y876-L880 WeakPolarHBondContact O-CB 3.3Å; Y876-L880 PolarHBondContact O-N 2.8Å
877	R	90.6	Very high	89.9	Confident	93 Å²	93	47.7 Å²	47.7	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-45.1	177.8	-78.9	172.2	-178	-172.1	2.2	112.9	E731 A873 A874 N879 L880 I881	E731-R877 WeakPolarHBondContact OE1-CG 3.31Å; E731-R877 IonicContact OE1-NE 3.93Å; E731-R877 PolarHBondContact OE1-NE 3.23Å; E731-R877 VanDerWaalsContact OE1-NE 3.07Å; E731-R877 IonicContact OE2-CZ 2.71Å; E731-R877 IonicContact OE2-NE 3.71Å; E731-R877 PolarHBondContact OE2-NE 3.38Å; E731-R877 IonicContact OE2-NH2 3.99Å; E731-R877 PolarHBondContact OE2-NH2 3.19Å; A873-R877 WeakPolarHBondContact O-CB 3.37Å; A873-R877 VanDerWaalsContact O-CG 3.32Å; A873-R877 WeakPolarHBondContact O-CG 3.26Å; A873-R877 PolarHBondContact O-N 3.27Å; A874-R877 PolarHBondContact O-N 2.93Å; R877-N879 VanDerWaalsContact C-N 3.29Å; R877-N879 PolarHBondContact O-N 3.37Å; R877-L880 PolarHBondContact O-N 2.85Å; R877-I881 WeakPolarHBondContact O-CB 3.36Å; R877-I881 VanDerWaalsContact O-CG1 3.31Å; R877-I881 WeakPolarHBondContact O-CG1 3.47Å; R877-I881 PolarHBondContact O-N 3.01Å
878	A	90.5	Very high	89.6	Confident	59 Å²	59	48.3 Å²	48.3	49%	0.488	26%	0.256	S	S	.	.	H	α-helix	trans	-60.3	-41.4	175.5	0	0	0	0	0	111.6	A874 A875 Y876 K882	A874-A878 PolarHBondContact O-N 3.47Å; A875-A878 PolarHBondContact O-N 3.32Å; Y876-A878 PolarHBondContact O-N 3.04Å; A878-K882 WeakPolarHBondContact O-CB 3.37Å; A878-K882 PolarHBondContact O-N 2.84Å; A878-K882 VanDerWaalsContact O-N 3.15Å
879	N	90.2	Very high	89.3	Confident	43 Å²	43	50.8 Å²	50.8	23%	0.23	28%	0.276	C	S	.	.	H	α-helix	trans	-66.8	-36	175.9	-80.4	-29.9	0	0	0	113.3	Q795 I799 A875 Y876 R877 F883	Q795-N879 VanDerWaalsContact NE2-CA 3.27Å; Q795-N879 PolarHBondContact NE2-O 3.33Å; Q795-N879 PolarHBondContact NE2-OD1 2.86Å; Q795-N879 VanDerWaalsContact NE2-OD1 3.07Å; I799-N879 HydrophobicContact CG1-CB 4.16Å; A875-N879 WeakPolarHBondContact O-CB 3.07Å; A875-N879 PolarHBondContact O-N 2.73Å; A875-N879 PolarHBondContact O-ND2 2.95Å; Y876-N879 WeakPolarHBondContact O-CB 3.39Å; Y876-N879 PolarHBondContact O-N 3.22Å; R877-N879 VanDerWaalsContact C-N 3.29Å; R877-N879 PolarHBondContact O-N 3.37Å; N879-F883 WeakPolarHBondContact O-CB 3.42Å; N879-F883 PolarHBondContact O-N 2.72Å; N879-F883 VanDerWaalsContact O-N 3.1Å
880	L	91.2	Very high	88.8	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-74.6	-43.6	179.1	-179.3	58.4	0	0	0	112.2	F735 Y876 R877 K882 F883 I884 I902 Y908	F735-L880 HydrophobicContact CD2-CD1 3.51Å; F735-L880 HydrophobicContact CE2-CD1 3.66Å; F735-L880 HydrophobicContact CG-CD1 4.31Å; Y876-L880 HydrophobicContact CE1-CB 4.45Å; Y876-L880 HydrophobicContact CE1-CD2 3.79Å; Y876-L880 WeakPolarHBondContact O-CB 3.3Å; Y876-L880 PolarHBondContact O-N 2.8Å; R877-L880 PolarHBondContact O-N 2.85Å; L880-K882 PolarHBondContact O-N 2.74Å; L880-F883 HydrophobicContact CD1-CD1 4.48Å; L880-F883 WeakPolarHBondContact O-CB 3.12Å; L880-F883 PolarHBondContact O-N 2.72Å; L880-F883 VanDerWaalsContact O-N 3.13Å; L880-I884 HydrophobicContact CD1-CD1 4.22Å; L880-I884 HydrophobicContact CD1-CG1 4.35Å; L880-I884 HydrophobicContact CG-CD1 4.04Å; L880-I884 WeakPolarHBondContact O-CG1 3.34Å; L880-I884 PolarHBondContact O-N 3.35Å; L880-I902 HydrophobicContact CD1-CG2 4.21Å; L880-Y908 HydrophobicContact CD2-CD1 4.34Å; L880-Y908 HydrophobicContact CD2-CE1 3.63Å; L880-Y908 HydrophobicContact CD2-CE2 4.27Å; L880-Y908 HydrophobicContact CG-CE1 4.47Å
881	I	89.8	Confident	88.1	Confident	35 Å²	35	50.4 Å²	50.4	18%	0.179	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-50.2	174.8	-68.9	165.3	0	0	0	109.6	R877 F883 I884 D885 T912	R877-I881 WeakPolarHBondContact O-CB 3.36Å; R877-I881 VanDerWaalsContact O-CG1 3.31Å; R877-I881 WeakPolarHBondContact O-CG1 3.47Å; R877-I881 PolarHBondContact O-N 3.01Å; I881-F883 PolarHBondContact O-N 3.39Å; I881-I884 PolarHBondContact O-N 3Å; I881-I884 VanDerWaalsContact O-N 3.11Å; I881-D885 PolarHBondContact O-N 2.77Å; I881-T912 HydrophobicContact CG2-CG2 3.92Å
882	K	88.9	Confident	87.3	Confident	107 Å²	107	47.7 Å²	47.7	47%	0.465	27%	0.273	S	S	.	.	H	α-helix	trans	-57.6	-36.8	175.5	-176.3	-176.5	170.2	-150.2	0	112.6	A878 L880 M886	A878-K882 WeakPolarHBondContact O-CB 3.37Å; A878-K882 PolarHBondContact O-N 2.84Å; A878-K882 VanDerWaalsContact O-N 3.15Å; L880-K882 PolarHBondContact O-N 2.74Å; K882-M886 HydrophobicContact CG-SD 4.13Å; K882-M886 WeakPolarHBondContact O-CB 3.38Å; K882-M886 WeakPolarHBondContact O-CG 3.16Å; K882-M886 PolarHBondContact O-N 3.2Å
883	F	89.4	Confident	86.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-68.3	-42.6	176.3	-177.9	-113.8	0	0	0	112.2	F735 L784 L792 Q795 L796 I799 N879 L880 I881 M886 L887 I902	F735-F883 HydrophobicContact CE2-CD1 4.02Å; F735-F883 AromaticContact CE2-CE1 3.87Å; F735-F883 HydrophobicContact CE2-CE1 3.87Å; F735-F883 HydrophobicContact CZ-CD1 4.37Å; F735-F883 HydrophobicContact CZ-CE1 4.08Å; L784-F883 HydrophobicContact CD1-CZ 4.29Å; L792-F883 HydrophobicContact CB-CE2 4.35Å; L792-F883 HydrophobicContact CD2-CD2 4.07Å; L792-F883 HydrophobicContact CD2-CE2 3.99Å; Q795-F883 HydrophobicContact CB-CD2 4.2Å; Q795-F883 HydrophobicContact CG-CB 3.91Å; Q795-F883 HydrophobicContact CG-CD2 4.12Å; Q795-F883 HydrophobicContact CG-CG 4.48Å; L796-F883 HydrophobicContact CB-CE2 4.17Å; L796-F883 HydrophobicContact CD1-CZ 4.38Å; I799-F883 HydrophobicContact CD1-CB 3.82Å; I799-F883 HydrophobicContact CD1-CD1 4.01Å; I799-F883 HydrophobicContact CD1-CD2 4.45Å; I799-F883 HydrophobicContact CD1-CG 3.86Å; N879-F883 WeakPolarHBondContact O-CB 3.42Å; N879-F883 PolarHBondContact O-N 2.72Å; N879-F883 VanDerWaalsContact O-N 3.1Å; L880-F883 HydrophobicContact CD1-CD1 4.48Å; L880-F883 WeakPolarHBondContact O-CB 3.12Å; L880-F883 PolarHBondContact O-N 2.72Å; L880-F883 VanDerWaalsContact O-N 3.13Å; I881-F883 PolarHBondContact O-N 3.39Å; F883-M886 PolarHBondContact O-N 3.31Å; F883-L887 HydrophobicContact CD1-CD1 3.85Å; F883-L887 HydrophobicContact CE1-CD1 3.45Å; F883-L887 VanDerWaalsContact CE1-CD1 3.45Å; F883-L887 HydrophobicContact CE1-CG 4.25Å; F883-L887 HydrophobicContact CE2-CD1 4.39Å; F883-L887 HydrophobicContact CE2-CG 4.35Å; F883-L887 HydrophobicContact CG-CD1 4.48Å; F883-L887 HydrophobicContact CZ-CD1 3.75Å; F883-L887 HydrophobicContact CZ-CD2 4.32Å; F883-L887 HydrophobicContact CZ-CG 4.16Å; F883-L887 WeakPolarHBondContact O-CG 3.3Å; F883-L887 PolarHBondContact O-N 3.42Å; F883-I902 HydrophobicContact CE1-CD1 4.22Å
884	I	88.5	Confident	86.2	Confident	9 Å²	9	50.9 Å²	50.9	5%	0.046	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-43.7	175.1	-65.7	163.3	0	0	0	110.6	L880 I881 M886 L887 S888 A899 I902 Y908	L880-I884 HydrophobicContact CD1-CD1 4.22Å; L880-I884 HydrophobicContact CD1-CG1 4.35Å; L880-I884 HydrophobicContact CG-CD1 4.04Å; L880-I884 WeakPolarHBondContact O-CG1 3.34Å; L880-I884 PolarHBondContact O-N 3.35Å; I881-I884 PolarHBondContact O-N 3Å; I881-I884 VanDerWaalsContact O-N 3.11Å; I884-M886 VanDerWaalsContact C-N 3.31Å; I884-M886 PolarHBondContact O-N 3.41Å; I884-L887 PolarHBondContact O-N 2.86Å; I884-S888 WeakPolarHBondContact O-CB 3.25Å; I884-S888 PolarHBondContact O-N 3.47Å; I884-S888 PolarHBondContact O-OG 2.87Å; I884-A899 HydrophobicContact CG2-CB 4.47Å; I884-I902 HydrophobicContact CD1-CG2 3.74Å; I884-I902 HydrophobicContact CG1-CG2 3.97Å; I884-Y908 HydrophobicContact CD1-CD2 3.78Å; I884-Y908 HydrophobicContact CD1-CE2 4.47Å; I884-Y908 HydrophobicContact CD1-CG 3.88Å
885	D	86.7	Confident	85.7	Confident	73 Å²	73	48.1 Å²	48.1	39%	0.39	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-33.3	176.4	-68.7	-23.3	0	0	0	112.5	I881 S888 N889	I881-D885 PolarHBondContact O-N 2.77Å; D885-S888 PolarHBondContact O-OG 2.84Å; D885-S888 VanDerWaalsContact O-OG 3.13Å; D885-N889 PolarHBondContact O-ND2 2.94Å
886	M	86.2	Confident	85.3	Confident	45 Å²	45	50.5 Å²	50.5	22%	0.222	27%	0.272	C	S	.	.	H	α-helix	trans	-75.1	-33.6	173.9	-71.1	172.8	66.3	0	0	112.5	Q791 L792 Q795 K882 F883 I884	Q791-M886 HydrophobicContact CB-CE 3.69Å; L792-M886 HydrophobicContact CD2-CB 3.49Å; L792-M886 VanDerWaalsContact CD2-CB 3.49Å; L792-M886 HydrophobicContact CD2-CE 4.27Å; L792-M886 HydrophobicContact CG-CE 4.47Å; Q795-M886 HydrophobicContact CB-SD 4.48Å; Q795-M886 HydrophobicContact CG-SD 4.5Å; K882-M886 HydrophobicContact CG-SD 4.13Å; K882-M886 WeakPolarHBondContact O-CB 3.38Å; K882-M886 WeakPolarHBondContact O-CG 3.16Å; K882-M886 PolarHBondContact O-N 3.2Å; F883-M886 PolarHBondContact O-N 3.31Å; I884-M886 VanDerWaalsContact C-N 3.31Å; I884-M886 PolarHBondContact O-N 3.41Å
887	L	85.6	Confident	84.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-72.3	-40.3	176.2	-75.1	174.4	0	0	0	112.6	L792 F883 I884 N889 H890 L895 L898 A899 I902	L792-L887 HydrophobicContact CD1-CD2 4Å; L792-L887 HydrophobicContact CD2-CD2 3.9Å; L792-L887 HydrophobicContact CD2-CG 4.02Å; F883-L887 HydrophobicContact CD1-CD1 3.85Å; F883-L887 HydrophobicContact CE1-CD1 3.45Å; F883-L887 VanDerWaalsContact CE1-CD1 3.45Å; F883-L887 HydrophobicContact CE1-CG 4.25Å; F883-L887 HydrophobicContact CE2-CD1 4.39Å; F883-L887 HydrophobicContact CE2-CG 4.35Å; F883-L887 HydrophobicContact CG-CD1 4.48Å; F883-L887 HydrophobicContact CZ-CD1 3.75Å; F883-L887 HydrophobicContact CZ-CD2 4.32Å; F883-L887 HydrophobicContact CZ-CG 4.16Å; F883-L887 WeakPolarHBondContact O-CG 3.3Å; F883-L887 PolarHBondContact O-N 3.42Å; I884-L887 PolarHBondContact O-N 2.86Å; L887-N889 VanDerWaalsContact C-N 3.26Å; L887-N889 PolarHBondContact O-N 3.02Å; L887-H890 WeakPolarHBondContact O-CB 3.37Å; L887-H890 PolarHBondContact O-N 3.39Å; L887-H890 VanDerWaalsContact O-N 3.14Å; L887-L895 HydrophobicContact CD2-CB 4.09Å; L887-L895 HydrophobicContact CD2-CD2 4.2Å; L887-L898 HydrophobicContact CD1-CD2 3.94Å; L887-L898 HydrophobicContact CD1-CG 4Å; L887-L898 HydrophobicContact CD2-CD2 4.34Å; L887-A899 HydrophobicContact CB-CB 3.93Å; L887-I902 HydrophobicContact CD1-CD1 4.24Å
888	S	83.1	Confident	84.6	Confident	56 Å²	56	49.1 Å²	49.1	39%	0.392	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-30.3	-179.1	63.8	0	0	0	0	112.9	I884 D885 R896	I884-S888 WeakPolarHBondContact O-CB 3.25Å; I884-S888 PolarHBondContact O-N 3.47Å; I884-S888 PolarHBondContact O-OG 2.87Å; D885-S888 PolarHBondContact O-OG 2.84Å; D885-S888 VanDerWaalsContact O-OG 3.13Å; S888-R896 WeakPolarHBondContact O-CD 3.39Å
889	N	83.7	Confident	84.3	Confident	138 Å²	138	46.7 Å²	46.7	74%	0.738	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-2	175.8	-72.7	-60.3	0	0	0	114.1	D885 L887	D885-N889 PolarHBondContact O-ND2 2.94Å; L887-N889 VanDerWaalsContact C-N 3.26Å; L887-N889 PolarHBondContact O-N 3.02Å
890	H	80.4	Confident	83.9	Confident	29 Å²	29	50.7 Å²	50.7	13%	0.134	27%	0.269	C	S	.	.			trans	-73.7	146.3	-179.5	-156	-87.6	0	0	0	112	L887 D892 L895 R896	L887-H890 WeakPolarHBondContact O-CB 3.37Å; L887-H890 PolarHBondContact O-N 3.39Å; L887-H890 VanDerWaalsContact O-N 3.14Å; H890-D892 IonicContact CE1-OD2 3.82Å; H890-D892 PolarHBondContact CE1-OD2 3.14Å; H890-D892 VanDerWaalsContact CE1-OD2 3.3Å; H890-D892 PolarHBondContact ND1-N 3.29Å; H890-D892 IonicContact ND1-OD2 3.81Å; H890-L895 HydrophobicContact CB-CB 4.38Å; H890-R896 PolarHBondContact O-NE 3.49Å
891	T	77.3	Confident	83.6	Confident	99 Å²	99	54.2 Å²	54.2	61%	0.607	29%	0.285	S	S	*	.	S	Bend	trans	-58.3	-52.5	179.7	46.3	0	0	0	0	111.4	C893 R896	T891-C893 PolarHBondContact O-N 3.08Å; T891-R896 PolarHBondContact O-NH2 3.04Å
892	D	75.3	Confident	83.4	Confident	66 Å²	66	52.6 Å²	52.6	35%	0.353	28%	0.276	S	S	.	.			trans	-58.1	125.3	-178.6	-68.3	-40.3	0	0	0	114.2	H890 S894 L895 R896	H890-D892 IonicContact CE1-OD2 3.82Å; H890-D892 PolarHBondContact CE1-OD2 3.14Å; H890-D892 VanDerWaalsContact CE1-OD2 3.3Å; H890-D892 PolarHBondContact ND1-N 3.29Å; H890-D892 IonicContact ND1-OD2 3.81Å; D892-S894 VanDerWaalsContact C-N 3.25Å; D892-S894 PolarHBondContact O-N 2.9Å; D892-L895 HydrophobicContact CB-CB 4.47Å; D892-L895 HydrophobicContact CB-CD1 4.32Å; D892-L895 HydrophobicContact CB-CG 4.35Å; D892-L895 PolarHBondContact O-N 3Å; D892-R896 PolarHBondContact O-N 3.16Å
893	C	80	Confident	83.3	Confident	87 Å²	87	48.8 Å²	48.8	59%	0.588	26%	0.261	S	S	*	.	H	α-helix	trans	-59.7	-34.8	175.7	-58.1	0	0	0	0	112.7	T891 L895 R896 L897	T891-C893 PolarHBondContact O-N 3.08Å; C893-L895 VanDerWaalsContact C-N 3.35Å; C893-L895 PolarHBondContact O-N 2.86Å; C893-R896 PolarHBondContact O-N 3.43Å; C893-R896 PolarHBondContact SG-NH2 3.43Å; C893-L897 PolarHBondContact O-N 2.87Å; C893-L897 VanDerWaalsContact O-N 3.14Å
894	S	78.8	Confident	83	Confident	21 Å²	21	56.9 Å²	56.9	15%	0.147	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-32	-177.2	55.4	0	0	0	0	112.9	Y742 D892 L897 L898	Y742-S894 WeakPolarHBondContact CE2-O 3.25Å; D892-S894 VanDerWaalsContact C-N 3.25Å; D892-S894 PolarHBondContact O-N 2.9Å; S894-L897 PolarHBondContact O-N 3.18Å; S894-L898 PolarHBondContact O-N 2.85Å
895	L	80.5	Confident	82.7	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-78.1	-26.8	176.2	-68.6	177.2	0	0	0	112.4	Y742 L784 L792 L887 H890 D892 C893 L898 A899	Y742-L895 HydrophobicContact CE1-CD2 4.4Å; L784-L895 HydrophobicContact CD2-CD1 3.63Å; L784-L895 HydrophobicContact CD2-CD2 3.59Å; L784-L895 HydrophobicContact CD2-CG 4.28Å; L784-L895 HydrophobicContact CG-CD2 4.16Å; L792-L895 HydrophobicContact CD1-CD1 4.37Å; L887-L895 HydrophobicContact CD2-CB 4.09Å; L887-L895 HydrophobicContact CD2-CD2 4.2Å; H890-L895 HydrophobicContact CB-CB 4.38Å; D892-L895 HydrophobicContact CB-CB 4.47Å; D892-L895 HydrophobicContact CB-CD1 4.32Å; D892-L895 HydrophobicContact CB-CG 4.35Å; D892-L895 PolarHBondContact O-N 3Å; C893-L895 VanDerWaalsContact C-N 3.35Å; C893-L895 PolarHBondContact O-N 2.86Å; L895-L898 WeakPolarHBondContact O-CB 3.37Å; L895-L898 PolarHBondContact O-N 3.47Å; L895-A899 PolarHBondContact O-N 2.94Å
896	R	82.4	Confident	82.3	Confident	100 Å²	100	60.3 Å²	60.3	38%	0.377	32%	0.32	S	S	.	.	H	α-helix	trans	-67.5	-38.3	168.6	-72.1	-176.8	-84.9	137.3	-6.3	112.2	S888 H890 T891 D892 C893 L898 A899 E900	S888-R896 WeakPolarHBondContact O-CD 3.39Å; H890-R896 PolarHBondContact O-NE 3.49Å; T891-R896 PolarHBondContact O-NH2 3.04Å; D892-R896 PolarHBondContact O-N 3.16Å; C893-R896 PolarHBondContact O-N 3.43Å; C893-R896 PolarHBondContact SG-NH2 3.43Å; R896-L898 VanDerWaalsContact C-N 3.31Å; R896-L898 PolarHBondContact O-N 2.93Å; R896-A899 WeakPolarHBondContact O-CB 3.44Å; R896-A899 PolarHBondContact O-N 3.45Å; R896-A899 VanDerWaalsContact O-N 3.11Å; R896-E900 PolarHBondContact O-N 3.07Å
897	L	82	Confident	82.1	Confident	64 Å²	64	63.3 Å²	63.3	34%	0.335	33%	0.333	S	S	.	.	H	α-helix	trans	-58.3	-41.8	170.7	-65	173.6	0	0	0	111.8	C893 S894 A899 E900 H901	C893-L897 PolarHBondContact O-N 2.87Å; C893-L897 VanDerWaalsContact O-N 3.14Å; S894-L897 PolarHBondContact O-N 3.18Å; L897-A899 VanDerWaalsContact C-N 3.3Å; L897-A899 PolarHBondContact O-N 3.33Å; L897-E900 PolarHBondContact O-N 2.73Å; L897-E900 VanDerWaalsContact O-N 3.15Å; L897-H901 PolarHBondContact O-CD2 3.11Å; L897-H901 PolarHBondContact O-N 3.07Å
898	L	85.6	Confident	81.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-39.8	175	176.2	61.7	0	0	0	112.1	L739 Y742 L887 S894 L895 R896 H901 I902	L739-L898 HydrophobicContact CD1-CD1 4.38Å; L739-L898 HydrophobicContact CD1-CD2 4.22Å; Y742-L898 HydrophobicContact CD1-CB 4.44Å; Y742-L898 HydrophobicContact CD1-CD1 4.14Å; Y742-L898 HydrophobicContact CD1-CD2 4.05Å; Y742-L898 HydrophobicContact CD1-CG 4.44Å; Y742-L898 HydrophobicContact CD2-CB 4.01Å; Y742-L898 HydrophobicContact CD2-CD1 4.49Å; Y742-L898 HydrophobicContact CE1-CD2 4.21Å; Y742-L898 HydrophobicContact CE2-CB 4.17Å; Y742-L898 HydrophobicContact CG-CB 4.15Å; Y742-L898 HydrophobicContact CG-CD1 3.87Å; Y742-L898 HydrophobicContact CG-CD2 4.48Å; Y742-L898 HydrophobicContact CG-CG 4.38Å; L887-L898 HydrophobicContact CD1-CD2 3.94Å; L887-L898 HydrophobicContact CD1-CG 4Å; L887-L898 HydrophobicContact CD2-CD2 4.34Å; S894-L898 PolarHBondContact O-N 2.85Å; L895-L898 WeakPolarHBondContact O-CB 3.37Å; L895-L898 PolarHBondContact O-N 3.47Å; R896-L898 VanDerWaalsContact C-N 3.31Å; R896-L898 PolarHBondContact O-N 2.93Å; L898-H901 PolarHBondContact O-N 2.84Å; L898-I902 HydrophobicContact CD1-CD1 3.79Å; L898-I902 HydrophobicContact CD1-CG1 4.11Å; L898-I902 HydrophobicContact CG-CD1 3.83Å; L898-I902 WeakPolarHBondContact O-CD1 3.45Å; L898-I902 VanDerWaalsContact O-CG1 3.25Å; L898-I902 WeakPolarHBondContact O-CG1 3.2Å; L898-I902 PolarHBondContact O-N 3.24Å
899	A	84.8	Confident	80.8	Confident	8 Å²	8	64.1 Å²	64.1	7%	0.066	34%	0.336	C	S	.	.	H	α-helix	trans	-63.8	-41.1	174.7	0	0	0	0	0	112.3	I884 L887 L895 R896 L897 I902 N903	I884-A899 HydrophobicContact CG2-CB 4.47Å; L887-A899 HydrophobicContact CB-CB 3.93Å; L895-A899 PolarHBondContact O-N 2.94Å; R896-A899 WeakPolarHBondContact O-CB 3.44Å; R896-A899 PolarHBondContact O-N 3.45Å; R896-A899 VanDerWaalsContact O-N 3.11Å; L897-A899 VanDerWaalsContact C-N 3.3Å; L897-A899 PolarHBondContact O-N 3.33Å; A899-I902 PolarHBondContact O-N 2.82Å; A899-N903 WeakPolarHBondContact O-CB 3.47Å; A899-N903 PolarHBondContact O-N 2.88Å
900	E	82.9	Confident	79.5	Confident	127 Å²	127	63.6 Å²	63.6	59%	0.593	33%	0.333	S	S	*	.	H	α-helix	trans	-64.4	-42.6	175.1	-68.7	175.2	-173.1	0	0	112	R896 L897 N903 F904	R896-E900 PolarHBondContact O-N 3.07Å; L897-E900 PolarHBondContact O-N 2.73Å; L897-E900 VanDerWaalsContact O-N 3.15Å; E900-N903 CarbonylContact O-C 3.52Å; E900-N903 PolarHBondContact O-N 3.31Å; E900-F904 WeakPolarHBondContact O-CA 3.38Å; E900-F904 PolarHBondContact O-N 3.37Å
901	H	84.6	Confident	78.1	Confident	73 Å²	73	66.6 Å²	66.6	34%	0.338	36%	0.357	S	S	.	.	H	α-helix	trans	-63.4	-42.6	175.8	-75.5	-66.3	0	0	0	112.8	L897 L898 N903	L897-H901 PolarHBondContact O-CD2 3.11Å; L897-H901 PolarHBondContact O-N 3.07Å; L898-H901 PolarHBondContact O-N 2.84Å; H901-N903 VanDerWaalsContact C-N 3.3Å; H901-N903 PolarHBondContact O-N 3.14Å
902	I	85.7	Confident	76.6	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-66.5	-33.1	176.9	-68.1	164.4	0	0	0	111.5	F735 Q738 L880 F883 I884 L887 L898 A899 Y908	F735-I902 HydrophobicContact CD2-CD1 4.08Å; F735-I902 HydrophobicContact CD2-CG1 4.27Å; F735-I902 HydrophobicContact CD2-CG2 4.33Å; F735-I902 HydrophobicContact CE2-CD1 3.85Å; Q738-I902 HydrophobicContact CB-CG1 4.27Å; L880-I902 HydrophobicContact CD1-CG2 4.21Å; F883-I902 HydrophobicContact CE1-CD1 4.22Å; I884-I902 HydrophobicContact CD1-CG2 3.74Å; I884-I902 HydrophobicContact CG1-CG2 3.97Å; L887-I902 HydrophobicContact CD1-CD1 4.24Å; L898-I902 HydrophobicContact CD1-CD1 3.79Å; L898-I902 HydrophobicContact CD1-CG1 4.11Å; L898-I902 HydrophobicContact CG-CD1 3.83Å; L898-I902 WeakPolarHBondContact O-CD1 3.45Å; L898-I902 VanDerWaalsContact O-CG1 3.25Å; L898-I902 WeakPolarHBondContact O-CG1 3.2Å; L898-I902 PolarHBondContact O-N 3.24Å; A899-I902 PolarHBondContact O-N 2.82Å; I902-Y908 HydrophobicContact CG2-CE2 4.39Å
903	N	86.3	Confident	74.8	Confident	28 Å²	28	68.1 Å²	68.1	15%	0.15	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	30.3	-173.4	-167.9	38.7	0	0	0	113.6	A899 E900 H901 N905 G906 H907 Y908 C909	A899-N903 WeakPolarHBondContact O-CB 3.47Å; A899-N903 PolarHBondContact O-N 2.88Å; E900-N903 CarbonylContact O-C 3.52Å; E900-N903 PolarHBondContact O-N 3.31Å; H901-N903 VanDerWaalsContact C-N 3.3Å; H901-N903 PolarHBondContact O-N 3.14Å; N903-N905 PolarHBondContact O-N 2.92Å; N903-G906 PolarHBondContact O-N 3.21Å; N903-G906 WeakPolarHBondContact OD1-CA 3.42Å; N903-H907 PolarHBondContact OD1-N 3.41Å; N903-Y908 HydrophobicContact CB-CD2 4.38Å; N903-Y908 PolarHBondContact OD1-N 3.26Å; N903-C909 PolarHBondContact ND2-SG 3.03Å
904	F	82	Confident	72.6	Confident	169 Å²	169	67.9 Å²	67.9	74%	0.741	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-34.1	-175.7	-175.9	-97.6	0	0	0	114.1	E900	E900-F904 WeakPolarHBondContact O-CA 3.38Å; E900-F904 PolarHBondContact O-N 3.37Å
905	N	83.2	Confident	70.3	Confident	134 Å²	134	71.1 Å²	71.1	72%	0.717	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	2.5	179.6	-68.8	-25.9	0	0	0	114.5	N903 H907	N903-N905 PolarHBondContact O-N 2.92Å; N905-H907 PolarHBondContact O-N 2.8Å; N905-H907 VanDerWaalsContact O-N 3.1Å
906	G	78.2	Confident	67.8	Low	21 Å²	21	76.2 Å²	76.2	22%	0.216	44%	0.435	C	S	.	.			trans	65.6	8.4	-175.9	0	0	0	0	0	115.6	N903 Y908 C909 N910	N903-G906 PolarHBondContact O-N 3.21Å; N903-G906 WeakPolarHBondContact OD1-CA 3.42Å; G906-Y908 PolarHBondContact O-N 2.69Å; G906-C909 PolarHBondContact O-N 3.11Å; G906-N910 PolarHBondContact O-N 2.85Å; G906-N910 VanDerWaalsContact O-N 3.15Å
907	H	81.6	Confident	65.2	Low	108 Å²	108	76.3 Å²	76.3	50%	0.5	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-37.1	-174.2	176.2	-96.9	0	0	0	113	N903 N905	N903-H907 PolarHBondContact OD1-N 3.41Å; N905-H907 PolarHBondContact O-N 2.8Å; N905-H907 VanDerWaalsContact O-N 3.1Å
908	Y	77.5	Confident	62.7	Low	17 Å²	17	79.9 Å²	79.9	7%	0.067	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-37	-176.7	-57.3	-71.5	0	0	0	112.5	L880 I884 I902 N903 G906 S911	L880-Y908 HydrophobicContact CD2-CD1 4.34Å; L880-Y908 HydrophobicContact CD2-CE1 3.63Å; L880-Y908 HydrophobicContact CD2-CE2 4.27Å; L880-Y908 HydrophobicContact CG-CE1 4.47Å; I884-Y908 HydrophobicContact CD1-CD2 3.78Å; I884-Y908 HydrophobicContact CD1-CE2 4.47Å; I884-Y908 HydrophobicContact CD1-CG 3.88Å; I902-Y908 HydrophobicContact CG2-CE2 4.39Å; N903-Y908 HydrophobicContact CB-CD2 4.38Å; N903-Y908 PolarHBondContact OD1-N 3.26Å; G906-Y908 PolarHBondContact O-N 2.69Å; Y908-S911 PolarHBondContact O-N 2.77Å
909	C	63.1	Low	60.2	Low	55 Å²	55	86 Å²	86	37%	0.372	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-71.9	-32.4	179.1	-69.5	0	0	0	0	113.6	N903 G906 S911 T912	N903-C909 PolarHBondContact ND2-SG 3.03Å; G906-C909 PolarHBondContact O-N 3.11Å; C909-S911 PolarHBondContact O-N 2.97Å; C909-T912 PolarHBondContact O-N 3.34Å; C909-T912 PolarHBondContact O-OG1 3.03Å
910	N	56.7	Low	57.6	Low	127 Å²	127	91.5 Å²	91.5	68%	0.679	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-67.1	-18.6	177.6	-70.3	-15	0	0	0	112.5	G906	G906-N910 PolarHBondContact O-N 2.85Å; G906-N910 VanDerWaalsContact O-N 3.15Å
911	S	51.2	Low	55.2	Low	93 Å²	93	89.1 Å²	89.1	65%	0.65	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-81.2	-15.5	176.5	-168.3	0	0	0	0	114.1	Y908 C909	Y908-S911 PolarHBondContact O-N 2.77Å; C909-S911 PolarHBondContact O-N 2.97Å
912	T	46	Very low	52.5	Low	76 Å²	76	91.1 Å²	91.1	47%	0.466	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.8	-13.7	179.3	52.2	0	0	0	0	113.2	I881 C909 G914	I881-T912 HydrophobicContact CG2-CG2 3.92Å; C909-T912 PolarHBondContact O-N 3.34Å; C909-T912 PolarHBondContact O-OG1 3.03Å; T912-G914 PolarHBondContact O-N 3.21Å
913	L	37.1	Very low	50.2	Low	120 Å²	120	99.1 Å²	99.1	63%	0.628	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	33.7	-179	-131.9	78.2	0	0	0	114.8	S915	L913-S915 VanDerWaalsContact C-N 3.32Å
914	G	34.9	Very low	47.7	Very low	82 Å²	82	103.3 Å²	103.3	85%	0.845	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-2.9	173.1	0	0	0	0	0	114.5	T912	T912-G914 PolarHBondContact O-N 3.21Å
915	S	30.5	Very low	45.2	Very low	90 Å²	90	100.7 Å²	100.7	63%	0.629	65%	0.652	S	S	*	*	S	Bend	trans	-140.5	126.3	178.6	-171.4	0	0	0	0	112.3	L913	L913-S915 VanDerWaalsContact C-N 3.32Å
916	S	27.1	Very low	42.7	Very low	108 Å²	108	98.2 Å²	98.2	76%	0.755	66%	0.658	S	S	*	*			trans	54.5	80.4	158.8	55.2	0	0	0	0	118.9
917	C	28.2	Very low	40.5	Very low	101 Å²	101	107.8 Å²	107.8	68%	0.682	69%	0.689	S	S	*	*			trans	-142.9	69.9	157.7	-74.5	0	0	0	0	111.4	T919	C917-T919 PolarHBondContact O-N 3.41Å
918	T	28.9	Very low	38.3	Very low	139 Å²	139	107.6 Å²	107.6	85%	0.853	70%	0.697	S	S	*	*			trans	-86.2	92.8	172.3	47.5	0	0	0	0	111.3
919	T	34.3	Very low	35.9	Very low	128 Å²	128	112.5 Å²	112.5	79%	0.785	73%	0.734	S	S	*	*			trans	-160.8	113	155.6	-6.9	0	0	0	0	113.3	C917	C917-T919 PolarHBondContact O-N 3.41Å
920	S	29.7	Very low	34.3	Very low	124 Å²	124	117.2 Å²	117.2	87%	0.867	75%	0.754	S	S	*	*			trans	47.9	95.2	142	-51.5	0	0	0	0	119.6
921	G	32.1	Very low	32.9	Very low	78 Å²	78	119.3 Å²	119.3	80%	0.804	76%	0.762	S	S	*	*			trans	-168.9	44	173.7	0	0	0	0	0	114.5	I923	G921-I923 PolarHBondContact O-N 3.33Å
922	S	28.9	Very low	32	Very low	114 Å²	114	121.5 Å²	121.5	80%	0.797	77%	0.766	S	S	*	*			trans	-72.4	104.2	-177.3	53.1	0	0	0	0	112.9
923	I	36.6	Very low	31.2	Very low	170 Å²	170	126.1 Å²	126.1	87%	0.872	78%	0.782	S	S	*	*			trans	-123.3	135.1	150.2	-63.3	-176.3	0	0	0	108.3	G921	G921-I923 PolarHBondContact O-N 3.33Å
924	T	33.8	Very low	30.8	Very low	116 Å²	116	127.3 Å²	127.3	71%	0.712	78%	0.784	S	S	*	*			trans	-98.7	140.6	-157.3	48.5	0	0	0	0	113.9
925	S	30.2	Very low	30.5	Very low	114 Å²	114	130.8 Å²	130.8	80%	0.797	78%	0.779	S	S	*	*			trans	45.3	115.3	144.4	63.4	0	0	0	0	120.3
926	G	30.8	Very low	30.6	Very low	81 Å²	81	135.1 Å²	135.1	84%	0.835	79%	0.786	S	S	*	*			trans	-167.7	67.2	169.3	0	0	0	0	0	114.3
927	Y	30.5	Very low	30.7	Very low	223 Å²	223	139.4 Å²	139.4	88%	0.875	79%	0.787	S	S	*	*			trans	-66.8	174.6	167.8	-78.5	-83.5	0	0	0	112.1
928	P	35.3	Very low	30.5	Very low	104 Å²	104	142.6 Å²	142.6	68%	0.675	79%	0.792	S	S	*	*			cis	-134.7	-167.9	-27.7	34.1	-13.5	0	0	0	113.1
929	S	27.4	Very low	30.5	Very low	120 Å²	120	141.5 Å²	141.5	84%	0.839	79%	0.79	S	S	*	*			trans	-39.5	131	166.4	-44.3	0	0	0	0	116
930	I	29.7	Very low	30.5	Very low	154 Å²	154	140.8 Å²	140.8	79%	0.79	79%	0.79	S	S	*	*			trans	-133.6	106	160.4	-61.8	-176.1	0	0	0	110.2
931	M	27.1	Very low	30.5	Very low	171 Å²	171	142.9 Å²	142.9	84%	0.842	79%	0.786	S	S	*	*			trans	-75.8	155	153.2	-132.9	175.7	-174.1	0	0	108.1
932	N	32.2	Very low	30.2	Very low	138 Å²	138	147.1 Å²	147.1	74%	0.738	78%	0.784	S	S	*	*			trans	82	107	174.6	-54.3	-27.2	0	0	0	117.4
933	H	29.4	Very low	30.2	Very low	174 Å²	174	150.1 Å²	150.1	81%	0.806	79%	0.786	S	S	*	*				-26.4	135.2	129.1	-84.1	-41.7	0	0	0	111.7
934	H	30	Very low	30	Very low	144 Å²	144	150.5 Å²	150.5	67%	0.667	78%	0.784	S	S	*	*				-179.2	164.3	64.9	-132.8	39.6	0	0	0	109.8
935	Q	28.7	Very low	29.8	Very low	156 Å²	156	153.5 Å²	153.5	73%	0.729	79%	0.79	S	S	*	*			trans	57.2	97.4	151.8	-69.4	179.9	4.6	0	0	119.9
936	K	30.8	Very low	29.7	Very low	181 Å²	181	155.9 Å²	155.9	79%	0.787	79%	0.788	S	S	*	*				169.7	136.1	95.7	-90.9	176.9	175.7	173.9	0	113.2
937	Y	29.6	Very low	29.9	Very low	197 Å²	197	160.5 Å²	160.5	77%	0.773	79%	0.788	S	S	*	*			trans	38	113.8	143.8	-68.9	-105	0	0	0	119.2
938	Q	25.6	Very low	30	Very low	169 Å²	169	155.3 Å²	155.3	79%	0.79	77%	0.774	S	S	*	*				52	101.8	79.2	-72.1	-172.4	-19.5	0	0	115
939	S	28.3	Very low	29.6	Very low	115 Å²	115	158.9 Å²	158.9	80%	0.804	78%	0.782	S	S	*	*			trans	174.6	162.2	130.2	-78.2	0	0	0	0	111.1
940	S	34.2	Very low	29.8	Very low	113 Å²	113	158.4 Å²	158.4	79%	0.79	78%	0.778	S	S	*	*			trans	50.4	99.3	179.9	56.2	0	0	0	0	115.1
941	H	28.5	Very low	30	Very low	168 Å²	168	158.5 Å²	158.5	78%	0.778	78%	0.78	S	S	*	*			cis	60.8	117.8	31.6	-109.8	-74.2	0	0	0	115
942	H	26.7	Very low	30.2	Very low	168 Å²	168	156.6 Å²	156.6	78%	0.778	78%	0.777	S	S	*	*			trans	53.3	110.8	168.1	-69.5	-48.4	0	0	0	119.2
943	E	29.1	Very low	30.1	Very low	177 Å²	177	155 Å²	155	83%	0.827	78%	0.777	S	S	*	*				-162.1	163	113	-113.4	172.3	-166.8	0	0	112.6
944	Q	33.3	Very low	30.3	Very low	177 Å²	177	153.1 Å²	153.1	83%	0.827	78%	0.778	S	S	*	*			trans	71.2	64.8	165.5	-64.4	169.2	26.9	0	0	118.8
945	Q	27.7	Very low	30.9	Very low	179 Å²	179	151.9 Å²	151.9	84%	0.836	78%	0.783	S	S	*	*				-68.3	164.5	129.2	-72.3	174.1	-22.2	0	0	110
946	Q	29	Very low	31.4	Very low	165 Å²	165	150 Å²	150	77%	0.771	78%	0.784	S	S	*	*			trans	91.4	91.2	168.2	-50.9	-179	15.2	0	0	118.9
947	H	34.3	Very low	31.8	Very low	177 Å²	177	147 Å²	147	82%	0.819	78%	0.783	S	S	*	*				-165.5	95.8	128	-117.9	-75.2	0	0	0	107.8
948	I	32.6	Very low	32.1	Very low	115 Å²	115	145.5 Å²	145.5	59%	0.59	79%	0.788	S	S	*	*				68.7	89.5	76.6	-58.2	171.4	0	0	0	112.8
949	Q	27.7	Very low	32.6	Very low	178 Å²	178	143 Å²	143	83%	0.832	79%	0.786	S	S	*	*				43.3	120.9	121.1	-65.3	176	-23.6	0	0	120.8
950	S	31.7	Very low	33	Very low	110 Å²	110	143 Å²	143	77%	0.769	79%	0.786	S	S	*	*			trans	158	145.1	148.6	49.6	0	0	0	0	108
951	L	33.7	Very low	32.9	Very low	157 Å²	157	142.8 Å²	142.8	82%	0.822	79%	0.785	S	S	*	*			cis	-135	139.4	-7.6	-57.6	85.1	0	0	0	105.3
952	V	30.5	Very low	33.1	Very low	131 Å²	131	139.7 Å²	139.7	79%	0.794	78%	0.781	S	S	*	*				55	102.7	58.3	-167.7	0	0	0	0	115.2
953	S	30.4	Very low	33.5	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	78%	0.78	S	S	*	*				165.6	152.9	126.4	-74	0	0	0	0	115.9
954	T	33.3	Very low	33.7	Very low	134 Å²	134	137.3 Å²	137.3	82%	0.822	78%	0.783	S	S	*	*			trans	78.5	100.4	160.4	54.9	0	0	0	0	123.5
955	P	42.6	Very low	33.7	Very low	119 Å²	119	133.9 Å²	133.9	77%	0.773	78%	0.776	S	S	*	*			trans	-89.6	-178.8	137.2	40.3	-33.4	0	0	0	110.2
956	P	40.9	Very low	33.7	Very low	117 Å²	117	131.1 Å²	131.1	76%	0.76	77%	0.771	S	S	*	*			cis	-150.2	-142.8	44.7	44.7	-19.5	0	0	0	112.8
957	P	38.5	Very low	33.9	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	77%	0.768	S	S	*	*			cis	-134.6	175.2	-15.7	37.9	-17.8	0	0	0	117.9
958	L	35.2	Very low	33.6	Very low	165 Å²	165	127.2 Å²	127.2	86%	0.864	77%	0.765	S	S	*	*			trans	-102.3	160.3	168.1	-84.9	151.2	0	0	0	112.4
959	P	37.5	Very low	33.4	Very low	115 Å²	115	129 Å²	129	75%	0.747	77%	0.771	S	S	*	*				-140.2	165.2	125	37	-23.8	0	0	0	112.3
960	S	35.7	Very low	33.4	Very low	115 Å²	115	128.1 Å²	128.1	80%	0.804	77%	0.766	S	S	*	*			cis	-162	164.2	-4.8	38.3	0	0	0	0	110.8
961	S	32.4	Very low	33.4	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	77%	0.771	S	S	*	*			trans	-65	158.7	-176.4	47.8	0	0	0	0	116.2
962	S	33.2	Very low	33	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	77%	0.773	S	S	*	*				176.4	147.8	81.3	40.5	0	0	0	0	115.2
963	S	33.5	Very low	32.9	Very low	107 Å²	107	134.3 Å²	134.3	75%	0.748	78%	0.775	S	S	*	*			trans	55	140.4	155.7	46.7	0	0	0	0	120.8
964	Q	34.1	Very low	32.8	Very low	189 Å²	189	138.1 Å²	138.1	88%	0.883	78%	0.779	S	S	*	*			cis	-154.4	168.5	1.6	-117.5	178.6	-18.8	0	0	110.3
965	P	33.7	Very low	32.7	Very low	104 Å²	104	137.4 Å²	137.4	68%	0.675	77%	0.774	S	S	*	*			trans	-117.9	-170.6	-157.8	44.3	-36.9	0	0	0	117.5
966	T	27.9	Very low	31.9	Very low	121 Å²	121	141.2 Å²	141.2	74%	0.742	78%	0.779	S	S	*	*			trans	71.9	133.1	165.8	32.7	0	0	0	0	116.8
967	S	32.8	Very low	31.5	Very low	102 Å²	102	145 Å²	145	71%	0.713	78%	0.779	S	S	*	*			cis	-144.3	135.8	31.3	-57.6	0	0	0	0	111.1
968	Q	28.1	Very low	30.9	Very low	159 Å²	159	143.9 Å²	143.9	74%	0.743	77%	0.774	S	S	*	*				50.9	121.3	93.3	-73	-178.1	-0.1	0	0	113.7
969	Q	28.1	Very low	30.6	Very low	153 Å²	153	143 Å²	143	72%	0.715	77%	0.77	S	S	*	*			cis	-149.4	-178.5	9.5	-84	144.2	-109.6	0	0	108.7
970	E	28	Very low	30.2	Very low	159 Å²	159	144.7 Å²	144.7	74%	0.743	77%	0.771	S	S	*	*			cis	-146.5	-136.9	4.9	-156.3	138.2	-67	0	0	112.5
971	E	31.5	Very low	30	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	78%	0.775	S	S	*	*			trans	41.3	65.5	166.7	-62.1	-154.9	133.2	0	0	120
972	Q	25	Very low	29.9	Very low	186 Å²	186	148.2 Å²	148.2	87%	0.869	77%	0.769	S	S	*	*			trans	-111.8	101.8	139	-76.4	-170	-7.5	0	0	110
973	N	28.2	Very low	29.7	Very low	155 Å²	155	151.4 Å²	151.4	83%	0.829	78%	0.777	S	S	*	*			trans	-161.9	139.1	164.9	-110.7	-38.1	0	0	0	112.8
974	K	28.9	Very low	29.4	Very low	185 Å²	185	155.4 Å²	155.4	80%	0.804	78%	0.781	S	S	*	*			trans	71.3	132.4	-176.8	-49.9	164.8	-176.3	169.5	0	112.6
975	T	29.9	Very low	29.1	Very low	118 Å²	118	152.3 Å²	152.3	72%	0.724	78%	0.781	S	S	*	*			cis	-135.6	100.2	27.7	38.3	0	0	0	0	114.1	Y977	T975-Y977 HydrophobicContact CG2-CD2 3.84Å; T975-Y977 HydrophobicContact CG2-CE2 4.32Å; T975-Y977 PolarHBondContact O-N 3.24Å
976	K	27.4	Very low	28.9	Very low	200 Å²	200	151.6 Å²	151.6	87%	0.87	78%	0.784	S	S	*	*			trans	-77.9	90.1	145.4	-94.7	-176.4	174.2	177.1	0	107.9
977	Y	30.9	Very low	28.9	Very low	197 Å²	197	153.2 Å²	153.2	77%	0.773	78%	0.783	S	S	*	*			trans	-124.9	57.1	163.3	-78.7	-75.3	0	0	0	110.3	T975 N979	T975-Y977 HydrophobicContact CG2-CD2 3.84Å; T975-Y977 HydrophobicContact CG2-CE2 4.32Å; T975-Y977 PolarHBondContact O-N 3.24Å; Y977-N979 PolarHBondContact O-N 3.27Å
978	S	27.3	Very low	28.9	Very low	93 Å²	93	153.3 Å²	153.3	65%	0.65	78%	0.781	S	S	*	*			trans	-64.9	119.4	158.9	49	0	0	0	0	109.3
979	N	28.9	Very low	29.1	Very low	148 Å²	148	156.2 Å²	156.2	79%	0.791	79%	0.787	S	S	*	*	S	Bend	trans	57.5	82	159.3	-52.6	-21	0	0	0	116.3	Y977	Y977-N979 PolarHBondContact O-N 3.27Å
980	I	27.9	Very low	29.1	Very low	150 Å²	150	153.1 Å²	153.1	77%	0.769	78%	0.782	S	S	*	*			trans	-174.7	99.7	137.8	-86.1	140.5	0	0	0	105.8	I982	I980-I982 HydrophobicContact CG2-CG1 3.98Å
981	I	31.3	Very low	29.1	Very low	172 Å²	172	148.7 Å²	148.7	88%	0.882	78%	0.779	S	S	*	*			trans	-112.3	120.8	154.2	-67.4	-177	0	0	0	106.2
982	I	31.3	Very low	28.9	Very low	127 Å²	127	145.2 Å²	145.2	65%	0.651	78%	0.775	S	S	*	*			trans	-71.8	129.3	-171.7	-64.1	168.4	0	0	0	108.9	I980 K984	I980-I982 HydrophobicContact CG2-CG1 3.98Å; I982-K984 HydrophobicContact CG2-CB 4.28Å; I982-K984 PolarHBondContact O-N 2.92Å
983	L	28.1	Very low	29.2	Very low	168 Å²	168	143.6 Å²	143.6	88%	0.88	77%	0.771	S	S	*	*	S	Bend	trans	-55.2	91.9	165.9	-74.8	160.5	0	0	0	110.4
984	K	27.7	Very low	29.2	Very low	191 Å²	191	142 Å²	142	83%	0.83	77%	0.767	S	S	*	*			trans	-158.4	42.9	175	-119.4	172.9	-172.4	-176.4	0	116.2	I982	I982-K984 HydrophobicContact CG2-CB 4.28Å; I982-K984 PolarHBondContact O-N 2.92Å
985	S	27.6	Very low	29.5	Very low	125 Å²	125	138.4 Å²	138.4	87%	0.874	76%	0.763	S	S	*	*			trans	-161.8	24.8	159.3	50.2	0	0	0	0	114.3	Q987	S985-Q987 PolarHBondContact O-N 3.09Å
986	A	29.5	Very low	29.5	Very low	89 Å²	89	138.4 Å²	138.4	74%	0.736	77%	0.767	S	S	*	*			trans	-92.8	78.1	169.6	0	0	0	0	0	110.3	P988	A986-P988 VanDerWaalsContact O-CD 3.23Å; A986-P988 WeakPolarHBondContact O-CD 3.45Å
987	Q	28.3	Very low	29.7	Very low	154 Å²	154	134.7 Å²	134.7	72%	0.72	77%	0.767	S	S	*	*			trans	-85.6	103.8	157	-85.7	-78.3	-44	0	0	107	S985	S985-Q987 PolarHBondContact O-N 3.09Å
988	P	32.6	Very low	29.6	Very low	105 Å²	105	129.4 Å²	129.4	68%	0.682	76%	0.764	S	S	*	*			trans	-62.2	141.3	161	29.8	-33	0	0	0	107.5	A986 S990	A986-P988 VanDerWaalsContact O-CD 3.23Å; A986-P988 WeakPolarHBondContact O-CD 3.45Å; P988-S990 PolarHBondContact O-N 3.06Å
989	Y	33.4	Very low	29.7	Very low	219 Å²	219	130.3 Å²	130.3	86%	0.859	77%	0.77	S	S	*	*			trans	-51.2	101.2	178.3	-91.7	-98.1	0	0	0	110.8	G991	Y989-G991 VanDerWaalsContact C-N 3.25Å; Y989-G991 PolarHBondContact O-N 2.94Å
990	S	26.6	Very low	29.9	Very low	88 Å²	88	128.5 Å²	128.5	62%	0.615	77%	0.769	S	S	*	*			trans	-82.1	79.6	171.5	47	0	0	0	0	107.8	P988 S992	P988-S990 PolarHBondContact O-N 3.06Å; S990-S992 VanDerWaalsContact C-N 3.25Å; S990-S992 PolarHBondContact O-N 3.33Å
991	G	29.8	Very low	29.9	Very low	67 Å²	67	126.9 Å²	126.9	69%	0.691	77%	0.771	S	S	*	*			trans	-61.4	88.4	170.5	0	0	0	0	0	110.2	Y989 I993	Y989-G991 VanDerWaalsContact C-N 3.25Å; Y989-G991 PolarHBondContact O-N 2.94Å; G991-I993 PolarHBondContact O-N 2.6Å
992	S	25.5	Very low	29.9	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	77%	0.77	S	S	*	*			trans	-74.3	66	179.2	45.1	0	0	0	0	111.1	S990 T994	S990-S992 VanDerWaalsContact C-N 3.25Å; S990-S992 PolarHBondContact O-N 3.33Å; S992-T994 PolarHBondContact O-N 3.28Å
993	I	31.8	Very low	29.9	Very low	152 Å²	152	126 Å²	126	78%	0.779	77%	0.773	S	S	*	*			trans	-85	90.7	168.1	-56.4	-179.8	0	0	0	107.8	G991 P995	G991-I993 PolarHBondContact O-N 2.6Å; I993-P995 VanDerWaalsContact O-CD 3.3Å; I993-P995 WeakPolarHBondContact O-CD 3.39Å
994	T	29.5	Very low	30.1	Very low	121 Å²	121	126.2 Å²	126.2	74%	0.742	77%	0.773	S	S	*	*			trans	-67.3	117.8	160.9	39.2	0	0	0	0	109	S992 S996	S992-T994 PolarHBondContact O-N 3.28Å; T994-S996 PolarHBondContact O-N 3.46Å
995	P	33.6	Very low	30.4	Very low	110 Å²	110	120.1 Å²	120.1	71%	0.714	77%	0.765	S	S	*	*			trans	-80.5	102.8	167.1	31.3	-28.3	0	0	0	108	I993 S997	I993-P995 VanDerWaalsContact O-CD 3.3Å; I993-P995 WeakPolarHBondContact O-CD 3.39Å; P995-S997 VanDerWaalsContact C-N 3.25Å; P995-S997 PolarHBondContact O-N 3.02Å
996	S	29.9	Very low	30.7	Very low	118 Å²	118	119.3 Å²	119.3	83%	0.825	76%	0.759	S	S	*	*			trans	-64.9	88.6	165.9	38.9	0	0	0	0	109.4	T994 A998	T994-S996 PolarHBondContact O-N 3.46Å; S996-A998 PolarHBondContact O-N 3.11Å
997	S	31.6	Very low	30.9	Very low	123 Å²	123	124.2 Å²	124.2	86%	0.86	76%	0.764	S	S	*	*			trans	-73.9	90.4	-179	40.5	0	0	0	0	111.1	P995	P995-S997 VanDerWaalsContact C-N 3.25Å; P995-S997 PolarHBondContact O-N 3.02Å
998	A	30.1	Very low	31.2	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	77%	0.767	S	S	*	*			trans	-95.4	137.3	160	0	0	0	0	0	110.3	S996	S996-A998 PolarHBondContact O-N 3.11Å
999	S	29.7	Very low	31.2	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	77%	0.768	S	S	*	*			trans	96.9	142	165.3	-42.5	0	0	0	0	118.7
1000	S	31.6	Very low	31.2	Very low	110 Å²	110	122.9 Å²	122.9	77%	0.769	76%	0.764	S	S	*	*			trans	60.9	85.9	175.3	53.6	0	0	0	0	116.8
1001	S	28.7	Very low	31.6	Very low	116 Å²	116	125 Å²	125	81%	0.811	78%	0.779	S	S	*	*				70.7	98.3	59.8	86.2	0	0	0	0	115.2
1002	L	31.1	Very low	31.7	Very low	165 Å²	165	125 Å²	125	86%	0.864	78%	0.779	S	S	*	*			trans	-138.6	111.5	159.5	-94.2	168.3	0	0	0	110.3
1003	T	31	Very low	32.2	Very low	116 Å²	116	126.2 Å²	126.2	71%	0.712	78%	0.781	S	S	*	*			trans	48.7	118.4	141	-29.6	0	0	0	0	120.5
1004	I	33.4	Very low	32.4	Very low	171 Å²	171	123.4 Å²	123.4	88%	0.877	78%	0.775	S	S	*	*				163.7	135.3	118.3	-81.6	156.1	0	0	0	108.4
1005	G	32.8	Very low	32.7	Very low	63 Å²	63	124.9 Å²	124.9	65%	0.649	77%	0.773	S	S	*	*			trans	122.2	78.6	156.9	0	0	0	0	0	119.1
1006	S	34.7	Very low	33	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	78%	0.775	S	S	*	*			trans	53.9	115.3	136.1	59	0	0	0	0	123.5
1007	K	33.5	Very low	33.3	Very low	193 Å²	193	125.8 Å²	125.8	84%	0.839	77%	0.769	S	S	*	*				84.3	142.7	127.6	-71.9	-178.2	175.1	-178.9	0	121.9
1008	Q	33.6	Very low	33.3	Very low	167 Å²	167	126.9 Å²	126.9	78%	0.78	77%	0.765	S	S	*	*			trans	77.6	104	158.5	-78.3	168.5	-20.5	0	0	116.4
1009	T	34.3	Very low	33.6	Very low	114 Å²	114	128.6 Å²	128.6	70%	0.699	77%	0.767	S	S	*	*				65.7	131.1	92.8	55.8	0	0	0	0	112.2
1010	E	32.3	Very low	33.9	Very low	169 Å²	169	132 Å²	132	79%	0.79	77%	0.77	S	S	*	*			cis	-169.8	156.6	20.7	-121.5	162	-156.7	0	0	109.8
1011	S	34.5	Very low	34	Very low	131 Å²	131	137 Å²	137	92%	0.916	77%	0.774	S	S	*	*			trans	60.5	155.4	165.6	73.7	0	0	0	0	118.7
1012	G	32.5	Very low	34	Very low	67 Å²	67	142.1 Å²	142.1	69%	0.691	78%	0.775	S	S	*	*			cis	173	137	-12	0	0	0	0	0	113.9
1013	V	35.2	Very low	34.2	Very low	138 Å²	138	142.8 Å²	142.8	84%	0.836	77%	0.771	S	S	*	*			trans	77.9	119.2	142.9	-175.3	0	0	0	0	121.9
1014	S	36.3	Very low	34.3	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	77%	0.77	S	S	*	*			trans	74.3	154.5	148.8	79.7	0	0	0	0	119.9
1015	H	37.2	Very low	34.2	Very low	153 Å²	153	140.1 Å²	140.1	71%	0.708	76%	0.762	S	S	*	*			cis	-136.2	140.3	3.3	-101	-84.4	0	0	0	107.9
1016	I	38.3	Very low	34.3	Very low	147 Å²	147	142.3 Å²	142.3	75%	0.754	77%	0.768	S	S	*	*				62.3	129.8	81.4	-66.5	169.3	0	0	0	111.9
1017	S	37.3	Very low	34.3	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	77%	0.767	S	S	*	*			cis	-151	164	19.3	48	0	0	0	0	115.1
1018	D	32	Very low	34.3	Very low	146 Å²	146	136.8 Å²	136.8	78%	0.781	76%	0.759	S	S	*	*			trans	-32.3	172.9	150.5	-45.8	-79.6	0	0	0	116.2
1019	V	35.8	Very low	34.4	Very low	120 Å²	120	135.5 Å²	135.5	73%	0.727	76%	0.757	S	S	*	*			cis	-158.1	153.3	40.2	-173.5	0	0	0	0	106.5
1020	E	35.2	Very low	34.4	Very low	185 Å²	185	137 Å²	137	86%	0.864	76%	0.756	S	S	*	*				175.1	170.1	78.3	-156.2	137.1	-117.5	0	0	111.9
1021	Y	34.8	Very low	34.7	Very low	216 Å²	216	136.8 Å²	136.8	85%	0.847	75%	0.749	S	S	*	*			trans	-113	158.8	-145.6	-119.9	-104.1	0	0	0	118.1
1022	R	28.2	Very low	34.7	Very low	222 Å²	222	139.3 Å²	139.3	84%	0.838	74%	0.739	S	S	*	*			trans	-53.4	144.6	159.8	-71.1	166.3	157.4	157.6	-8.7	112.2
1023	K	35.2	Very low	34.9	Very low	180 Å²	180	142.4 Å²	142.4	78%	0.783	74%	0.735	S	S	*	*				174	152.4	115.7	-100.3	175	179	175.8	0	116.1
1024	N	33.6	Very low	35.1	Very low	130 Å²	130	146 Å²	146	70%	0.695	74%	0.74	S	S	*	*			trans	67.8	106.3	142.4	-66.5	9.8	0	0	0	122.3
1025	S	31.5	Very low	35.3	Very low	100 Å²	100	146.5 Å²	146.5	70%	0.699	74%	0.739	S	S	*	*				45.2	144	118.5	68.1	0	0	0	0	123.6
1026	S	33.5	Very low	35.6	Very low	110 Å²	110	147.3 Å²	147.3	77%	0.769	75%	0.748	S	S	*	*			trans	75.9	102.3	148.1	61.4	0	0	0	0	120.3
1027	A	35.1	Very low	35.5	Very low	89 Å²	89	148.6 Å²	148.6	74%	0.736	75%	0.751	S	S	*	*				89.5	148.7	118.5	0	0	0	0	0	120.5
1028	S	34.2	Very low	35.7	Very low	96 Å²	96	149 Å²	149	67%	0.671	75%	0.751	S	S	*	*			trans	77.2	122.1	156.8	-52.8	0	0	0	0	118.6
1029	D	35.3	Very low	36.1	Very low	140 Å²	140	155.3 Å²	155.3	75%	0.749	77%	0.771	S	S	*	*			trans	66.6	144.3	132.4	-51.5	-19.5	0	0	0	118.2
1030	E	35.2	Very low	36.1	Very low	144 Å²	144	157.1 Å²	157.1	67%	0.673	77%	0.773	S	S	*	*			cis	-163.4	159.6	1.8	-122.5	179	179.1	0	0	110.8
1031	Y	38.1	Very low	36.2	Very low	165 Å²	165	155.6 Å²	155.6	65%	0.647	77%	0.768	S	S	*	*			trans	44.2	128.4	151.6	-69.2	-58.5	0	0	0	125.6
1032	R	34.8	Very low	36.3	Very low	184 Å²	184	152.2 Å²	152.2	69%	0.694	76%	0.764	S	S	*	*				64.4	157	128.7	-72.9	176.8	153.7	131.1	-5.1	119.9
1033	E	35.2	Very low	36.8	Very low	132 Å²	132	148.1 Å²	148.1	62%	0.617	76%	0.76	S	S	*	*			cis	-160.4	147.6	-15.1	-120.5	154.6	-162.2	0	0	105
1034	F	41	Very low	36.8	Very low	214 Å²	214	146.1 Å²	146.1	94%	0.939	76%	0.758	S	S	*	*			trans	-168.8	114.4	131.4	-106.3	-67.3	0	0	0	110.3
1035	T	40.2	Very low	37.1	Very low	104 Å²	104	147.2 Å²	147.2	64%	0.638	76%	0.762	S	S	*	*			trans	-80.2	156.4	179.3	41.4	0	0	0	0	112.5
1036	L	43	Very low	37.5	Very low	169 Å²	169	150.6 Å²	150.6	89%	0.885	77%	0.767	S	S	*	*				-170.4	125.4	114.7	-97.5	160	0	0	0	114
1037	H	36.3	Very low	37.8	Very low	175 Å²	175	153.7 Å²	153.7	81%	0.81	77%	0.767	S	S	*	*			trans	-42.5	177.1	176.6	-91.8	-60.1	0	0	0	120.7
1038	P	42.3	Very low	38	Very low	108 Å²	108	159.1 Å²	159.1	70%	0.701	77%	0.769	S	S	*	*			trans	-122.6	-170.6	-144.9	45	-31	0	0	0	114.7
1039	K	40.4	Very low	38.3	Very low	278 Å²	278	164.8 Å²	164.8	100%	1.209	78%	0.778	S	S	*	*			trans	-131.4	0	146	-97.8	-172.8	175.3	-179.7	0	109.4

Retrieved 1,039 of 1,039 residues in 2308.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).