A0A087YI27_POEFO Loading...

ATP-dependent DNA helicase PIF1

DNA-dependent ATPase and 5'-3' DNA helicase required for the maintenance of both mitochondrial and nuclear genome stability.

AlphaFold DB , UniProt , Accession A0A087YI27, Species POEFO (Poecilia formosa, Amazon molly), Gene PIF1, Length 629 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	50.7	Low	243 Å²	243	100.7 Å²	100.7	100%	1.197	56%	0.562	S	S	*	*				0	123.3	0	-72	171.4	179.6	0	0	106.4
2	L	23.4	Very low	53.4	Low	171 Å²	171	93.1 Å²	93.1	90%	0.895	52%	0.52	S	S	*	.			trans	-94	144.5	153.6	-79.4	164.9	0	0	0	105.9
3	P	27.9	Very low	55.7	Low	119 Å²	119	87.8 Å²	87.8	77%	0.773	49%	0.493	S	S	*	.			trans	-75.7	140.9	-173.5	31.4	-32.4	0	0	0	111.3
4	G	35.4	Very low	57.8	Low	79 Å²	79	81.6 Å²	81.6	81%	0.814	46%	0.458	S	S	*	.			trans	58	65.6	150.4	0	0	0	0	0	120
5	E	38.4	Very low	59.6	Low	132 Å²	132	76.5 Å²	76.5	62%	0.617	43%	0.43	S	S	*	.			trans	-125.6	108.2	157.8	-69.2	-159.8	168.9	0	0	111.2	G7 R96	E5-G7 PolarHBondContact O-N 2.92Å; E5-R96 IonicContact OE1-CZ 3.73Å; E5-R96 IonicContact OE1-NH2 3.6Å; E5-R96 PolarHBondContact OE1-NH2 3.37Å; E5-R96 IonicContact OE2-CZ 3.78Å; E5-R96 IonicContact OE2-NE 2.89Å; E5-R96 PolarHBondContact OE2-NE 2.83Å; E5-R96 IonicContact OE2-NH2 2.71Å; E5-R96 PolarHBondContact OE2-NH2 3.29Å
6	D	50.4	Low	61	Low	109 Å²	109	72.3 Å²	72.3	58%	0.583	41%	0.407	S	S	*	.			trans	-62.4	102.4	175.7	-87.1	-38.5	0	0	0	111.2	A8 Q9	D6-A8 PolarHBondContact O-N 3.46Å; D6-Q9 PolarHBondContact O-N 2.83Å
7	G	54.9	Low	62.4	Low	15 Å²	15	69.5 Å²	69.5	16%	0.155	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	7.9	175.5	0	0	0	0	0	115.4	E5	E5-G7 PolarHBondContact O-N 2.92Å
8	A	60.2	Low	63.2	Low	7 Å²	7	72.2 Å²	72.2	6%	0.058	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-8.7	-179.5	0	0	0	0	0	113.7	D6 I37 L38 I134	D6-A8 PolarHBondContact O-N 3.46Å; A8-I37 WeakPolarHBondContact O-CA 3.37Å; A8-L38 PolarHBondContact O-N 3.49Å; A8-I134 HydrophobicContact CB-CG2 4.11Å; A8-I134 WeakPolarHBondContact CB-O 3.3Å
9	Q	75.4	Confident	63.9	Low	83 Å²	83	69.2 Å²	69.2	39%	0.388	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135.2	-179.7	-177.1	173.3	10.7	0	0	111.7	D6 S35 V36 I37	D6-Q9 PolarHBondContact O-N 2.83Å; Q9-S35 PolarHBondContact NE2-OG 3.19Å; Q9-V36 CarbonylContact C-O 3.6Å; Q9-V36 WeakPolarHBondContact CA-O 3.48Å; Q9-I37 HydrophobicContact CB-CG1 4.32Å; Q9-I37 HydrophobicContact CG-CG1 3.91Å
10	L	80.1	Confident	64.3	Low	3 Å²	3	69.7 Å²	69.7	2%	0.016	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.6	175.2	-79	169.5	0	0	0	109.8	S35 V36 R96 L97 F100	L10-S35 CarbonylContact O-C 3.55Å; L10-S35 WeakPolarHBondContact O-CA 3.3Å; L10-V36 HydrophobicContact CB-CB 4.35Å; L10-V36 PolarHBondContact N-O 3.19Å; L10-V36 PolarHBondContact O-N 3.1Å; L10-R96 HydrophobicContact CD2-CB 3.86Å; L10-L97 HydrophobicContact CD1-CD1 4.1Å; L10-F100 HydrophobicContact CD1-CB 3.52Å; L10-F100 HydrophobicContact CD1-CD1 3.39Å; L10-F100 HydrophobicContact CD1-CD2 3.56Å; L10-F100 HydrophobicContact CD1-CE1 3.91Å; L10-F100 HydrophobicContact CD1-CE2 4.05Å; L10-F100 HydrophobicContact CD1-CG 3.19Å; L10-F100 HydrophobicContact CD1-CZ 4.21Å; L10-F100 HydrophobicContact CD2-CB 4.4Å; L10-F100 HydrophobicContact CG-CB 3.97Å; L10-F100 HydrophobicContact CG-CD1 4.49Å; L10-F100 HydrophobicContact CG-CD2 3.83Å; L10-F100 HydrophobicContact CG-CE2 4.43Å; L10-F100 HydrophobicContact CG-CG 3.86Å
11	Q	80.4	Confident	64.1	Low	147 Å²	147	72.1 Å²	72.1	69%	0.687	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.6	164.6	-70.6	-175.2	-12.7	0	0	108.7	A34	Q11-A34 WeakPolarHBondContact CA-O 3.4Å
12	C	83.2	Confident	65.3	Low	9 Å²	9	66 Å²	66	6%	0.061	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	170.8	-175.1	60	0	0	0	0	113.9	A34 S90 C92	C12-A34 PolarHBondContact N-O 3.49Å; C12-A34 WeakPolarHBondContact O-CA 3.33Å; C12-A34 PolarHBondContact O-N 2.85Å; C12-A34 VanDerWaalsContact O-O 3.13Å; C12-S90 WeakPolarHBondContact CB-O 3.45Å; C12-C92 HydrophobicContact CB-CB 4.44Å; C12-C92 WeakPolarHBondContact CB-SG 3.5Å
13	C	83.2	Confident	67.1	Low	25 Å²	25	60 Å²	60	17%	0.169	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.8	168.1	-67	0	0	0	0	109.2	I31 R32 S90	C13-I31 CarbonylContact C-O 3.56Å; C13-I31 WeakPolarHBondContact CA-O 3.21Å; C13-R32 PolarHBondContact SG-O 3.23Å; C13-S90 WeakPolarHBondContact CB-OG 3.36Å; C13-S90 PolarHBondContact N-O 3.12Å; C13-S90 PolarHBondContact O-N 3.16Å; C13-S90 PolarHBondContact O-OG 3.44Å
14	V	85.3	Confident	68.9	Low	0 Å²	0	61.3 Å²	61.3	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.4	-178.6	-176.1	0	0	0	0	110.1	V16 I31 A34 V36 V50 V87 L88 L89	V14-V16 HydrophobicContact CG1-CG2 4.03Å; V14-I31 PolarHBondContact N-O 3.38Å; V14-I31 PolarHBondContact O-N 3.19Å; V14-A34 HydrophobicContact CB-CB 4.02Å; V14-A34 HydrophobicContact CG2-CB 3.49Å; V14-A34 VanDerWaalsContact CG2-CB 3.49Å; V14-V36 HydrophobicContact CG2-CG2 3.54Å; V14-V50 HydrophobicContact CB-CG1 4.15Å; V14-V50 HydrophobicContact CG1-CG1 4.1Å; V14-V50 HydrophobicContact CG1-CG2 4.4Å; V14-V50 HydrophobicContact CG2-CG1 4.07Å; V14-V87 HydrophobicContact CG1-CG1 3.58Å; V14-L88 CarbonylContact C-O 3.55Å; V14-L88 VanDerWaalsContact CA-O 3.32Å; V14-L88 WeakPolarHBondContact CA-O 3.37Å; V14-L89 HydrophobicContact CB-CD2 4.38Å; V14-L89 HydrophobicContact CG1-CD2 4.1Å; V14-L89 HydrophobicContact CG2-CD2 3.61Å
15	A	83.7	Confident	70.4	Confident	5 Å²	5	60.1 Å²	60.1	4%	0.041	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123	166.5	0	0	0	0	0	109.4	Q29 L30 L88	A15-Q29 CarbonylContact C-O 3.59Å; A15-Q29 WeakPolarHBondContact CA-O 3.39Å; A15-L30 HydrophobicContact CB-CD1 3.88Å; A15-L88 HydrophobicContact CB-CB 4.24Å; A15-L88 PolarHBondContact N-O 2.7Å; A15-L88 PolarHBondContact O-N 3.24Å
16	V	82.9	Confident	71.7	Confident	10 Å²	10	58 Å²	58	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.3	175.1	-175.3	0	0	0	0	108.4	V14 R28 Q29 Y59 T85 Q86 V87	V14-V16 HydrophobicContact CG1-CG2 4.03Å; V16-R28 WeakPolarHBondContact O-CA 3.14Å; V16-Q29 PolarHBondContact N-O 3.3Å; V16-Q29 PolarHBondContact O-N 3.11Å; V16-Y59 HydrophobicContact CG1-CE1 4.28Å; V16-Y59 WeakPolarHBondContact CG1-OH 3.48Å; V16-Y59 HydrophobicContact CG2-CE2 4.48Å; V16-T85 HydrophobicContact CG1-CG2 3.66Å; V16-Q86 CarbonylContact C-O 3.56Å; V16-Q86 WeakPolarHBondContact CA-O 3.5Å; V16-V87 HydrophobicContact CG2-CG2 4.43Å
17	E	84.1	Confident	72.7	Confident	25 Å²	25	61.2 Å²	61.2	12%	0.117	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125	-178.2	-71.7	172.1	-170.3	0	0	109.8	A25 R27 R28 T85 Q86 L88	E17-A25 HydrophobicContact CB-CB 4.21Å; E17-A25 HydrophobicContact CG-CB 4.31Å; E17-R27 CarbonylContact C-O 3.57Å; E17-R27 VanDerWaalsContact CA-O 3.32Å; E17-R27 WeakPolarHBondContact CA-O 3.38Å; E17-R28 HydrophobicContact CG-CB 4.06Å; E17-R28 HydrophobicContact CG-CG 3.72Å; E17-R28 WeakPolarHBondContact OE1-CD 3.36Å; E17-R28 IonicContact OE1-CZ 2.75Å; E17-R28 IonicContact OE1-NE 2.84Å; E17-R28 PolarHBondContact OE1-NE 3.41Å; E17-R28 IonicContact OE1-NH2 2.78Å; E17-T85 CarbonylContact O-C 3.57Å; E17-T85 WeakPolarHBondContact O-CA 3.35Å; E17-Q86 HydrophobicContact CB-CB 4.4Å; E17-Q86 PolarHBondContact N-O 2.65Å; E17-Q86 PolarHBondContact O-N 2.93Å; E17-L88 HydrophobicContact CB-CD1 4.47Å; E17-L88 HydrophobicContact CG-CD1 4.19Å
18	K	77.3	Confident	73.9	Confident	117 Å²	117	68.3 Å²	68.3	51%	0.509	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	128.9	166.5	-71.4	-170.4	176.3	-172.3	0	108.8	A25 T26 R27	K18-A25 CarbonylContact O-C 3.49Å; K18-A25 WeakPolarHBondContact O-CA 2.95Å; K18-T26 PolarHBondContact O-N 3.3Å; K18-T26 PolarHBondContact O-OG1 2.99Å; K18-T26 VanDerWaalsContact O-OG1 3.12Å; K18-R27 HydrophobicContact CB-CB 4.47Å; K18-R27 PolarHBondContact N-O 3.28Å
19	L	76.8	Confident	74.8	Confident	16 Å²	16	71.6 Å²	71.6	8%	0.084	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	140.7	-177.3	-55.7	171.4	0	0	0	110.9	Q24 A25 K79 N84 Q86	L19-Q24 WeakPolarHBondContact CA-O 3.29Å; L19-A25 HydrophobicContact CD2-CB 4.16Å; L19-K79 HydrophobicContact CD1-CD 4.4Å; L19-N84 HydrophobicContact CB-CB 4.44Å; L19-N84 VanDerWaalsContact CB-O 3.31Å; L19-N84 WeakPolarHBondContact CB-O 3.26Å; L19-N84 PolarHBondContact N-O 2.9Å; L19-Q86 HydrophobicContact CD1-CB 4.24Å
20	N	70.8	Confident	75.1	Confident	78 Å²	78	72.2 Å²	72.2	42%	0.417	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-75.6	171.3	167.4	-75.7	2.4	0	0	0	111.5	C22 G23 Q24 T26	N20-C22 PolarHBondContact O-N 3.07Å; N20-C22 VanDerWaalsContact O-N 3.09Å; N20-G23 PolarHBondContact O-N 3.48Å; N20-Q24 PolarHBondContact N-O 2.74Å; N20-T26 WeakPolarHBondContact ND2-CG2 3.43Å; N20-T26 WeakPolarHBondContact OD1-CB 3.31Å; N20-T26 WeakPolarHBondContact OD1-CG2 3.38Å; N20-T26 PolarHBondContact OD1-OG1 3.39Å
21	S	60.2	Low	75.1	Confident	122 Å²	122	72.4 Å²	72.4	85%	0.853	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.2	175.3	45.2	0	0	0	0	113.9
22	C	56.7	Low	74.8	Confident	114 Å²	114	74.9 Å²	74.9	77%	0.77	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	3.5	174.9	-60.8	0	0	0	0	114.7	N20	N20-C22 PolarHBondContact O-N 3.07Å; N20-C22 VanDerWaalsContact O-N 3.09Å
23	G	61.2	Low	74.6	Confident	45 Å²	45	83.2 Å²	83.2	46%	0.464	42%	0.423	S	S	.	.	S	Bend	trans	80.2	10.2	176.8	0	0	0	0	0	116.1	N20	N20-G23 PolarHBondContact O-N 3.48Å
24	Q	66.2	Low	74.5	Confident	146 Å²	146	82.2 Å²	82.2	68%	0.682	42%	0.416	S	S	*	.			trans	-90.4	142.7	173.5	-68	-179	-13.7	0	0	111.3	L19 N20 T26	L19-Q24 WeakPolarHBondContact CA-O 3.29Å; N20-Q24 PolarHBondContact N-O 2.74Å; Q24-T26 PolarHBondContact O-N 2.95Å
25	A	67.2	Low	74.3	Confident	55 Å²	55	83 Å²	83	46%	0.455	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	113	-178.7	0	0	0	0	0	111.5	E17 K18 L19	E17-A25 HydrophobicContact CB-CB 4.21Å; E17-A25 HydrophobicContact CG-CB 4.31Å; K18-A25 CarbonylContact O-C 3.49Å; K18-A25 WeakPolarHBondContact O-CA 2.95Å; L19-A25 HydrophobicContact CD2-CB 4.16Å
26	T	66.6	Low	74.2	Confident	86 Å²	86	82.8 Å²	82.8	53%	0.528	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-29.9	176.2	10.7	0	0	0	0	113.1	K18 N20 Q24	K18-T26 PolarHBondContact O-N 3.3Å; K18-T26 PolarHBondContact O-OG1 2.99Å; K18-T26 VanDerWaalsContact O-OG1 3.12Å; N20-T26 WeakPolarHBondContact ND2-CG2 3.43Å; N20-T26 WeakPolarHBondContact OD1-CB 3.31Å; N20-T26 WeakPolarHBondContact OD1-CG2 3.38Å; N20-T26 PolarHBondContact OD1-OG1 3.39Å; Q24-T26 PolarHBondContact O-N 2.95Å
27	R	70.9	Confident	74.1	Confident	178 Å²	178	84 Å²	84	67%	0.672	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147	125.9	179.8	-171	173.7	177.8	179	-1.4	109.9	E17 K18	E17-R27 CarbonylContact C-O 3.57Å; E17-R27 VanDerWaalsContact CA-O 3.32Å; E17-R27 WeakPolarHBondContact CA-O 3.38Å; K18-R27 HydrophobicContact CB-CB 4.47Å; K18-R27 PolarHBondContact N-O 3.28Å
28	R	80.1	Confident	73.9	Confident	164 Å²	164	82.9 Å²	82.9	62%	0.619	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.3	179.9	-175.2	174.6	-163.1	-151.1	-4.4	110.4	V16 E17	V16-R28 WeakPolarHBondContact O-CA 3.14Å; E17-R28 HydrophobicContact CG-CB 4.06Å; E17-R28 HydrophobicContact CG-CG 3.72Å; E17-R28 WeakPolarHBondContact OE1-CD 3.36Å; E17-R28 IonicContact OE1-CZ 2.75Å; E17-R28 IonicContact OE1-NE 2.84Å; E17-R28 PolarHBondContact OE1-NE 3.41Å; E17-R28 IonicContact OE1-NH2 2.78Å
29	Q	79	Confident	73.8	Confident	76 Å²	76	77.3 Å²	77.3	36%	0.355	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	117.8	174.4	-177	175.5	-3.4	0	0	109.1	A15 V16	A15-Q29 CarbonylContact C-O 3.59Å; A15-Q29 WeakPolarHBondContact CA-O 3.39Å; V16-Q29 PolarHBondContact N-O 3.3Å; V16-Q29 PolarHBondContact O-N 3.11Å
30	L	81.2	Confident	73.6	Confident	96 Å²	96	79.9 Å²	79.9	50%	0.503	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122	-179.7	-179.8	70.2	0	0	0	110.5	A15	A15-L30 HydrophobicContact CB-CD1 3.88Å
31	I	80.4	Confident	73.6	Confident	6 Å²	6	77.7 Å²	77.7	3%	0.031	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	111.4	177	-62.2	168.8	0	0	0	108.3	C13 V14 A34 V50 D52	C13-I31 CarbonylContact C-O 3.56Å; C13-I31 WeakPolarHBondContact CA-O 3.21Å; V14-I31 PolarHBondContact N-O 3.38Å; V14-I31 PolarHBondContact O-N 3.19Å; I31-A34 HydrophobicContact CB-CB 4.21Å; I31-A34 HydrophobicContact CG2-CB 3.46Å; I31-A34 VanDerWaalsContact CG2-CB 3.46Å; I31-V50 HydrophobicContact CD1-CG1 4.11Å; I31-D52 HydrophobicContact CD1-CB 4.35Å; I31-D52 HydrophobicContact CG2-CB 3.81Å; I31-D52 WeakPolarHBondContact CG2-OD1 3.32Å
32	R	75.1	Confident	73.5	Confident	199 Å²	199	76.3 Å²	76.3	75%	0.751	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	-23.5	-173.5	-66.6	-174.9	180	-174.4	0.8	114	C13	C13-R32 PolarHBondContact SG-O 3.23Å
33	K	78.1	Confident	73.6	Confident	185 Å²	185	73.9 Å²	73.9	80%	0.804	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	74	178.1	-71.9	-173	178.2	-179.5	0	110.3
34	A	81.3	Confident	73.7	Confident	3 Å²	3	77.5 Å²	77.5	3%	0.025	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	140.9	179.1	0	0	0	0	0	111.7	Q11 C12 V14 I31 V50 H51	Q11-A34 WeakPolarHBondContact CA-O 3.4Å; C12-A34 PolarHBondContact N-O 3.49Å; C12-A34 WeakPolarHBondContact O-CA 3.33Å; C12-A34 PolarHBondContact O-N 2.85Å; C12-A34 VanDerWaalsContact O-O 3.13Å; V14-A34 HydrophobicContact CB-CB 4.02Å; V14-A34 HydrophobicContact CG2-CB 3.49Å; V14-A34 VanDerWaalsContact CG2-CB 3.49Å; I31-A34 HydrophobicContact CB-CB 4.21Å; I31-A34 HydrophobicContact CG2-CB 3.46Å; I31-A34 VanDerWaalsContact CG2-CB 3.46Å; A34-V50 HydrophobicContact CB-CG1 3.74Å; A34-H51 CarbonylContact C-O 3.55Å; A34-H51 VanDerWaalsContact CA-O 3.3Å; A34-H51 WeakPolarHBondContact CA-O 3.49Å
35	S	80.8	Confident	74	Confident	18 Å²	18	72.2 Å²	72.2	13%	0.126	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.9	162.2	179.5	0	0	0	0	108.8	Q9 L10 H51	Q9-S35 PolarHBondContact NE2-OG 3.19Å; L10-S35 CarbonylContact O-C 3.55Å; L10-S35 WeakPolarHBondContact O-CA 3.3Å; S35-H51 PolarHBondContact N-O 3.26Å; S35-H51 PolarHBondContact O-N 2.93Å
36	V	81.8	Confident	74.4	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	119.1	177.7	-175.9	0	0	0	0	108.9	Q9 L10 V14 L48 R49 V50 L89 F100	Q9-V36 CarbonylContact C-O 3.6Å; Q9-V36 WeakPolarHBondContact CA-O 3.48Å; L10-V36 HydrophobicContact CB-CB 4.35Å; L10-V36 PolarHBondContact N-O 3.19Å; L10-V36 PolarHBondContact O-N 3.1Å; V14-V36 HydrophobicContact CG2-CG2 3.54Å; V36-L48 HydrophobicContact CG1-CD1 3.49Å; V36-L48 VanDerWaalsContact CG1-CD1 3.49Å; V36-L48 HydrophobicContact CG1-CG 4Å; V36-R49 CarbonylContact C-O 3.57Å; V36-R49 WeakPolarHBondContact CA-O 3.42Å; V36-V50 HydrophobicContact CG2-CG1 4.42Å; V36-V50 HydrophobicContact CG2-CG2 4.26Å; V36-L89 HydrophobicContact CG2-CD2 3.99Å; V36-F100 HydrophobicContact CG1-CZ 4.06Å
37	I	81.4	Confident	75	Confident	36 Å²	36	66.6 Å²	66.6	19%	0.185	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131	-177.9	-55.2	170.6	0	0	0	108.6	A8 Q9 R49 F131 A133	A8-I37 WeakPolarHBondContact O-CA 3.37Å; Q9-I37 HydrophobicContact CB-CG1 4.32Å; Q9-I37 HydrophobicContact CG-CG1 3.91Å; I37-R49 PolarHBondContact N-O 3.16Å; I37-R49 PolarHBondContact O-N 3.26Å; I37-F131 HydrophobicContact CB-CZ 4.2Å; I37-F131 HydrophobicContact CG2-CE1 3.92Å; I37-F131 HydrophobicContact CG2-CZ 3.81Å; I37-A133 HydrophobicContact CG2-CB 4.34Å
38	L	78.6	Confident	75.5	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128	169.4	-161.1	74.8	0	0	0	108.9	A8 L46 L48 L61 F100 T103 L104 I134	A8-L38 PolarHBondContact O-N 3.49Å; L38-L46 HydrophobicContact CD2-CD2 4.42Å; L38-L46 HydrophobicContact CG-CD2 4.4Å; L38-L48 HydrophobicContact CD1-CD1 4.13Å; L38-L61 HydrophobicContact CD1-CD1 3.72Å; L38-F100 HydrophobicContact CB-CE2 4.01Å; L38-F100 HydrophobicContact CB-CZ 4.36Å; L38-T103 HydrophobicContact CD2-CG2 4.33Å; L38-L104 HydrophobicContact CD1-CD1 3.87Å; L38-L104 HydrophobicContact CD1-CG 4.05Å; L38-L104 HydrophobicContact CD2-CB 4.09Å; L38-L104 HydrophobicContact CD2-CG 4.4Å; L38-I134 HydrophobicContact CB-CD1 4.46Å; L38-I134 HydrophobicContact CD2-CD1 3.81Å; L38-I134 HydrophobicContact CD2-CG2 4.28Å; L38-I134 HydrophobicContact CG-CD1 3.75Å; L38-I134 WeakPolarHBondContact O-CB 3.3Å; L38-I134 PolarHBondContact O-N 3.24Å; L38-I134 VanDerWaalsContact O-N 3.08Å
39	G	75.7	Confident	75.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	-174.5	178.3	0	0	0	0	0	113	I47 E132	G39-I47 PolarHBondContact N-O 2.91Å; G39-I47 PolarHBondContact O-N 3.46Å; G39-E132 CarbonylContact C-O 3.59Å; G39-E132 WeakPolarHBondContact CA-O 3.39Å
40	R	73.2	Confident	75.6	Confident	71 Å²	71	50.1 Å²	50.1	27%	0.268	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.4	173.8	-70	178.9	177.2	167.8	-3	110.5	E45 E132 I134	R40-E45 VanDerWaalsContact CA-O 3.28Å; R40-E45 WeakPolarHBondContact CA-O 3.22Å; R40-E132 PolarHBondContact N-O 3.33Å; R40-E132 PolarHBondContact O-N 2.9Å; R40-I134 HydrophobicContact CG-CD1 4.18Å; R40-I134 HydrophobicContact CG-CG1 4.23Å
41	N	69.8	Low	75.5	Confident	32 Å²	32	48.9 Å²	48.9	17%	0.171	22%	0.215	C	C	.	.			trans	-83.4	177.3	166.3	66	9.1	0	0	0	111.8	F43 Q44 E45 I47	N41-F43 PolarHBondContact O-N 3.09Å; N41-F43 WeakPolarHBondContact OD1-CA 3.24Å; N41-F43 PolarHBondContact OD1-N 3.26Å; N41-Q44 PolarHBondContact O-N 3.22Å; N41-Q44 PolarHBondContact OD1-N 2.59Å; N41-E45 PolarHBondContact N-O 3.23Å; N41-E45 PolarHBondContact ND2-OE2 3.49Å; N41-E45 WeakPolarHBondContact OD1-CA 3.49Å; N41-E45 WeakPolarHBondContact OD1-CB 3.48Å; N41-E45 PolarHBondContact OD1-N 2.85Å; N41-I47 HydrophobicContact CB-CD1 3.61Å; N41-I47 HydrophobicContact CB-CG1 4.32Å
42	E	57.8	Low	75.3	Confident	92 Å²	92	52.3 Å²	52.3	43%	0.43	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-17.4	175.4	64.2	-158.9	169.3	0	0	114.1
43	F	59.2	Low	74.7	Confident	64 Å²	64	45.5 Å²	45.5	28%	0.281	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	14.4	176.1	-52.8	-67.5	0	0	0	113.4	N41 E45 K122	N41-F43 PolarHBondContact O-N 3.09Å; N41-F43 WeakPolarHBondContact OD1-CA 3.24Å; N41-F43 PolarHBondContact OD1-N 3.26Å; F43-E45 HydrophobicContact CB-CG 4.23Å; F43-E45 PolarHBondContact O-N 3.12Å; F43-K122 HydrophobicContact CD1-CB 4.33Å; F43-K122 HydrophobicContact CD1-CD 4.47Å; F43-K122 HydrophobicContact CD1-CG 3.96Å; F43-K122 HydrophobicContact CE1-CB 3.99Å; F43-K122 HydrophobicContact CE1-CG 4.13Å
44	Q	64.2	Low	73.8	Confident	121 Å²	121	46.2 Å²	46.2	57%	0.565	23%	0.228	S	C	*	.			trans	59.3	15.5	-174.8	-58.1	-159.1	-2.6	0	0	116.1	N41	N41-Q44 PolarHBondContact O-N 3.22Å; N41-Q44 PolarHBondContact OD1-N 2.59Å
45	E	71.4	Confident	72.9	Confident	34 Å²	34	51.9 Å²	51.9	16%	0.159	26%	0.258	C	S	.	.			trans	-76.3	141.6	174.4	-52.5	176.4	134.8	0	0	110.4	R40 N41 F43 I47 L60 K62	R40-E45 VanDerWaalsContact CA-O 3.28Å; R40-E45 WeakPolarHBondContact CA-O 3.22Å; N41-E45 PolarHBondContact N-O 3.23Å; N41-E45 PolarHBondContact ND2-OE2 3.49Å; N41-E45 WeakPolarHBondContact OD1-CA 3.49Å; N41-E45 WeakPolarHBondContact OD1-CB 3.48Å; N41-E45 PolarHBondContact OD1-N 2.85Å; F43-E45 HydrophobicContact CB-CG 4.23Å; F43-E45 PolarHBondContact O-N 3.12Å; E45-I47 PolarHBondContact O-N 3.41Å; E45-L60 HydrophobicContact CB-CD1 3.74Å; E45-L60 WeakPolarHBondContact OE2-CD1 3.44Å; E45-K62 WeakPolarHBondContact OE1-CE 3.3Å; E45-K62 IonicContact OE1-NZ 3.5Å; E45-K62 PolarHBondContact OE1-NZ 3.21Å; E45-K62 IonicContact OE2-NZ 3.94Å
46	L	75.8	Confident	72.5	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.8	179.8	-82.4	158.2	0	0	0	111.1	L38 L61 K107 H108 W111 I134	L38-L46 HydrophobicContact CD2-CD2 4.42Å; L38-L46 HydrophobicContact CG-CD2 4.4Å; L46-L61 HydrophobicContact CB-CB 4.03Å; L46-L61 HydrophobicContact CB-CD1 4.39Å; L46-L61 WeakPolarHBondContact O-CB 3.26Å; L46-L61 PolarHBondContact O-N 3.48Å; L46-K107 HydrophobicContact CD2-CB 4.32Å; L46-H108 VanDerWaalsContact CD1-CA 3.49Å; L46-H108 HydrophobicContact CD1-CB 4Å; L46-W111 HydrophobicContact CD1-CB 4.01Å; L46-W111 HydrophobicContact CD1-CG 4.38Å; L46-I134 HydrophobicContact CD2-CD1 3.29Å
47	I	79.3	Confident	72.2	Confident	20 Å²	20	57.3 Å²	57.3	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.3	175.9	-66.6	-169.2	0	0	0	110.4	G39 N41 E45 Y59 L60 F131	G39-I47 PolarHBondContact N-O 2.91Å; G39-I47 PolarHBondContact O-N 3.46Å; N41-I47 HydrophobicContact CB-CD1 3.61Å; N41-I47 HydrophobicContact CB-CG1 4.32Å; E45-I47 PolarHBondContact O-N 3.41Å; I47-Y59 WeakPolarHBondContact CA-O 3.47Å; I47-L60 HydrophobicContact CD1-CD1 4.3Å; I47-L60 HydrophobicContact CG1-CD1 3.79Å; I47-F131 HydrophobicContact CB-CE2 4.42Å; I47-F131 HydrophobicContact CG2-CE2 4.23Å
48	L	81	Confident	72	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	108	164.7	-169.9	71.3	0	0	0	108.6	V36 L38 Y59 L61 V87 F100	V36-L48 HydrophobicContact CG1-CD1 3.49Å; V36-L48 VanDerWaalsContact CG1-CD1 3.49Å; V36-L48 HydrophobicContact CG1-CG 4Å; L38-L48 HydrophobicContact CD1-CD1 4.13Å; L48-Y59 PolarHBondContact N-O 3.28Å; L48-Y59 PolarHBondContact O-N 3.09Å; L48-L61 HydrophobicContact CB-CD1 4.04Å; L48-L61 HydrophobicContact CB-CD2 4.26Å; L48-L61 HydrophobicContact CB-CG 4.14Å; L48-V87 HydrophobicContact CD2-CG1 4.46Å; L48-F100 HydrophobicContact CD1-CE1 4.32Å; L48-F100 HydrophobicContact CD1-CZ 3.68Å
49	R	80.6	Confident	72	Confident	70 Å²	70	59.5 Å²	59.5	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.2	178	-176.3	173.3	-76.4	-179.3	-4.8	110.1	V36 I37 H57 S58 F131	V36-R49 CarbonylContact C-O 3.57Å; V36-R49 WeakPolarHBondContact CA-O 3.42Å; I37-R49 PolarHBondContact N-O 3.16Å; I37-R49 PolarHBondContact O-N 3.26Å; R49-H57 CarbonylContact C-O 3.54Å; R49-H57 WeakPolarHBondContact CA-O 3.36Å; R49-S58 PolarHBondContact NE-OG 3.2Å; R49-S58 VanDerWaalsContact NE-OG 3.13Å; R49-F131 HydrophobicContact CB-CE2 3.85Å; R49-F131 HydrophobicContact CB-CZ 3.88Å; R49-F131 VanDerWaalsContact CZ-CB 3.43Å; R49-F131 VanDerWaalsContact NH1-CD1 3.29Å; R49-F131 VanDerWaalsContact NH2-CB 3.26Å
50	V	81.8	Confident	71.9	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	120.1	174.6	-175.5	0	0	0	0	108.3	V14 I31 A34 V36 H57 Y59	V14-V50 HydrophobicContact CB-CG1 4.15Å; V14-V50 HydrophobicContact CG1-CG1 4.1Å; V14-V50 HydrophobicContact CG1-CG2 4.4Å; V14-V50 HydrophobicContact CG2-CG1 4.07Å; I31-V50 HydrophobicContact CD1-CG1 4.11Å; A34-V50 HydrophobicContact CB-CG1 3.74Å; V36-V50 HydrophobicContact CG2-CG1 4.42Å; V36-V50 HydrophobicContact CG2-CG2 4.26Å; V50-H57 PolarHBondContact N-O 2.69Å; V50-H57 PolarHBondContact O-N 2.83Å; V50-Y59 HydrophobicContact CB-CE2 4.45Å; V50-Y59 HydrophobicContact CG2-CD2 4.25Å; V50-Y59 HydrophobicContact CG2-CE2 3.99Å
51	H	79.3	Confident	71.9	Confident	70 Å²	70	58.5 Å²	58.5	32%	0.324	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.8	-178.8	-175.2	-106.2	0	0	0	111.1	A34 S35 G53	A34-H51 CarbonylContact C-O 3.55Å; A34-H51 VanDerWaalsContact CA-O 3.3Å; A34-H51 WeakPolarHBondContact CA-O 3.49Å; S35-H51 PolarHBondContact N-O 3.26Å; S35-H51 PolarHBondContact O-N 2.93Å; H51-G53 VanDerWaalsContact CE1-C 3.41Å; H51-G53 WeakPolarHBondContact CE1-CA 3.37Å; H51-G53 PolarHBondContact CE1-N 3.34Å; H51-G53 VanDerWaalsContact CE1-N 3.29Å; H51-G53 PolarHBondContact ND1-N 3.35Å; H51-G53 VanDerWaalsContact ND1-N 3.19Å
52	D	74.6	Confident	71.8	Confident	77 Å²	77	61.3 Å²	61.3	41%	0.412	31%	0.313	S	S	.	.			trans	-103.4	22.4	179.9	-166	15.1	0	0	0	112.7	I31 K54 L55	I31-D52 HydrophobicContact CD1-CB 4.35Å; I31-D52 HydrophobicContact CG2-CB 3.81Å; I31-D52 WeakPolarHBondContact CG2-OD1 3.32Å; D52-K54 VanDerWaalsContact C-N 3.27Å; D52-K54 PolarHBondContact O-N 2.84Å; D52-L55 PolarHBondContact N-O 3.49Å
53	G	62.7	Low	72.4	Confident	57 Å²	57	62.8 Å²	62.8	59%	0.588	32%	0.32	S	S	*	.	S	Bend	trans	86.1	-23.8	-178.5	0	0	0	0	0	115.2	H51	H51-G53 VanDerWaalsContact CE1-C 3.41Å; H51-G53 WeakPolarHBondContact CE1-CA 3.37Å; H51-G53 PolarHBondContact CE1-N 3.34Å; H51-G53 VanDerWaalsContact CE1-N 3.29Å; H51-G53 PolarHBondContact ND1-N 3.35Å; H51-G53 VanDerWaalsContact ND1-N 3.19Å
54	K	59.4	Low	73.2	Confident	199 Å²	199	61 Å²	61	87%	0.865	31%	0.313	S	S	*	.	S	Bend	trans	-126.5	-35.6	178.8	-65	-177	-179.4	-178.5	0	114.8	D52	D52-K54 VanDerWaalsContact C-N 3.27Å; D52-K54 PolarHBondContact O-N 2.84Å
55	L	63.1	Low	73.8	Confident	123 Å²	123	60.9 Å²	60.9	64%	0.644	31%	0.31	S	S	*	.			trans	-125.9	139.9	-179.6	-68.5	169	0	0	0	109.9	D52	D52-L55 PolarHBondContact N-O 3.49Å
56	S	71.2	Confident	74.3	Confident	66 Å²	66	61.8 Å²	61.8	46%	0.462	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.6	175.1	61.3	0	0	0	0	111.1
57	H	75.7	Confident	74.4	Confident	65 Å²	65	66.6 Å²	66.6	30%	0.301	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	128.9	169.6	-62.5	84.2	0	0	0	108.8	R49 V50 Y59	R49-H57 CarbonylContact C-O 3.54Å; R49-H57 WeakPolarHBondContact CA-O 3.36Å; V50-H57 PolarHBondContact N-O 2.69Å; V50-H57 PolarHBondContact O-N 2.83Å; H57-Y59 HydrophobicContact CB-CE2 3.92Å
58	S	76.7	Confident	74.4	Confident	56 Å²	56	69.1 Å²	69.1	39%	0.392	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.2	-179.1	-62.2	0	0	0	0	109.3	R49	R49-S58 PolarHBondContact NE-OG 3.2Å; R49-S58 VanDerWaalsContact NE-OG 3.13Å
59	Y	78.8	Confident	73.9	Confident	26 Å²	26	77.6 Å²	77.6	10%	0.102	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.3	179.6	-58.6	-81.5	0	0	0	110.4	V16 I47 L48 V50 H57 L80 T85 V87	V16-Y59 HydrophobicContact CG1-CE1 4.28Å; V16-Y59 WeakPolarHBondContact CG1-OH 3.48Å; V16-Y59 HydrophobicContact CG2-CE2 4.48Å; I47-Y59 WeakPolarHBondContact CA-O 3.47Å; L48-Y59 PolarHBondContact N-O 3.28Å; L48-Y59 PolarHBondContact O-N 3.09Å; V50-Y59 HydrophobicContact CB-CE2 4.45Å; V50-Y59 HydrophobicContact CG2-CD2 4.25Å; V50-Y59 HydrophobicContact CG2-CE2 3.99Å; H57-Y59 HydrophobicContact CB-CE2 3.92Å; Y59-L80 HydrophobicContact CD1-CD1 3.84Å; Y59-L80 HydrophobicContact CG-CD1 4.08Å; Y59-T85 HydrophobicContact CE1-CG2 4.3Å; Y59-V87 HydrophobicContact CD2-CG2 4.5Å
60	L	74.4	Confident	73.7	Confident	48 Å²	48	79.7 Å²	79.7	25%	0.251	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	124.1	-178.3	-164.4	66.9	0	0	0	110.9	E45 I47 K62	E45-L60 HydrophobicContact CB-CD1 3.74Å; E45-L60 WeakPolarHBondContact OE2-CD1 3.44Å; I47-L60 HydrophobicContact CD1-CD1 4.3Å; I47-L60 HydrophobicContact CG1-CD1 3.79Å; L60-K62 HydrophobicContact CD2-CD 3.59Å; L60-K62 VanDerWaalsContact CD2-CE 3.43Å; L60-K62 HydrophobicContact CD2-CG 3.89Å; L60-K62 HydrophobicContact CG-CD 4.31Å; L60-K62 HydrophobicContact CG-CG 4.04Å; L60-K62 PolarHBondContact O-N 3.36Å
61	L	74.1	Confident	73.4	Confident	3 Å²	3	80.1 Å²	80.1	2%	0.016	41%	0.405	C	S	.	.			trans	-93.4	56.4	-176.9	-65.2	174.7	0	0	0	111.8	L38 L46 L48 F64 V78 L80 L104	L38-L61 HydrophobicContact CD1-CD1 3.72Å; L46-L61 HydrophobicContact CB-CB 4.03Å; L46-L61 HydrophobicContact CB-CD1 4.39Å; L46-L61 WeakPolarHBondContact O-CB 3.26Å; L46-L61 PolarHBondContact O-N 3.48Å; L48-L61 HydrophobicContact CB-CD1 4.04Å; L48-L61 HydrophobicContact CB-CD2 4.26Å; L48-L61 HydrophobicContact CB-CG 4.14Å; L61-F64 HydrophobicContact CB-CD1 3.8Å; L61-F64 HydrophobicContact CB-CE1 3.88Å; L61-F64 HydrophobicContact CD2-CB 4.42Å; L61-F64 HydrophobicContact CD2-CD1 3.87Å; L61-F64 HydrophobicContact CD2-CE1 4.34Å; L61-F64 HydrophobicContact CD2-CG 4.08Å; L61-F64 HydrophobicContact CG-CD1 4.39Å; L61-V78 HydrophobicContact CD2-CG1 4.23Å; L61-L80 HydrophobicContact CD2-CD2 3.7Å; L61-L104 HydrophobicContact CD1-CD1 4.15Å; L61-L104 HydrophobicContact CD1-CG 4.38Å
62	K	66.7	Low	73	Confident	90 Å²	90	80.2 Å²	80.2	39%	0.391	41%	0.413	S	S	.	.	S	Bend	trans	-73.2	-55.7	176.3	-83.7	179.1	173.3	162.5	0	112.5	E45 L60 W111	E45-K62 WeakPolarHBondContact OE1-CE 3.3Å; E45-K62 IonicContact OE1-NZ 3.5Å; E45-K62 PolarHBondContact OE1-NZ 3.21Å; E45-K62 IonicContact OE2-NZ 3.94Å; L60-K62 HydrophobicContact CD2-CD 3.59Å; L60-K62 VanDerWaalsContact CD2-CE 3.43Å; L60-K62 HydrophobicContact CD2-CG 3.89Å; L60-K62 HydrophobicContact CG-CD 4.31Å; L60-K62 HydrophobicContact CG-CG 4.04Å; L60-K62 PolarHBondContact O-N 3.36Å; K62-W111 HydrophobicContact CG-CH2 4.23Å
63	E	69.5	Low	73	Confident	123 Å²	123	81.3 Å²	81.3	58%	0.575	42%	0.419	S	S	*	.	S	Bend	trans	-135.8	113.9	175.3	-69.3	-170.6	175.6	0	0	109.6	L81 P82	E63-L81 HydrophobicContact CB-CB 4.19Å; E63-L81 HydrophobicContact CB-CD1 4.12Å; E63-L81 PolarHBondContact O-N 2.94Å; E63-P82 WeakPolarHBondContact O-CD 3.33Å
64	F	77.7	Confident	73.6	Confident	28 Å²	28	78.7 Å²	78.7	12%	0.123	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	154.3	-178.6	66.5	-88.7	0	0	0	112.3	L61 L66 V78 K79 L80 L104 H108	L61-F64 HydrophobicContact CB-CD1 3.8Å; L61-F64 HydrophobicContact CB-CE1 3.88Å; L61-F64 HydrophobicContact CD2-CB 4.42Å; L61-F64 HydrophobicContact CD2-CD1 3.87Å; L61-F64 HydrophobicContact CD2-CE1 4.34Å; L61-F64 HydrophobicContact CD2-CG 4.08Å; L61-F64 HydrophobicContact CG-CD1 4.39Å; F64-L66 HydrophobicContact CD2-CD2 4.01Å; F64-L66 HydrophobicContact CD2-CG 3.83Å; F64-L66 HydrophobicContact CE2-CD1 3.81Å; F64-L66 HydrophobicContact CE2-CD2 3.92Å; F64-L66 HydrophobicContact CE2-CG 3.58Å; F64-V78 HydrophobicContact CB-CG1 4.22Å; F64-V78 HydrophobicContact CD2-CG1 4.06Å; F64-V78 HydrophobicContact CG-CG1 4.34Å; F64-K79 CarbonylContact C-O 3.52Å; F64-K79 WeakPolarHBondContact CA-O 3.31Å; F64-K79 WeakPolarHBondContact CB-O 3.4Å; F64-L80 HydrophobicContact CB-CD2 4.01Å; F64-L104 HydrophobicContact CE1-CD2 4.34Å; F64-L104 HydrophobicContact CE2-CD2 3.41Å; F64-L104 VanDerWaalsContact CE2-CD2 3.41Å; F64-L104 HydrophobicContact CZ-CD2 3.31Å; F64-H108 HydrophobicContact CE1-CB 4.3Å; F64-H108 AromaticContact CE1-CD2 3.36Å; F64-H108 WeakPolarHBondContact CE1-CD2 3.4Å; F64-H108 AromaticContact CE1-CE1 3.87Å; F64-H108 AromaticContact CE1-CG 3.65Å; F64-H108 AromaticContact CE1-ND1 3.99Å; F64-H108 AromaticContact CE1-NE2 3.51Å; F64-H108 HydrophobicContact CZ-CB 4.08Å; F64-H108 AromaticContact CZ-CD2 3.97Å; F64-H108 AromaticContact CZ-CG 3.75Å; F64-H108 AromaticContact CZ-ND1 3.97Å
65	K	76.6	Confident	74.7	Confident	118 Å²	118	74.8 Å²	74.8	51%	0.513	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.3	171.7	-68.6	-176.5	178.4	178.4	0	109.9	F67 K79 L81	K65-F67 HydrophobicContact CB-CE2 4.13Å; K65-F67 HydrophobicContact CB-CZ 4.41Å; K65-K79 PolarHBondContact N-O 3.27Å; K65-K79 PolarHBondContact O-N 3.38Å; K65-L81 HydrophobicContact CD-CD2 4.18Å; K65-L81 HydrophobicContact CG-CD1 4.17Å; K65-L81 HydrophobicContact CG-CD2 4.37Å; K65-L81 HydrophobicContact CG-CG 4.47Å
66	L	80.7	Confident	75.7	Confident	52 Å²	52	69.1 Å²	69.1	27%	0.272	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.4	175	-66.8	170.4	0	0	0	110.7	F64 T68 V78 L101 L104	F64-L66 HydrophobicContact CD2-CD2 4.01Å; F64-L66 HydrophobicContact CD2-CG 3.83Å; F64-L66 HydrophobicContact CE2-CD1 3.81Å; F64-L66 HydrophobicContact CE2-CD2 3.92Å; F64-L66 HydrophobicContact CE2-CG 3.58Å; L66-T68 HydrophobicContact CB-CG2 4.34Å; L66-V78 HydrophobicContact CD2-CB 4.28Å; L66-V78 HydrophobicContact CD2-CG1 4.07Å; L66-V78 HydrophobicContact CD2-CG2 3.71Å; L66-L101 HydrophobicContact CD2-CD2 4.25Å; L66-L104 HydrophobicContact CD1-CD2 3.99Å; L66-L104 HydrophobicContact CD2-CD2 4.34Å
67	F	79.2	Confident	76.3	Confident	106 Å²	106	67.2 Å²	67.2	47%	0.465	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	111.6	170	-58.9	-87.8	0	0	0	109	K65 C76 T77 K79	K65-F67 HydrophobicContact CB-CE2 4.13Å; K65-F67 HydrophobicContact CB-CZ 4.41Å; F67-C76 PolarHBondContact O-SG 3.19Å; F67-T77 PolarHBondContact N-O 3.3Å; F67-T77 PolarHBondContact O-N 3.07Å; F67-T77 VanDerWaalsContact O-N 3.08Å; F67-K79 HydrophobicContact CE2-CB 3.97Å
68	T	78.4	Confident	76.6	Confident	73 Å²	73	64.2 Å²	64.2	45%	0.448	32%	0.317	S	S	.	.			trans	-115.3	10.6	-172.2	57.5	0	0	0	0	113.3	L66 F70 A71 L101	L66-T68 HydrophobicContact CB-CG2 4.34Å; T68-F70 PolarHBondContact O-N 3.14Å; T68-A71 VanDerWaalsContact O-CB 3.24Å; T68-A71 WeakPolarHBondContact O-CB 3.43Å; T68-A71 PolarHBondContact O-N 3.18Å; T68-L101 HydrophobicContact CG2-CD1 3.85Å; T68-L101 HydrophobicContact CG2-CD2 4.49Å
69	K	71.8	Confident	76.8	Confident	179 Å²	179	64 Å²	64	78%	0.778	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.2	-176.9	-170.4	176.7	179.6	-179.7	0	113.5
70	F	75.9	Confident	76.8	Confident	114 Å²	114	62.9 Å²	62.9	50%	0.5	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	20.2	-179.8	-58	-73.7	0	0	0	113.4	T68 S72 D73 G74 K75	T68-F70 PolarHBondContact O-N 3.14Å; F70-S72 PolarHBondContact O-N 3.44Å; F70-D73 CarbonylContact O-C 3.54Å; F70-D73 WeakPolarHBondContact O-CA 3.26Å; F70-D73 PolarHBondContact O-N 3.34Å; F70-G74 PolarHBondContact O-N 2.98Å; F70-K75 CarbonylContact C-O 3.59Å; F70-K75 HydrophobicContact CB-CB 3.94Å; F70-K75 PolarHBondContact O-N 3.34Å; F70-K75 VanDerWaalsContact O-N 3.13Å; F70-K75 VanDerWaalsContact O-O 3.05Å
71	A	74.9	Confident	76.4	Confident	10 Å²	10	63.6 Å²	63.6	8%	0.083	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-67	-22.2	-179.1	0	0	0	0	0	112.8	T68 D73 G74 K75 L97 L101	T68-A71 VanDerWaalsContact O-CB 3.24Å; T68-A71 WeakPolarHBondContact O-CB 3.43Å; T68-A71 PolarHBondContact O-N 3.18Å; A71-D73 PolarHBondContact O-N 3.01Å; A71-G74 PolarHBondContact O-N 3.18Å; A71-K75 VanDerWaalsContact CA-O 3.28Å; A71-K75 WeakPolarHBondContact CA-O 3.4Å; A71-K75 PolarHBondContact N-O 3.35Å; A71-K75 VanDerWaalsContact N-O 3.16Å; A71-L97 HydrophobicContact CB-CD2 4.31Å; A71-L101 HydrophobicContact CB-CD1 4.1Å
72	S	71.1	Confident	75.7	Confident	71 Å²	71	68 Å²	68	50%	0.497	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-63.7	-28.3	168.9	52.5	0	0	0	0	112.8	F70 P94	F70-S72 PolarHBondContact O-N 3.44Å; S72-P94 WeakPolarHBondContact O-CG 3.41Å
73	D	74.3	Confident	75.5	Confident	101 Å²	101	68.8 Å²	68.8	54%	0.54	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-101.2	14	-174.3	-48.8	-14.6	0	0	0	110.8	F70 A71 K75	F70-D73 CarbonylContact O-C 3.54Å; F70-D73 WeakPolarHBondContact O-CA 3.26Å; F70-D73 PolarHBondContact O-N 3.34Å; A71-D73 PolarHBondContact O-N 3.01Å; D73-K75 PolarHBondContact O-N 3.44Å
74	G	75.8	Confident	75.6	Confident	2 Å²	2	66.1 Å²	66.1	2%	0.021	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	21.4	179.2	0	0	0	0	0	114.7	F70 A71 N91 C92	F70-G74 PolarHBondContact O-N 2.98Å; A71-G74 PolarHBondContact O-N 3.18Å; G74-N91 PolarHBondContact O-N 3.4Å; G74-C92 WeakPolarHBondContact CA-O 3.43Å; G74-C92 PolarHBondContact O-N 2.98Å; G74-C92 VanDerWaalsContact O-N 3.13Å
75	K	81.8	Confident	75.6	Confident	117 Å²	117	65 Å²	65	51%	0.509	33%	0.328	S	S	.	.			trans	-121.2	136.4	179.9	-62.3	176.3	-174.9	173.6	0	112.1	F70 A71 D73 L89	F70-K75 CarbonylContact C-O 3.59Å; F70-K75 HydrophobicContact CB-CB 3.94Å; F70-K75 PolarHBondContact O-N 3.34Å; F70-K75 VanDerWaalsContact O-N 3.13Å; F70-K75 VanDerWaalsContact O-O 3.05Å; A71-K75 VanDerWaalsContact CA-O 3.28Å; A71-K75 WeakPolarHBondContact CA-O 3.4Å; A71-K75 PolarHBondContact N-O 3.35Å; A71-K75 VanDerWaalsContact N-O 3.16Å; D73-K75 PolarHBondContact O-N 3.44Å; K75-L89 CarbonylContact C-O 3.56Å; K75-L89 VanDerWaalsContact CA-O 3.28Å; K75-L89 WeakPolarHBondContact CA-O 3.36Å
76	C	85.7	Confident	75.8	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.02	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	151.6	175.4	-178.6	0	0	0	0	110.6	F67 L89 L97 L101	F67-C76 PolarHBondContact O-SG 3.19Å; C76-L89 PolarHBondContact N-O 2.99Å; C76-L89 PolarHBondContact O-N 2.9Å; C76-L97 HydrophobicContact CB-CD1 4.11Å; C76-L97 HydrophobicContact CB-CD2 4.16Å; C76-L101 HydrophobicContact CB-CD1 4.35Å; C76-L101 VanDerWaalsContact SG-CD2 3.55Å
77	T	82.5	Confident	75.9	Confident	27 Å²	27	58.8 Å²	58.8	17%	0.166	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.8	175.7	-49.5	0	0	0	0	111.5	F67 Q86 V87 L88	F67-T77 PolarHBondContact N-O 3.3Å; F67-T77 PolarHBondContact O-N 3.07Å; F67-T77 VanDerWaalsContact O-N 3.08Å; T77-Q86 HydrophobicContact CG2-CG 3.23Å; T77-V87 WeakPolarHBondContact CA-O 3.24Å; T77-L88 HydrophobicContact CG2-CD1 4.41Å; T77-L88 HydrophobicContact CG2-CG 3.89Å
78	V	82.9	Confident	76.2	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	115.9	174.4	-170	0	0	0	0	108.1	L61 F64 L66 V87	L61-V78 HydrophobicContact CD2-CG1 4.23Å; F64-V78 HydrophobicContact CB-CG1 4.22Å; F64-V78 HydrophobicContact CD2-CG1 4.06Å; F64-V78 HydrophobicContact CG-CG1 4.34Å; L66-V78 HydrophobicContact CD2-CB 4.28Å; L66-V78 HydrophobicContact CD2-CG1 4.07Å; L66-V78 HydrophobicContact CD2-CG2 3.71Å; V78-V87 HydrophobicContact CB-CB 4.48Å; V78-V87 PolarHBondContact N-O 3.2Å; V78-V87 PolarHBondContact O-N 3.12Å
79	K	79.7	Confident	76.5	Confident	52 Å²	52	52.4 Å²	52.4	23%	0.226	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.7	176.7	-176.6	171.4	179.5	168.7	0	109.9	L19 F64 K65 F67	L19-K79 HydrophobicContact CD1-CD 4.4Å; F64-K79 CarbonylContact C-O 3.52Å; F64-K79 WeakPolarHBondContact CA-O 3.31Å; F64-K79 WeakPolarHBondContact CB-O 3.4Å; K65-K79 PolarHBondContact N-O 3.27Å; K65-K79 PolarHBondContact O-N 3.38Å; F67-K79 HydrophobicContact CE2-CB 3.97Å
80	L	79.3	Confident	77	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	122.4	176.6	-55.1	169.5	0	0	0	108.5	Y59 L61 F64 N84 T85	Y59-L80 HydrophobicContact CD1-CD1 3.84Å; Y59-L80 HydrophobicContact CG-CD1 4.08Å; L61-L80 HydrophobicContact CD2-CD2 3.7Å; F64-L80 HydrophobicContact CB-CD2 4.01Å; L80-N84 PolarHBondContact O-N 3.35Å; L80-T85 WeakPolarHBondContact CB-O 3.32Å; L80-T85 PolarHBondContact N-O 3.45Å; L80-T85 PolarHBondContact O-N 2.85Å
81	L	65.4	Low	77.3	Confident	62 Å²	62	46.4 Å²	46.4	33%	0.325	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-41.5	-173.4	-68.9	167.3	0	0	0	114.7	E63 K65 E83	E63-L81 HydrophobicContact CB-CB 4.19Å; E63-L81 HydrophobicContact CB-CD1 4.12Å; E63-L81 PolarHBondContact O-N 2.94Å; K65-L81 HydrophobicContact CD-CD2 4.18Å; K65-L81 HydrophobicContact CG-CD1 4.17Å; K65-L81 HydrophobicContact CG-CD2 4.37Å; K65-L81 HydrophobicContact CG-CG 4.47Å; L81-E83 VanDerWaalsContact C-N 3.33Å; L81-E83 PolarHBondContact O-N 2.78Å
82	P	60.7	Low	77.5	Confident	95 Å²	95	46.2 Å²	46.2	62%	0.617	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-21.1	-178.3	25.6	-31.4	0	0	0	113.8	E63	E63-P82 WeakPolarHBondContact O-CD 3.33Å
83	E	62.8	Low	77.9	Confident	108 Å²	108	46 Å²	46	51%	0.505	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	3.6	-175.7	-63.3	-177.9	178.5	0	0	113.5	L81 T85	L81-E83 VanDerWaalsContact C-N 3.33Å; L81-E83 PolarHBondContact O-N 2.78Å; E83-T85 PolarHBondContact O-N 2.96Å; E83-T85 PolarHBondContact O-OG1 3.13Å
84	N	70.7	Confident	77.9	Confident	67 Å²	67	43.6 Å²	43.6	36%	0.358	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	41.8	35.5	-173.2	-87.8	-29.6	0	0	0	113.7	L19 L80	L19-N84 HydrophobicContact CB-CB 4.44Å; L19-N84 VanDerWaalsContact CB-O 3.31Å; L19-N84 WeakPolarHBondContact CB-O 3.26Å; L19-N84 PolarHBondContact N-O 2.9Å; L80-N84 PolarHBondContact O-N 3.35Å
85	T	77.2	Confident	77.8	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.7	-175.7	-63	0	0	0	0	109.4	V16 E17 Y59 L80 E83	V16-T85 HydrophobicContact CG1-CG2 3.66Å; E17-T85 CarbonylContact O-C 3.57Å; E17-T85 WeakPolarHBondContact O-CA 3.35Å; Y59-T85 HydrophobicContact CE1-CG2 4.3Å; L80-T85 WeakPolarHBondContact CB-O 3.32Å; L80-T85 PolarHBondContact N-O 3.45Å; L80-T85 PolarHBondContact O-N 2.85Å; E83-T85 PolarHBondContact O-N 2.96Å; E83-T85 PolarHBondContact O-OG1 3.13Å
86	Q	81.8	Confident	77.5	Confident	39 Å²	39	49.2 Å²	49.2	18%	0.182	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.6	-177.1	-170.1	173.5	0.3	0	0	109.7	V16 E17 L19 T77 L88	V16-Q86 CarbonylContact C-O 3.56Å; V16-Q86 WeakPolarHBondContact CA-O 3.5Å; E17-Q86 HydrophobicContact CB-CB 4.4Å; E17-Q86 PolarHBondContact N-O 2.65Å; E17-Q86 PolarHBondContact O-N 2.93Å; L19-Q86 HydrophobicContact CD1-CB 4.24Å; T77-Q86 HydrophobicContact CG2-CG 3.23Å; Q86-L88 HydrophobicContact CB-CD1 4.36Å; Q86-L88 HydrophobicContact CG-CD1 3.81Å; Q86-L88 HydrophobicContact CG-CG 4.46Å
87	V	83.3	Confident	77.2	Confident	1 Å²	1	49 Å²	49	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	110.6	177.8	-175.8	0	0	0	0	108.2	V14 V16 L48 Y59 T77 V78 L89	V14-V87 HydrophobicContact CG1-CG1 3.58Å; V16-V87 HydrophobicContact CG2-CG2 4.43Å; L48-V87 HydrophobicContact CD2-CG1 4.46Å; Y59-V87 HydrophobicContact CD2-CG2 4.5Å; T77-V87 WeakPolarHBondContact CA-O 3.24Å; V78-V87 HydrophobicContact CB-CB 4.48Å; V78-V87 PolarHBondContact N-O 3.2Å; V78-V87 PolarHBondContact O-N 3.12Å; V87-L89 HydrophobicContact CG1-CD2 4.06Å
88	L	84.6	Confident	76.8	Confident	42 Å²	42	52.3 Å²	52.3	22%	0.22	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.1	178.4	-63.5	86	0	0	0	109.3	V14 A15 E17 T77 Q86	V14-L88 CarbonylContact C-O 3.55Å; V14-L88 VanDerWaalsContact CA-O 3.32Å; V14-L88 WeakPolarHBondContact CA-O 3.37Å; A15-L88 HydrophobicContact CB-CB 4.24Å; A15-L88 PolarHBondContact N-O 2.7Å; A15-L88 PolarHBondContact O-N 3.24Å; E17-L88 HydrophobicContact CB-CD1 4.47Å; E17-L88 HydrophobicContact CG-CD1 4.19Å; T77-L88 HydrophobicContact CG2-CD1 4.41Å; T77-L88 HydrophobicContact CG2-CG 3.89Å; Q86-L88 HydrophobicContact CB-CD1 4.36Å; Q86-L88 HydrophobicContact CG-CD1 3.81Å; Q86-L88 HydrophobicContact CG-CG 4.46Å
89	L	85.1	Confident	76.5	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.4	174.2	-52.5	-179.8	0	0	0	108.6	V14 V36 K75 C76 V87	V14-L89 HydrophobicContact CB-CD2 4.38Å; V14-L89 HydrophobicContact CG1-CD2 4.1Å; V14-L89 HydrophobicContact CG2-CD2 3.61Å; V36-L89 HydrophobicContact CG2-CD2 3.99Å; K75-L89 CarbonylContact C-O 3.56Å; K75-L89 VanDerWaalsContact CA-O 3.28Å; K75-L89 WeakPolarHBondContact CA-O 3.36Å; C76-L89 PolarHBondContact N-O 2.99Å; C76-L89 PolarHBondContact O-N 2.9Å; V87-L89 HydrophobicContact CG1-CD2 4.06Å
90	S	82.7	Confident	76.4	Confident	39 Å²	39	53.8 Å²	53.8	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	159.4	179.5	59.9	0	0	0	0	111.1	C12 C13 C92	C12-S90 WeakPolarHBondContact CB-O 3.45Å; C13-S90 WeakPolarHBondContact CB-OG 3.36Å; C13-S90 PolarHBondContact N-O 3.12Å; C13-S90 PolarHBondContact O-N 3.16Å; C13-S90 PolarHBondContact O-OG 3.44Å; S90-C92 VanDerWaalsContact C-N 3.3Å; S90-C92 PolarHBondContact O-N 3.01Å
91	N	81.2	Confident	76.3	Confident	129 Å²	129	54.5 Å²	54.5	69%	0.69	29%	0.288	S	S	*	.	S	Bend	trans	61.1	35.9	-176.8	-158.8	27.4	0	0	0	113.4	G74	G74-N91 PolarHBondContact O-N 3.4Å
92	C	79.3	Confident	76.7	Confident	6 Å²	6	58.1 Å²	58.1	4%	0.041	30%	0.301	C	S	.	.			trans	-91.4	141.7	174.5	-55.7	0	0	0	0	110.5	C12 G74 S90 P94 L97	C12-C92 HydrophobicContact CB-CB 4.44Å; C12-C92 WeakPolarHBondContact CB-SG 3.5Å; G74-C92 WeakPolarHBondContact CA-O 3.43Å; G74-C92 PolarHBondContact O-N 2.98Å; G74-C92 VanDerWaalsContact O-N 3.13Å; S90-C92 VanDerWaalsContact C-N 3.3Å; S90-C92 PolarHBondContact O-N 3.01Å; C92-P94 WeakPolarHBondContact O-CD 3.31Å; C92-L97 HydrophobicContact CB-CB 3.97Å; C92-L97 HydrophobicContact CB-CD1 4.31Å; C92-L97 HydrophobicContact CB-CD2 4.16Å; C92-L97 HydrophobicContact CB-CG 4.37Å
93	P	78.3	Confident	77.3	Confident	65 Å²	65	53.8 Å²	53.8	42%	0.422	27%	0.273	S	S	.	.			trans	-55.6	122.6	165.9	-23.8	33.5	0	0	0	110.4	D95 R96 L97	P93-D95 PolarHBondContact O-N 3.48Å; P93-D95 VanDerWaalsContact O-N 3.15Å; P93-R96 HydrophobicContact CB-CB 4.28Å; P93-R96 HydrophobicContact CB-CG 4.43Å; P93-R96 PolarHBondContact O-N 3.46Å; P93-R96 VanDerWaalsContact O-N 3.13Å; P93-L97 PolarHBondContact O-N 3.08Å
94	P	75.3	Confident	77.9	Confident	52 Å²	52	48.7 Å²	48.7	34%	0.338	25%	0.249	S	C	.	.	H	α-helix	trans	-57.8	-34.2	-170.7	-27.8	34.4	0	0	0	114.2	S72 C92 K98	S72-P94 WeakPolarHBondContact O-CG 3.41Å; C92-P94 WeakPolarHBondContact O-CD 3.31Å; P94-K98 VanDerWaalsContact O-CG 3.25Å; P94-K98 WeakPolarHBondContact O-CG 3.36Å; P94-K98 PolarHBondContact O-N 3.04Å
95	D	73.7	Confident	78	Confident	126 Å²	126	48.2 Å²	48.2	67%	0.674	25%	0.251	S	S	*	.	H	α-helix	trans	-74.1	-38.1	-179.5	-65.3	-34.2	0	0	0	112.4	P93 L99	P93-D95 PolarHBondContact O-N 3.48Å; P93-D95 VanDerWaalsContact O-N 3.15Å; D95-L99 PolarHBondContact O-N 2.9Å; D95-L99 VanDerWaalsContact O-N 3.13Å
96	R	76.3	Confident	77.7	Confident	110 Å²	110	49.7 Å²	49.7	42%	0.415	26%	0.258	S	S	.	.	H	α-helix	trans	-70.6	-38.1	173.7	-70.1	-166.8	175.5	172.3	5.4	111.7	E5 L10 P93 K98 L99 F100	E5-R96 IonicContact OE1-CZ 3.73Å; E5-R96 IonicContact OE1-NH2 3.6Å; E5-R96 PolarHBondContact OE1-NH2 3.37Å; E5-R96 IonicContact OE2-CZ 3.78Å; E5-R96 IonicContact OE2-NE 2.89Å; E5-R96 PolarHBondContact OE2-NE 2.83Å; E5-R96 IonicContact OE2-NH2 2.71Å; E5-R96 PolarHBondContact OE2-NH2 3.29Å; L10-R96 HydrophobicContact CD2-CB 3.86Å; P93-R96 HydrophobicContact CB-CB 4.28Å; P93-R96 HydrophobicContact CB-CG 4.43Å; P93-R96 PolarHBondContact O-N 3.46Å; P93-R96 VanDerWaalsContact O-N 3.13Å; R96-K98 PolarHBondContact O-N 3.47Å; R96-L99 PolarHBondContact O-N 3.38Å; R96-F100 WeakPolarHBondContact O-CB 3.5Å; R96-F100 PolarHBondContact O-N 3.02Å
97	L	77.8	Confident	77.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-42	175.5	-176.8	62.3	0	0	0	111.5	L10 A71 C76 C92 P93 F100 L101	L10-L97 HydrophobicContact CD1-CD1 4.1Å; A71-L97 HydrophobicContact CB-CD2 4.31Å; C76-L97 HydrophobicContact CB-CD1 4.11Å; C76-L97 HydrophobicContact CB-CD2 4.16Å; C92-L97 HydrophobicContact CB-CB 3.97Å; C92-L97 HydrophobicContact CB-CD1 4.31Å; C92-L97 HydrophobicContact CB-CD2 4.16Å; C92-L97 HydrophobicContact CB-CG 4.37Å; P93-L97 PolarHBondContact O-N 3.08Å; L97-F100 PolarHBondContact O-N 3.3Å; L97-L101 HydrophobicContact CD1-CD1 4.23Å; L97-L101 HydrophobicContact CD1-CG 4.27Å; L97-L101 HydrophobicContact CG-CD1 4.01Å; L97-L101 HydrophobicContact CG-CG 4.47Å; L97-L101 WeakPolarHBondContact O-CB 3.35Å; L97-L101 VanDerWaalsContact O-CG 3.24Å; L97-L101 WeakPolarHBondContact O-CG 3.34Å; L97-L101 PolarHBondContact O-N 2.85Å
98	K	75.1	Confident	76.8	Confident	95 Å²	95	49.5 Å²	49.5	41%	0.413	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-39.9	175.1	-75.1	168.9	-170.1	164.8	0	112.4	P94 R96 K102	P94-K98 VanDerWaalsContact O-CG 3.25Å; P94-K98 WeakPolarHBondContact O-CG 3.36Å; P94-K98 PolarHBondContact O-N 3.04Å; R96-K98 PolarHBondContact O-N 3.47Å; K98-K102 WeakPolarHBondContact O-CB 3.48Å; K98-K102 VanDerWaalsContact O-CG 3.31Å; K98-K102 WeakPolarHBondContact O-CG 3.47Å; K98-K102 PolarHBondContact O-N 3.49Å; K98-K102 VanDerWaalsContact O-N 3.12Å
99	L	76.2	Confident	76	Confident	82 Å²	82	50.6 Å²	50.6	43%	0.429	26%	0.261	S	S	.	.	H	α-helix	trans	-65.4	-47	176.5	-173.6	65.5	0	0	0	110.8	D95 R96 L101 K102 T103	D95-L99 PolarHBondContact O-N 2.9Å; D95-L99 VanDerWaalsContact O-N 3.13Å; R96-L99 PolarHBondContact O-N 3.38Å; L99-L101 PolarHBondContact O-N 2.9Å; L99-K102 PolarHBondContact O-N 3.41Å; L99-T103 PolarHBondContact O-N 2.83Å; L99-T103 PolarHBondContact O-OG1 2.81Å
100	F	77.2	Confident	75.2	Confident	3 Å²	3	51.6 Å²	51.6	1%	0.013	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-46.4	177.7	-178.5	-94.1	0	0	0	112.7	L10 V36 L38 L48 R96 L97 K102 T103 L104	L10-F100 HydrophobicContact CD1-CB 3.52Å; L10-F100 HydrophobicContact CD1-CD1 3.39Å; L10-F100 HydrophobicContact CD1-CD2 3.56Å; L10-F100 HydrophobicContact CD1-CE1 3.91Å; L10-F100 HydrophobicContact CD1-CE2 4.05Å; L10-F100 HydrophobicContact CD1-CG 3.19Å; L10-F100 HydrophobicContact CD1-CZ 4.21Å; L10-F100 HydrophobicContact CD2-CB 4.4Å; L10-F100 HydrophobicContact CG-CB 3.97Å; L10-F100 HydrophobicContact CG-CD1 4.49Å; L10-F100 HydrophobicContact CG-CD2 3.83Å; L10-F100 HydrophobicContact CG-CE2 4.43Å; L10-F100 HydrophobicContact CG-CG 3.86Å; V36-F100 HydrophobicContact CG1-CZ 4.06Å; L38-F100 HydrophobicContact CB-CE2 4.01Å; L38-F100 HydrophobicContact CB-CZ 4.36Å; L48-F100 HydrophobicContact CD1-CE1 4.32Å; L48-F100 HydrophobicContact CD1-CZ 3.68Å; R96-F100 WeakPolarHBondContact O-CB 3.5Å; R96-F100 PolarHBondContact O-N 3.02Å; L97-F100 PolarHBondContact O-N 3.3Å; F100-K102 VanDerWaalsContact C-N 3.33Å; F100-K102 PolarHBondContact O-N 3.18Å; F100-T103 PolarHBondContact O-N 3.19Å; F100-L104 HydrophobicContact CE1-CD1 3.96Å; F100-L104 HydrophobicContact CZ-CD1 4.41Å; F100-L104 WeakPolarHBondContact O-CB 3.34Å; F100-L104 PolarHBondContact O-N 2.99Å
101	L	77.4	Confident	74.4	Confident	17 Å²	17	53.5 Å²	53.5	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-36.3	178.3	-70.2	171.4	0	0	0	112.5	L66 T68 A71 C76 L97 L99 S105	L66-L101 HydrophobicContact CD2-CD2 4.25Å; T68-L101 HydrophobicContact CG2-CD1 3.85Å; T68-L101 HydrophobicContact CG2-CD2 4.49Å; A71-L101 HydrophobicContact CB-CD1 4.1Å; C76-L101 HydrophobicContact CB-CD1 4.35Å; C76-L101 VanDerWaalsContact SG-CD2 3.55Å; L97-L101 HydrophobicContact CD1-CD1 4.23Å; L97-L101 HydrophobicContact CD1-CG 4.27Å; L97-L101 HydrophobicContact CG-CD1 4.01Å; L97-L101 HydrophobicContact CG-CG 4.47Å; L97-L101 WeakPolarHBondContact O-CB 3.35Å; L97-L101 VanDerWaalsContact O-CG 3.24Å; L97-L101 WeakPolarHBondContact O-CG 3.34Å; L97-L101 PolarHBondContact O-N 2.85Å; L99-L101 PolarHBondContact O-N 2.9Å; L101-S105 WeakPolarHBondContact O-CB 3.31Å; L101-S105 PolarHBondContact O-N 3.45Å
102	K	73.7	Confident	73.5	Confident	139 Å²	139	53.3 Å²	53.3	60%	0.604	26%	0.263	S	S	*	.	H	α-helix	trans	-64.9	-45.8	172.3	-77.9	177.7	179.1	-178.3	0	111.3	K98 L99 F100 L104 S105 I106	K98-K102 WeakPolarHBondContact O-CB 3.48Å; K98-K102 VanDerWaalsContact O-CG 3.31Å; K98-K102 WeakPolarHBondContact O-CG 3.47Å; K98-K102 PolarHBondContact O-N 3.49Å; K98-K102 VanDerWaalsContact O-N 3.12Å; L99-K102 PolarHBondContact O-N 3.41Å; F100-K102 VanDerWaalsContact C-N 3.33Å; F100-K102 PolarHBondContact O-N 3.18Å; K102-L104 PolarHBondContact O-N 3.47Å; K102-S105 PolarHBondContact O-N 3.24Å; K102-I106 WeakPolarHBondContact O-CB 3.47Å; K102-I106 WeakPolarHBondContact O-CD1 3.43Å; K102-I106 WeakPolarHBondContact O-CG1 3.33Å; K102-I106 PolarHBondContact O-N 3.42Å
103	T	73.5	Confident	72.6	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-59.2	-46.6	177	-57.2	0	0	0	0	111.4	L38 L99 F100 K107 I134 L137	L38-T103 HydrophobicContact CD2-CG2 4.33Å; L99-T103 PolarHBondContact O-N 2.83Å; L99-T103 PolarHBondContact O-OG1 2.81Å; F100-T103 PolarHBondContact O-N 3.19Å; T103-K107 WeakPolarHBondContact O-CB 3.49Å; T103-K107 WeakPolarHBondContact O-CG 3.16Å; T103-K107 PolarHBondContact O-N 3.45Å; T103-I134 HydrophobicContact CG2-CG2 4.07Å; T103-L137 HydrophobicContact CG2-CG 4.15Å; T103-L137 WeakPolarHBondContact OG1-CD1 2.95Å
104	L	75.1	Confident	71.5	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-47	179.8	-171.9	159.3	0	0	0	111.6	L38 L61 F64 L66 F100 K102 H108	L38-L104 HydrophobicContact CD1-CD1 3.87Å; L38-L104 HydrophobicContact CD1-CG 4.05Å; L38-L104 HydrophobicContact CD2-CB 4.09Å; L38-L104 HydrophobicContact CD2-CG 4.4Å; L61-L104 HydrophobicContact CD1-CD1 4.15Å; L61-L104 HydrophobicContact CD1-CG 4.38Å; F64-L104 HydrophobicContact CE1-CD2 4.34Å; F64-L104 HydrophobicContact CE2-CD2 3.41Å; F64-L104 VanDerWaalsContact CE2-CD2 3.41Å; F64-L104 HydrophobicContact CZ-CD2 3.31Å; L66-L104 HydrophobicContact CD1-CD2 3.99Å; L66-L104 HydrophobicContact CD2-CD2 4.34Å; F100-L104 HydrophobicContact CE1-CD1 3.96Å; F100-L104 HydrophobicContact CZ-CD1 4.41Å; F100-L104 WeakPolarHBondContact O-CB 3.34Å; F100-L104 PolarHBondContact O-N 2.99Å; K102-L104 PolarHBondContact O-N 3.47Å; L104-H108 VanDerWaalsContact O-CB 3.26Å; L104-H108 WeakPolarHBondContact O-CB 3.45Å; L104-H108 PolarHBondContact O-N 3.25Å
105	S	74	Confident	70.1	Confident	57 Å²	57	62.6 Å²	62.6	40%	0.399	31%	0.312	S	S	.	.	H	α-helix	trans	-64.1	-42.8	179.3	-179.8	0	0	0	0	112.6	L101 K102 Q109	L101-S105 WeakPolarHBondContact O-CB 3.31Å; L101-S105 PolarHBondContact O-N 3.45Å; K102-S105 PolarHBondContact O-N 3.24Å; S105-Q109 WeakPolarHBondContact O-CB 3.35Å; S105-Q109 PolarHBondContact O-N 3.07Å; S105-Q109 VanDerWaalsContact O-N 3.13Å
106	I	70.9	Confident	69.2	Low	35 Å²	35	62.2 Å²	62.2	18%	0.179	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-48.1	179.5	-70.2	168.1	0	0	0	110.6	K102 H108 Q109 V110 L137 V145	K102-I106 WeakPolarHBondContact O-CB 3.47Å; K102-I106 WeakPolarHBondContact O-CD1 3.43Å; K102-I106 WeakPolarHBondContact O-CG1 3.33Å; K102-I106 PolarHBondContact O-N 3.42Å; I106-H108 VanDerWaalsContact C-N 3.33Å; I106-H108 PolarHBondContact O-N 3.45Å; I106-Q109 PolarHBondContact O-N 2.94Å; I106-V110 WeakPolarHBondContact O-CG2 3.44Å; I106-V110 PolarHBondContact O-N 3.44Å; I106-V110 VanDerWaalsContact O-N 3.08Å; I106-L137 HydrophobicContact CB-CD2 4.03Å; I106-L137 HydrophobicContact CD1-CD1 4.26Å; I106-L137 HydrophobicContact CD1-CD2 3.98Å; I106-L137 HydrophobicContact CG2-CD2 3.71Å; I106-V145 HydrophobicContact CG2-CG2 4.04Å
107	K	71.3	Confident	68.3	Low	11 Å²	11	60.4 Å²	60.4	5%	0.048	32%	0.315	C	S	.	.	H	α-helix	trans	-68.5	-32.3	-178.6	-70	-151.6	-176.5	-161.5	0	113	L46 T103 V110 W111 I134 S135	L46-K107 HydrophobicContact CD2-CB 4.32Å; T103-K107 WeakPolarHBondContact O-CB 3.49Å; T103-K107 WeakPolarHBondContact O-CG 3.16Å; T103-K107 PolarHBondContact O-N 3.45Å; K107-V110 PolarHBondContact O-N 2.93Å; K107-W111 WeakPolarHBondContact O-CB 3.29Å; K107-W111 PolarHBondContact O-N 3.4Å; K107-I134 HydrophobicContact CD-CB 4.31Å; K107-I134 HydrophobicContact CD-CD1 3.83Å; K107-I134 HydrophobicContact CD-CG1 3.82Å; K107-I134 HydrophobicContact CD-CG2 3.63Å; K107-S135 WeakPolarHBondContact CE-O 3.39Å; K107-S135 PolarHBondContact NZ-O 2.93Å
108	H	73.3	Confident	67.2	Low	25 Å²	25	64.6 Å²	64.6	12%	0.116	34%	0.34	C	S	.	.	H	α-helix	trans	-65.9	-42	172.8	-177	-109	0	0	0	112.2	L46 F64 L104 I106 V110 W111 Q112	L46-H108 VanDerWaalsContact CD1-CA 3.49Å; L46-H108 HydrophobicContact CD1-CB 4Å; F64-H108 HydrophobicContact CE1-CB 4.3Å; F64-H108 AromaticContact CE1-CD2 3.36Å; F64-H108 WeakPolarHBondContact CE1-CD2 3.4Å; F64-H108 AromaticContact CE1-CE1 3.87Å; F64-H108 AromaticContact CE1-CG 3.65Å; F64-H108 AromaticContact CE1-ND1 3.99Å; F64-H108 AromaticContact CE1-NE2 3.51Å; F64-H108 HydrophobicContact CZ-CB 4.08Å; F64-H108 AromaticContact CZ-CD2 3.97Å; F64-H108 AromaticContact CZ-CG 3.75Å; F64-H108 AromaticContact CZ-ND1 3.97Å; L104-H108 VanDerWaalsContact O-CB 3.26Å; L104-H108 WeakPolarHBondContact O-CB 3.45Å; L104-H108 PolarHBondContact O-N 3.25Å; I106-H108 VanDerWaalsContact C-N 3.33Å; I106-H108 PolarHBondContact O-N 3.45Å; H108-V110 VanDerWaalsContact C-N 3.31Å; H108-V110 PolarHBondContact O-N 3.43Å; H108-W111 PolarHBondContact O-N 2.97Å; H108-Q112 PolarHBondContact CE1-NE2 2.92Å; H108-Q112 PolarHBondContact O-N 3.26Å
109	Q	68.8	Low	66.1	Low	64 Å²	64	65.3 Å²	65.3	30%	0.299	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-35.6	177.7	-164	168	16.8	0	0	112.2	S105 I106	S105-Q109 WeakPolarHBondContact O-CB 3.35Å; S105-Q109 PolarHBondContact O-N 3.07Å; S105-Q109 VanDerWaalsContact O-N 3.13Å; I106-Q109 PolarHBondContact O-N 2.94Å
110	V	68.7	Low	64.9	Low	24 Å²	24	70.9 Å²	70.9	15%	0.145	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-42.7	172.3	174.5	0	0	0	0	111.4	I106 K107 H108 S113 G114 V145	I106-V110 WeakPolarHBondContact O-CG2 3.44Å; I106-V110 PolarHBondContact O-N 3.44Å; I106-V110 VanDerWaalsContact O-N 3.08Å; K107-V110 PolarHBondContact O-N 2.93Å; H108-V110 VanDerWaalsContact C-N 3.31Å; H108-V110 PolarHBondContact O-N 3.43Å; V110-S113 PolarHBondContact O-N 3.44Å; V110-S113 PolarHBondContact O-OG 2.95Å; V110-G114 PolarHBondContact O-N 3.24Å; V110-V145 HydrophobicContact CG2-CG2 3.68Å
111	W	64.6	Low	63.8	Low	78 Å²	78	75.5 Å²	75.5	30%	0.295	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-44.4	179.1	176.3	80.4	0	0	0	112.6	L46 K62 K107 H108 S113 G114	L46-W111 HydrophobicContact CD1-CB 4.01Å; L46-W111 HydrophobicContact CD1-CG 4.38Å; K62-W111 HydrophobicContact CG-CH2 4.23Å; K107-W111 WeakPolarHBondContact O-CB 3.29Å; K107-W111 PolarHBondContact O-N 3.4Å; H108-W111 PolarHBondContact O-N 2.97Å; W111-S113 PolarHBondContact O-N 3.27Å; W111-S113 VanDerWaalsContact O-N 3.12Å; W111-G114 PolarHBondContact O-N 3.49Å
112	Q	64.2	Low	62.8	Low	125 Å²	125	78.5 Å²	78.5	58%	0.584	40%	0.398	S	S	*	.	H	α-helix	trans	-61	-22.2	176.5	-72.8	-171.3	-25.5	0	0	113.8	H108	H108-Q112 PolarHBondContact CE1-NE2 2.92Å; H108-Q112 PolarHBondContact O-N 3.26Å
113	S	58.5	Low	61.9	Low	66 Å²	66	79.2 Å²	79.2	46%	0.462	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-10.2	178.3	73	0	0	0	0	114.3	V110 W111	V110-S113 PolarHBondContact O-N 3.44Å; V110-S113 PolarHBondContact O-OG 2.95Å; W111-S113 PolarHBondContact O-N 3.27Å; W111-S113 VanDerWaalsContact O-N 3.12Å
114	G	57	Low	60.8	Low	43 Å²	43	87.1 Å²	87.1	44%	0.443	44%	0.442	S	S	.	.	S	Bend	trans	-84.1	147.6	176.1	0	0	0	0	0	111.7	V110 W111	V110-G114 PolarHBondContact O-N 3.24Å; W111-G114 PolarHBondContact O-N 3.49Å
115	K	45.3	Very low	59.8	Low	209 Å²	209	89.9 Å²	89.9	91%	0.909	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-66.1	127.8	170	-71.8	-176.1	178.3	-178	0	108.7
116	P	55.1	Low	58.2	Low	118 Å²	118	90.7 Å²	90.7	77%	0.766	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-62.9	141.6	171.8	25.6	-31.4	0	0	0	109.5	T118	P116-T118 PolarHBondContact O-N 3.45Å
117	L	56.3	Low	56.8	Low	73 Å²	73	94.7 Å²	94.7	38%	0.382	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-57.7	133.9	175.3	-74.1	160	0	0	0	109.9	E121 K122	L117-E121 HydrophobicContact CD2-CB 4.31Å; L117-K122 HydrophobicContact CB-CG 4.35Å; L117-K122 VanDerWaalsContact O-CE 3.23Å; L117-K122 WeakPolarHBondContact O-CE 3.36Å
118	T	54.4	Low	55.6	Low	88 Å²	88	99.3 Å²	99.3	54%	0.54	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-70.2	149.4	-179.4	-13.6	0	0	0	0	110.2	P116 R120 E121 K122	P116-T118 PolarHBondContact O-N 3.45Å; T118-R120 PolarHBondContact O-N 2.93Å; T118-R120 VanDerWaalsContact O-N 3.07Å; T118-E121 WeakPolarHBondContact CB-OE2 3.45Å; T118-E121 PolarHBondContact N-OE2 3.3Å; T118-E121 WeakPolarHBondContact O-CA 3.36Å; T118-E121 WeakPolarHBondContact O-CB 3.22Å; T118-E121 PolarHBondContact O-N 3.26Å; T118-E121 PolarHBondContact OG1-OE2 3.41Å; T118-K122 PolarHBondContact O-N 2.96Å; T118-K122 VanDerWaalsContact O-N 3.11Å
119	D	52.2	Low	54.5	Low	110 Å²	110	108.8 Å²	108.8	59%	0.588	57%	0.569	S	S	*	*	H	α-helix	trans	-60.4	-27.2	-175.4	-65.4	-29.3	0	0	0	113.2	E121 K122 L123	D119-E121 VanDerWaalsContact C-N 3.33Å; D119-E121 PolarHBondContact O-N 3.46Å; D119-K122 PolarHBondContact O-N 3.5Å; D119-K122 IonicContact OD1-NZ 2.74Å; D119-K122 PolarHBondContact OD1-NZ 3.07Å; D119-L123 WeakPolarHBondContact O-CG 3.37Å; D119-L123 PolarHBondContact O-N 3.49Å; D119-L123 VanDerWaalsContact O-N 3.16Å
120	R	50.9	Low	53.6	Low	198 Å²	198	109.5 Å²	109.5	75%	0.747	58%	0.581	S	S	*	*	H	α-helix	trans	-67.5	-28.3	171.8	-167.7	174.7	-178.2	161.6	0.2	113.8	T118	T118-R120 PolarHBondContact O-N 2.93Å; T118-R120 VanDerWaalsContact O-N 3.07Å
121	E	55.4	Low	52.8	Low	100 Å²	100	110.7 Å²	110.7	47%	0.467	58%	0.584	S	S	.	*	H	α-helix	trans	-83.3	-34.2	176.6	-63.8	170	140.2	0	0	111	L117 T118 D119 L123 K124 A125	L117-E121 HydrophobicContact CD2-CB 4.31Å; T118-E121 WeakPolarHBondContact CB-OE2 3.45Å; T118-E121 PolarHBondContact N-OE2 3.3Å; T118-E121 WeakPolarHBondContact O-CA 3.36Å; T118-E121 WeakPolarHBondContact O-CB 3.22Å; T118-E121 PolarHBondContact O-N 3.26Å; T118-E121 PolarHBondContact OG1-OE2 3.41Å; D119-E121 VanDerWaalsContact C-N 3.33Å; D119-E121 PolarHBondContact O-N 3.46Å; E121-L123 VanDerWaalsContact C-N 3.33Å; E121-L123 PolarHBondContact O-N 3.24Å; E121-K124 PolarHBondContact O-N 2.95Å; E121-A125 PolarHBondContact O-N 3.37Å
122	K	56.5	Low	52.5	Low	80 Å²	80	113.4 Å²	113.4	35%	0.348	60%	0.6	S	S	.	*	H	α-helix	trans	-63.7	-36.6	172.8	-63.8	179.9	-168.2	149	0	112.5	F43 L117 T118 D119 K124	F43-K122 HydrophobicContact CD1-CB 4.33Å; F43-K122 HydrophobicContact CD1-CD 4.47Å; F43-K122 HydrophobicContact CD1-CG 3.96Å; F43-K122 HydrophobicContact CE1-CB 3.99Å; F43-K122 HydrophobicContact CE1-CG 4.13Å; L117-K122 HydrophobicContact CB-CG 4.35Å; L117-K122 VanDerWaalsContact O-CE 3.23Å; L117-K122 WeakPolarHBondContact O-CE 3.36Å; T118-K122 PolarHBondContact O-N 2.96Å; T118-K122 VanDerWaalsContact O-N 3.11Å; D119-K122 PolarHBondContact O-N 3.5Å; D119-K122 IonicContact OD1-NZ 2.74Å; D119-K122 PolarHBondContact OD1-NZ 3.07Å; K122-K124 VanDerWaalsContact C-N 3.34Å
123	L	53	Low	52.2	Low	155 Å²	155	110.3 Å²	110.3	81%	0.812	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-21.5	177.6	-75.2	165	0	0	0	113.7	D119 E121	D119-L123 WeakPolarHBondContact O-CG 3.37Å; D119-L123 PolarHBondContact O-N 3.49Å; D119-L123 VanDerWaalsContact O-N 3.16Å; E121-L123 VanDerWaalsContact C-N 3.33Å; E121-L123 PolarHBondContact O-N 3.24Å
124	K	51.3	Low	52.3	Low	169 Å²	169	107.5 Å²	107.5	74%	0.735	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-13.1	178.1	-80.1	-174.5	172.7	-170.5	0	113.9	E121 K122 G126	E121-K124 PolarHBondContact O-N 2.95Å; K122-K124 VanDerWaalsContact C-N 3.34Å; K124-G126 PolarHBondContact O-N 2.86Å
125	A	53.3	Low	52	Low	60 Å²	60	108.3 Å²	108.3	50%	0.496	58%	0.575	S	S	.	*			trans	-77.2	86.8	177.3	0	0	0	0	0	109.8	E121 L127	E121-A125 PolarHBondContact O-N 3.37Å; A125-L127 PolarHBondContact O-N 2.91Å
126	G	41.8	Very low	52.5	Low	73 Å²	73	101.8 Å²	101.8	75%	0.753	55%	0.554	S	S	*	*			trans	-60.9	126.8	166.9	0	0	0	0	0	110.5	K124	K124-G126 PolarHBondContact O-N 2.86Å
127	L	41.4	Very low	52.3	Low	119 Å²	119	98.5 Å²	98.5	62%	0.623	53%	0.529	S	S	*	.			trans	-51.4	146.2	-178.7	-84.7	125.2	0	0	0	113.6	A125 R129	A125-L127 PolarHBondContact O-N 2.91Å; L127-R129 HydrophobicContact CD2-CB 4.35Å; L127-R129 HydrophobicContact CD2-CG 3.31Å
128	P	44.8	Very low	52.1	Low	108 Å²	108	100.2 Å²	100.2	70%	0.701	54%	0.535	S	S	*	.				-124.1	150	72.5	29.8	-16.3	0	0	0	116	S130	P128-S130 PolarHBondContact O-N 3.03Å
129	R	51.3	Low	52	Low	224 Å²	224	103.2 Å²	103.2	85%	0.845	54%	0.543	S	S	*	.			trans	-60.6	81.8	178.3	-63.1	-177.8	174.6	162.6	-2.5	112.6	L127	L127-R129 HydrophobicContact CD2-CB 4.35Å; L127-R129 HydrophobicContact CD2-CG 3.31Å
130	S	50.7	Low	52	Low	80 Å²	80	105.2 Å²	105.2	56%	0.559	55%	0.547	S	S	*	.			trans	-108.2	117.8	175.5	54	0	0	0	0	110.9	P128	P128-S130 PolarHBondContact O-N 3.03Å
131	F	51.9	Low	52	Low	48 Å²	48	97.4 Å²	97.4	21%	0.211	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-80.2	120.2	163.5	165.4	-91.1	0	0	0	107.5	I37 I47 R49	I37-F131 HydrophobicContact CB-CZ 4.2Å; I37-F131 HydrophobicContact CG2-CE1 3.92Å; I37-F131 HydrophobicContact CG2-CZ 3.81Å; I47-F131 HydrophobicContact CB-CE2 4.42Å; I47-F131 HydrophobicContact CG2-CE2 4.23Å; R49-F131 HydrophobicContact CB-CE2 3.85Å; R49-F131 HydrophobicContact CB-CZ 3.88Å; R49-F131 VanDerWaalsContact CZ-CB 3.43Å; R49-F131 VanDerWaalsContact NH1-CD1 3.29Å; R49-F131 VanDerWaalsContact NH2-CB 3.26Å
132	E	58.2	Low	52.2	Low	135 Å²	135	96.2 Å²	96.2	63%	0.631	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	120.6	178.1	-158.9	-178.9	179.1	0	0	109.2	G39 R40	G39-E132 CarbonylContact C-O 3.59Å; G39-E132 WeakPolarHBondContact CA-O 3.39Å; R40-E132 PolarHBondContact N-O 3.33Å; R40-E132 PolarHBondContact O-N 2.9Å
133	A	57.8	Low	52.1	Low	60 Å²	60	97.5 Å²	97.5	50%	0.496	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	137.7	174.6	0	0	0	0	0	109.6	I37 S135	I37-A133 HydrophobicContact CG2-CB 4.34Å; A133-S135 PolarHBondContact O-N 3.5Å
134	I	60.6	Low	52.3	Low	7 Å²	7	95.9 Å²	95.9	4%	0.036	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-69.1	123	-175	-101.8	157.1	0	0	0	110.5	A8 L38 R40 L46 T103 K107	A8-I134 HydrophobicContact CB-CG2 4.11Å; A8-I134 WeakPolarHBondContact CB-O 3.3Å; L38-I134 HydrophobicContact CB-CD1 4.46Å; L38-I134 HydrophobicContact CD2-CD1 3.81Å; L38-I134 HydrophobicContact CD2-CG2 4.28Å; L38-I134 HydrophobicContact CG-CD1 3.75Å; L38-I134 WeakPolarHBondContact O-CB 3.3Å; L38-I134 PolarHBondContact O-N 3.24Å; L38-I134 VanDerWaalsContact O-N 3.08Å; R40-I134 HydrophobicContact CG-CD1 4.18Å; R40-I134 HydrophobicContact CG-CG1 4.23Å; L46-I134 HydrophobicContact CD2-CD1 3.29Å; T103-I134 HydrophobicContact CG2-CG2 4.07Å; K107-I134 HydrophobicContact CD-CB 4.31Å; K107-I134 HydrophobicContact CD-CD1 3.83Å; K107-I134 HydrophobicContact CD-CG1 3.82Å; K107-I134 HydrophobicContact CD-CG2 3.63Å
135	S	49.2	Very low	52.5	Low	61 Å²	61	88.1 Å²	88.1	43%	0.427	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-58.5	146.8	175.6	-36.6	0	0	0	0	111.3	K107 A133	K107-S135 WeakPolarHBondContact CE-O 3.39Å; K107-S135 PolarHBondContact NZ-O 2.93Å; A133-S135 PolarHBondContact O-N 3.5Å
136	P	55.9	Low	52.7	Low	72 Å²	72	89.7 Å²	89.7	47%	0.468	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-50.2	147.6	177.2	-26	33.1	0	0	0	112.3	Q138	P136-Q138 WeakPolarHBondContact O-CG 3.33Å; P136-Q138 PolarHBondContact O-N 3.39Å
137	L	50.9	Low	53.4	Low	48 Å²	48	91.2 Å²	91.2	25%	0.251	46%	0.464	S	S	.	.			trans	-49	111.4	-179.4	-81	164.6	0	0	0	111.3	T103 I106	T103-L137 HydrophobicContact CG2-CG 4.15Å; T103-L137 WeakPolarHBondContact OG1-CD1 2.95Å; I106-L137 HydrophobicContact CB-CD2 4.03Å; I106-L137 HydrophobicContact CD1-CD1 4.26Å; I106-L137 HydrophobicContact CD1-CD2 3.98Å; I106-L137 HydrophobicContact CG2-CD2 3.71Å
138	Q	53.6	Low	54	Low	109 Å²	109	88.4 Å²	88.4	51%	0.509	45%	0.449	S	S	.	.			trans	-90	153.3	177.7	-65.3	-172.6	-15.1	0	0	110.6	P136 K140 D141 I142	P136-Q138 WeakPolarHBondContact O-CG 3.33Å; P136-Q138 PolarHBondContact O-N 3.39Å; Q138-K140 PolarHBondContact O-N 2.94Å; Q138-K140 VanDerWaalsContact O-N 3.13Å; Q138-D141 PolarHBondContact N-OD2 3.48Å; Q138-D141 WeakPolarHBondContact O-CB 3.35Å; Q138-D141 PolarHBondContact O-N 2.99Å; Q138-I142 PolarHBondContact O-N 2.83Å
139	Q	51.4	Low	54.3	Low	152 Å²	152	90.7 Å²	90.7	71%	0.71	44%	0.444	S	S	*	.	H	α-helix	trans	-60.6	-27.1	-178.8	-161.6	159.1	1.7	0	0	112.8	I142 Q143	Q139-I142 PolarHBondContact O-N 3.49Å; Q139-Q143 VanDerWaalsContact O-CG 3.28Å; Q139-Q143 WeakPolarHBondContact O-CG 3.42Å; Q139-Q143 PolarHBondContact O-N 3.07Å; Q139-Q143 VanDerWaalsContact O-N 3.08Å
140	K	52.2	Low	54.1	Low	152 Å²	152	84.4 Å²	84.4	66%	0.661	43%	0.434	S	S	*	.	H	α-helix	trans	-65.3	-35.6	174	-63.4	-178.2	179.5	179.8	0	112.9	Q138 Q143 K144	Q138-K140 PolarHBondContact O-N 2.94Å; Q138-K140 VanDerWaalsContact O-N 3.13Å; K140-Q143 PolarHBondContact O-N 3.13Å; K140-K144 PolarHBondContact O-N 3.38Å
141	D	51.1	Low	54	Low	33 Å²	33	90.1 Å²	90.1	18%	0.176	44%	0.444	C	S	.	.	H	α-helix	trans	-69.6	-39.5	178.5	-62.9	-35.7	0	0	0	111.1	Q138 K144 V145	Q138-D141 PolarHBondContact N-OD2 3.48Å; Q138-D141 WeakPolarHBondContact O-CB 3.35Å; Q138-D141 PolarHBondContact O-N 2.99Å; D141-K144 PolarHBondContact O-N 3.34Å; D141-V145 WeakPolarHBondContact O-CG2 3.49Å; D141-V145 PolarHBondContact O-N 2.89Å; D141-V145 VanDerWaalsContact O-N 3.13Å
142	I	60.2	Low	53.3	Low	76 Å²	76	92.7 Å²	92.7	39%	0.39	46%	0.463	S	S	.	.	H	α-helix	trans	-69	-38.7	178.1	-58.8	172	0	0	0	110.6	Q138 Q139 V145 N146	Q138-I142 PolarHBondContact O-N 2.83Å; Q139-I142 PolarHBondContact O-N 3.49Å; I142-V145 PolarHBondContact O-N 3.42Å; I142-N146 WeakPolarHBondContact O-CB 3.44Å; I142-N146 PolarHBondContact O-N 3.3Å; I142-N146 PolarHBondContact O-ND2 3.01Å
143	Q	54.6	Low	52	Low	107 Å²	107	90.3 Å²	90.3	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-64.3	-46.3	175.4	-75.1	169.9	-6.5	0	0	111.7	Q139 K140 V145 N146 E147	Q139-Q143 VanDerWaalsContact O-CG 3.28Å; Q139-Q143 WeakPolarHBondContact O-CG 3.42Å; Q139-Q143 PolarHBondContact O-N 3.07Å; Q139-Q143 VanDerWaalsContact O-N 3.08Å; K140-Q143 PolarHBondContact O-N 3.13Å; Q143-V145 VanDerWaalsContact C-N 3.34Å; Q143-V145 PolarHBondContact O-N 3.27Å; Q143-N146 PolarHBondContact O-N 3.22Å; Q143-E147 PolarHBondContact O-N 2.92Å
144	K	56.5	Low	51	Low	121 Å²	121	93.9 Å²	93.9	53%	0.526	48%	0.484	S	S	.	.	H	α-helix	trans	-58.2	-41.5	174.8	-98.3	-177.5	174.4	179.8	0	112.9	K140 D141 E147 L148	K140-K144 PolarHBondContact O-N 3.38Å; D141-K144 PolarHBondContact O-N 3.34Å; K144-E147 PolarHBondContact O-N 2.81Å; K144-L148 WeakPolarHBondContact O-CB 3.31Å; K144-L148 VanDerWaalsContact O-CG 3.3Å; K144-L148 WeakPolarHBondContact O-CG 3.48Å; K144-L148 PolarHBondContact O-N 3.45Å
145	V	55.6	Low	49.3	Very low	6 Å²	6	98.4 Å²	98.4	4%	0.036	52%	0.517	C	S	.	.	H	α-helix	trans	-68	-38.5	176.8	171.1	0	0	0	0	112.1	I106 V110 D141 I142 Q143 E147 L148 R149	I106-V145 HydrophobicContact CG2-CG2 4.04Å; V110-V145 HydrophobicContact CG2-CG2 3.68Å; D141-V145 WeakPolarHBondContact O-CG2 3.49Å; D141-V145 PolarHBondContact O-N 2.89Å; D141-V145 VanDerWaalsContact O-N 3.13Å; I142-V145 PolarHBondContact O-N 3.42Å; Q143-V145 VanDerWaalsContact C-N 3.34Å; Q143-V145 PolarHBondContact O-N 3.27Å; V145-E147 VanDerWaalsContact C-N 3.35Å; V145-L148 PolarHBondContact O-N 3.46Å; V145-R149 WeakPolarHBondContact O-CB 3.37Å; V145-R149 WeakPolarHBondContact O-CG 3.42Å; V145-R149 PolarHBondContact O-N 2.82Å
146	N	56.3	Low	48.3	Very low	92 Å²	92	99 Å²	99	49%	0.492	53%	0.533	S	S	.	.	H	α-helix	trans	-67.3	-36.8	175.7	-74.1	-19.1	0	0	0	111.8	I142 Q143 R149 S150	I142-N146 WeakPolarHBondContact O-CB 3.44Å; I142-N146 PolarHBondContact O-N 3.3Å; I142-N146 PolarHBondContact O-ND2 3.01Å; Q143-N146 PolarHBondContact O-N 3.22Å; N146-R149 PolarHBondContact O-N 3.42Å; N146-S150 WeakPolarHBondContact O-CB 3.29Å; N146-S150 PolarHBondContact O-N 3.27Å; N146-S150 PolarHBondContact O-OG 3.06Å
147	E	57.4	Low	46.9	Very low	106 Å²	106	104.2 Å²	104.2	50%	0.495	56%	0.556	S	S	.	*	H	α-helix	trans	-63.5	-45.8	171.3	-77.7	-177.4	168.2	0	0	111.7	Q143 K144 V145 R149 S150 R151	Q143-E147 PolarHBondContact O-N 2.92Å; K144-E147 PolarHBondContact O-N 2.81Å; V145-E147 VanDerWaalsContact C-N 3.35Å; E147-R149 VanDerWaalsContact C-N 3.32Å; E147-R149 PolarHBondContact O-N 2.6Å; E147-S150 WeakPolarHBondContact CA-OG 3.44Å; E147-S150 PolarHBondContact O-N 2.9Å; E147-S150 VanDerWaalsContact O-N 3.07Å; E147-S150 PolarHBondContact O-OG 2.67Å; E147-R151 WeakPolarHBondContact O-CG 3.49Å; E147-R151 PolarHBondContact O-N 2.92Å
148	L	54.5	Low	45.8	Very low	60 Å²	60	106.7 Å²	106.7	31%	0.314	57%	0.573	S	S	.	*	H	α-helix	trans	-61.6	-37.9	176.4	-74.8	163.2	0	0	0	112.4	K144 V145 S150 R151	K144-L148 WeakPolarHBondContact O-CB 3.31Å; K144-L148 VanDerWaalsContact O-CG 3.3Å; K144-L148 WeakPolarHBondContact O-CG 3.48Å; K144-L148 PolarHBondContact O-N 3.45Å; V145-L148 PolarHBondContact O-N 3.46Å; L148-S150 VanDerWaalsContact C-N 3.32Å; L148-R151 PolarHBondContact O-N 3.38Å
149	R	50.2	Low	44.4	Very low	155 Å²	155	109.2 Å²	109.2	59%	0.585	59%	0.59	S	S	*	*	H	α-helix	trans	-69.7	-27.7	173.8	-74	177.9	-176.8	-166.3	-1.1	113.2	V145 N146 E147	V145-R149 WeakPolarHBondContact O-CB 3.37Å; V145-R149 WeakPolarHBondContact O-CG 3.42Å; V145-R149 PolarHBondContact O-N 2.82Å; N146-R149 PolarHBondContact O-N 3.42Å; E147-R149 VanDerWaalsContact C-N 3.32Å; E147-R149 PolarHBondContact O-N 2.6Å
150	S	47.5	Very low	43.2	Very low	93 Å²	93	111.9 Å²	111.9	65%	0.65	59%	0.593	S	S	*	*	H	α-helix	trans	-80.9	-22.2	177.1	71	0	0	0	0	113.7	N146 E147 L148	N146-S150 WeakPolarHBondContact O-CB 3.29Å; N146-S150 PolarHBondContact O-N 3.27Å; N146-S150 PolarHBondContact O-OG 3.06Å; E147-S150 WeakPolarHBondContact CA-OG 3.44Å; E147-S150 PolarHBondContact O-N 2.9Å; E147-S150 VanDerWaalsContact O-N 3.07Å; E147-S150 PolarHBondContact O-OG 2.67Å; L148-S150 VanDerWaalsContact C-N 3.32Å
151	R	47.8	Very low	42	Very low	200 Å²	200	111.9 Å²	111.9	76%	0.755	60%	0.599	S	S	*	*	S	Bend	trans	-84.7	-6.4	178.7	-71.3	-177.1	-174.5	-168.9	3	114.1	E147 L148	E147-R151 WeakPolarHBondContact O-CG 3.49Å; E147-R151 PolarHBondContact O-N 2.92Å; L148-R151 PolarHBondContact O-N 3.38Å
152	V	38.9	Very low	40.8	Very low	102 Å²	102	117 Å²	117	62%	0.618	63%	0.627	S	S	*	*			trans	-118	99.1	177.6	-174.7	0	0	0	0	109.2
153	A	30.3	Very low	39.1	Very low	85 Å²	85	123 Å²	123	70%	0.702	65%	0.65	S	S	*	*			trans	-81.6	157.9	160.9	0	0	0	0	0	109.3	S155	A153-S155 PolarHBondContact O-N 3.44Å; A153-S155 VanDerWaalsContact O-N 3.11Å
154	P	36.2	Very low	37.7	Very low	134 Å²	134	121 Å²	121	87%	0.87	66%	0.658	S	S	*	*			trans	-80.4	102.4	-143.2	31.9	-34	0	0	0	112.9
155	S	25.3	Very low	36.3	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	68%	0.675	S	S	*	*			trans	-93.7	118.7	151	60.1	0	0	0	0	107.9	A153 L157	A153-S155 PolarHBondContact O-N 3.44Å; A153-S155 VanDerWaalsContact O-N 3.11Å; S155-L157 PolarHBondContact O-N 3.15Å
156	G	28.1	Very low	34.8	Very low	74 Å²	74	126.4 Å²	126.4	76%	0.763	72%	0.715	S	S	*	*			trans	-53.2	131.5	-168.1	0	0	0	0	0	115.1
157	L	26.4	Very low	33.2	Very low	180 Å²	180	127.2 Å²	127.2	94%	0.942	73%	0.734	S	S	*	*			trans	-94.1	107.1	148.4	-89.7	159.7	0	0	0	106.9	S155 D159	S155-L157 PolarHBondContact O-N 3.15Å; L157-D159 PolarHBondContact O-N 2.88Å
158	T	26.9	Very low	31.6	Very low	101 Å²	101	125.4 Å²	125.4	62%	0.62	74%	0.744	S	S	*	*			trans	-61.5	119.8	177.9	49.9	0	0	0	0	111.3	R160	T158-R160 PolarHBondContact O-N 2.96Å
159	D	26	Very low	30	Very low	161 Å²	161	129.8 Å²	129.8	86%	0.861	77%	0.774	S	S	*	*			trans	-67.7	80.2	148.7	-93.8	-29.9	0	0	0	107.8	L157 I161	L157-D159 PolarHBondContact O-N 2.88Å; D159-I161 VanDerWaalsContact C-N 3.28Å; D159-I161 PolarHBondContact O-N 3Å; D159-I161 VanDerWaalsContact O-N 3.16Å
160	R	25.1	Very low	28.7	Very low	208 Å²	208	125.9 Å²	125.9	79%	0.785	78%	0.781	S	S	*	*			trans	-79.5	85	161.5	-82.5	-176.7	-178.8	-176.7	0.8	107.8	T158 N162	T158-R160 PolarHBondContact O-N 2.96Å; R160-N162 PolarHBondContact O-N 2.89Å
161	I	27.3	Very low	27.5	Very low	152 Å²	152	130 Å²	130	78%	0.779	79%	0.79	S	S	*	*			trans	-72.3	100.1	154.1	-63.8	175.1	0	0	0	105.6	D159 K163	D159-I161 VanDerWaalsContact C-N 3.28Å; D159-I161 PolarHBondContact O-N 3Å; D159-I161 VanDerWaalsContact O-N 3.16Å; I161-K163 PolarHBondContact O-N 3.1Å; I161-K163 VanDerWaalsContact O-N 3.1Å
162	N	25.1	Very low	26.2	Very low	142 Å²	142	128.6 Å²	128.6	76%	0.759	79%	0.792	S	S	*	*			trans	-60.7	111.2	170.2	-95.8	-9.4	0	0	0	109.2	R160	R160-N162 PolarHBondContact O-N 2.89Å
163	K	25.3	Very low	25.5	Very low	200 Å²	200	129.3 Å²	129.3	87%	0.87	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.9	130.1	141.9	-73.6	178.6	173.9	-180	0	107.4	I161	I161-K163 PolarHBondContact O-N 3.1Å; I161-K163 VanDerWaalsContact O-N 3.1Å
164	G	25.7	Very low	25	Very low	66 Å²	66	133.6 Å²	133.6	68%	0.68	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68	160.7	171.3	0	0	0	0	0	111.9
165	P	25.8	Very low	24.3	Very low	134 Å²	134	137.5 Å²	137.5	87%	0.87	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-77.8	150.1	-177.5	32.8	-31.8	0	0	0	111.4
166	A	25	Very low	24.1	Very low	106 Å²	106	137.8 Å²	137.8	88%	0.876	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80.8	136.6	176.9	0	0	0	0	0	111.8
167	A	23.3	Very low	23.7	Very low	109 Å²	109	145.8 Å²	145.8	90%	0.901	81%	0.806	S	S	*	*			trans	-170.1	137.2	144.7	0	0	0	0	0	109.9
168	G	22.1	Very low	23.5	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	79%	0.794	S	S	*	*			trans	119.2	83.2	156.8	0	0	0	0	0	117.7
169	T	22.1	Very low	23.2	Very low	153 Å²	153	144.3 Å²	144.3	94%	0.939	80%	0.803	S	S	*	*			trans	36	127	131.3	54.4	0	0	0	0	121.3
170	G	21.8	Very low	22.9	Very low	72 Å²	72	140.8 Å²	140.8	74%	0.742	80%	0.796	S	S	*	*			trans	147	102.7	146.5	0	0	0	0	0	116.7
171	Q	22.2	Very low	22.7	Very low	180 Å²	180	136.1 Å²	136.1	84%	0.841	80%	0.795	S	S	*	*			trans	26.1	119.9	142.7	-72.4	170.6	-18	0	0	120.2
172	Q	22.3	Very low	22.5	Very low	171 Å²	171	133.9 Å²	133.9	80%	0.799	79%	0.794	S	S	*	*				101.4	141.3	74.1	-145.5	-173.1	44.7	0	0	111.9
173	V	22.4	Very low	22.5	Very low	117 Å²	117	132.9 Å²	132.9	71%	0.709	80%	0.797	S	S	*	*			trans	96.2	101.6	153.8	-165.6	0	0	0	0	120.8
174	K	21.1	Very low	22.4	Very low	174 Å²	174	128.7 Å²	128.7	76%	0.757	79%	0.791	S	S	*	*				44.7	138.6	124	-96.5	174.9	178.4	170.9	0	124.3
175	R	20.7	Very low	22.4	Very low	217 Å²	217	132.5 Å²	132.5	82%	0.819	80%	0.801	S	S	*	*			trans	76.7	149.9	146.5	-71.8	177.8	172.7	175.2	-3.5	116.9
176	S	20.7	Very low	22.4	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	80%	0.8	S	S	*	*			cis	-168.6	172.5	-3.8	37.1	0	0	0	0	109.5
177	R	21.1	Very low	22.4	Very low	241 Å²	241	133.8 Å²	133.8	91%	0.909	79%	0.792	S	S	*	*			trans	-39.1	164.2	175.7	-57.7	170.6	170.2	163.7	-5	115.8
178	S	21.2	Very low	22.5	Very low	99 Å²	99	136 Å²	136	69%	0.692	79%	0.789	S	S	*	*			cis	-173.2	163.7	39.9	44.3	0	0	0	0	113.1
179	D	20.7	Very low	22.8	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	79%	0.793	S	S	*	*			trans	74.7	119.7	146.4	-62.3	-24.5	0	0	0	126.1
180	A	20.2	Very low	23.2	Very low	88 Å²	88	136.6 Å²	136.6	73%	0.727	79%	0.786	S	S	*	*			trans	64.8	113.2	132.1	0	0	0	0	0	120.9
181	S	21.1	Very low	23.6	Very low	109 Å²	109	142.8 Å²	142.8	76%	0.762	79%	0.792	S	S	*	*				153.3	129.8	98.4	56.2	0	0	0	0	113.2
182	S	23.3	Very low	23.9	Very low	106 Å²	106	145.5 Å²	145.5	74%	0.741	80%	0.795	S	S	*	*			trans	40.7	114.5	150.1	59.3	0	0	0	0	121.1
183	S	23.8	Very low	24.1	Very low	120 Å²	120	142 Å²	142	84%	0.839	80%	0.795	S	S	*	*			trans	178.7	158.8	130.6	-90.6	0	0	0	0	114.3
184	P	25.2	Very low	24.5	Very low	112 Å²	112	143.9 Å²	143.9	73%	0.727	80%	0.799	S	S	*	*			trans	-90.8	148.8	-146.5	34.7	-33.7	0	0	0	114.5	K186	P184-K186 PolarHBondContact O-N 3.44Å; P184-K186 VanDerWaalsContact O-N 3.09Å
185	V	24.3	Very low	24.9	Very low	147 Å²	147	142.6 Å²	142.6	89%	0.891	80%	0.8	S	S	*	*			trans	-65.6	105.7	172.4	178.3	0	0	0	0	109.5	G187	V185-G187 PolarHBondContact O-N 3.3Å
186	K	26.2	Very low	25.3	Very low	197 Å²	197	137.5 Å²	137.5	86%	0.857	80%	0.797	S	S	*	*			trans	-64.3	113.5	169.2	-78.9	178.2	176.7	174.3	0	109.5	P184	P184-K186 PolarHBondContact O-N 3.44Å; P184-K186 VanDerWaalsContact O-N 3.09Å
187	G	24.2	Very low	26	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	78%	0.783	S	S	*	*			trans	-61.6	132	169.2	0	0	0	0	0	111.3	V185	V185-G187 PolarHBondContact O-N 3.3Å
188	N	26.8	Very low	26.7	Very low	157 Å²	157	129.2 Å²	129.2	84%	0.84	77%	0.767	S	S	*	*			trans	-60.6	132.7	170.4	-85	-26.4	0	0	0	110.3	S190	N188-S190 PolarHBondContact O-N 2.85Å; N188-S190 VanDerWaalsContact O-N 3.16Å
189	P	28.4	Very low	27.8	Very low	119 Å²	119	132.7 Å²	132.7	77%	0.773	78%	0.776	S	S	*	*			trans	-68.3	114.8	168.8	26.5	-29.1	0	0	0	108.6	K191	P189-K191 PolarHBondContact O-N 2.97Å
190	S	30.6	Very low	29.6	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	77%	0.772	S	S	*	*			trans	-56.4	123.1	175.8	45.6	0	0	0	0	110.4	N188 R192	N188-S190 PolarHBondContact O-N 2.85Å; N188-S190 VanDerWaalsContact O-N 3.16Å; S190-R192 PolarHBondContact O-N 3.41Å
191	K	29.1	Very low	32.3	Very low	201 Å²	201	139.3 Å²	139.3	87%	0.874	78%	0.776	S	S	*	*			trans	-54.2	119.7	166.4	-68.8	174.9	178.7	175.2	0	107.5	P189 A193	P189-K191 PolarHBondContact O-N 2.97Å; K191-A193 PolarHBondContact O-N 3.04Å
192	R	27.9	Very low	35.4	Very low	238 Å²	238	136.3 Å²	136.3	90%	0.898	75%	0.751	S	S	*	*			trans	-54.5	112.7	166.1	-81.8	-177.8	174.5	173.2	-1.1	107.6	S190 I194	S190-R192 PolarHBondContact O-N 3.41Å; R192-I194 PolarHBondContact O-N 2.96Å; R192-I194 VanDerWaalsContact O-N 3.08Å
193	A	28	Very low	38.5	Very low	96 Å²	96	131.8 Å²	131.8	79%	0.793	72%	0.719	S	S	*	*			trans	-63.1	109.5	172	0	0	0	0	0	108.2	K191 L195	K191-A193 PolarHBondContact O-N 3.04Å; A193-L195 PolarHBondContact O-N 2.94Å
194	I	29.2	Very low	41.6	Very low	157 Å²	157	135.4 Å²	135.4	81%	0.805	72%	0.72	S	S	*	*			trans	-69.7	113.7	161.7	-63	169.9	0	0	0	104.7	R192 S196	R192-I194 PolarHBondContact O-N 2.96Å; R192-I194 VanDerWaalsContact O-N 3.08Å; I194-S196 VanDerWaalsContact C-N 3.28Å; I194-S196 PolarHBondContact O-N 3.29Å
195	L	30.6	Very low	44.7	Very low	147 Å²	147	132.1 Å²	132.1	77%	0.77	70%	0.695	S	S	*	*			trans	-61	87.5	172.7	-79.8	155.9	0	0	0	109.5	A193 L197	A193-L195 PolarHBondContact O-N 2.94Å; L195-L197 VanDerWaalsContact C-N 3.31Å; L195-L197 PolarHBondContact O-N 3.47Å; L195-L197 VanDerWaalsContact O-N 3.1Å
196	S	29.9	Very low	47.9	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	65%	0.653	S	S	*	*			trans	-75.5	89.9	160.8	57.6	0	0	0	0	107.6	I194	I194-S196 VanDerWaalsContact C-N 3.28Å; I194-S196 PolarHBondContact O-N 3.29Å
197	L	34.5	Very low	51	Low	89 Å²	89	118 Å²	118	47%	0.466	63%	0.63	S	S	.	*			trans	-60.7	136.1	169.1	-76	158.2	0	0	0	109	L195 I199	L195-L197 VanDerWaalsContact C-N 3.31Å; L195-L197 PolarHBondContact O-N 3.47Å; L195-L197 VanDerWaalsContact O-N 3.1Å; L197-I199 PolarHBondContact O-N 3.32Å
198	P	35.8	Very low	54.2	Low	88 Å²	88	116.9 Å²	116.9	57%	0.571	61%	0.614	S	S	*	*			trans	-58.4	136.2	171.8	22.8	-31.6	0	0	0	110.1	R200	P198-R200 PolarHBondContact O-N 3.47Å
199	I	44.7	Very low	57.4	Low	171 Å²	171	109.5 Å²	109.5	88%	0.877	57%	0.574	S	S	*	*			trans	-72.5	75.2	-175.8	-53	167.4	0	0	0	109.2	L197	L197-I199 PolarHBondContact O-N 3.32Å
200	R	59	Low	60.5	Low	194 Å²	194	104.8 Å²	104.8	73%	0.732	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-77.7	125.9	163.6	-79.1	-173	175.6	-173.8	-1.2	108.5	P198 L202 F231	P198-R200 PolarHBondContact O-N 3.47Å; R200-L202 PolarHBondContact O-N 2.93Å; R200-F231 HydrophobicContact CB-CZ 4.09Å
201	K	76.1	Confident	63.5	Low	185 Å²	185	103.1 Å²	103.1	80%	0.804	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-61	132.8	176	-73.9	-178.5	177.9	177.7	0	110	R375	K201-R375 PolarHBondContact O-NH1 3.05Å
202	L	86.2	Confident	66.5	Low	45 Å²	45	94.1 Å²	94.1	24%	0.236	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-66.1	144.2	170.6	-64	173.1	0	0	0	109.2	R200 Q206 A207 L210 F231 L232 R235	R200-L202 PolarHBondContact O-N 2.93Å; L202-Q206 HydrophobicContact CB-CB 4.07Å; L202-Q206 HydrophobicContact CD2-CB 4.22Å; L202-A207 HydrophobicContact CB-CB 4.48Å; L202-L210 HydrophobicContact CD1-CD2 3.75Å; L202-F231 HydrophobicContact CD2-CE1 3.89Å; L202-L232 HydrophobicContact CD2-CD1 4.27Å; L202-R235 HydrophobicContact CD1-CG 4.17Å; L202-R235 HydrophobicContact CD2-CG 4.32Å
203	S	87.9	Confident	69.7	Low	11 Å²	11	82.9 Å²	82.9	8%	0.077	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-66.3	164.3	168.5	75.5	0	0	0	0	110.9	E205 Q206 A207 E373	S203-E205 PolarHBondContact O-N 2.93Å; S203-Q206 VanDerWaalsContact N-OE1 3.1Å; S203-Q206 PolarHBondContact O-N 2.85Å; S203-Q206 WeakPolarHBondContact OG-CB 3.3Å; S203-Q206 VanDerWaalsContact OG-CG 3.27Å; S203-Q206 WeakPolarHBondContact OG-CG 3.47Å; S203-Q206 PolarHBondContact OG-N 3.38Å; S203-Q206 VanDerWaalsContact OG-N 3.09Å; S203-A207 WeakPolarHBondContact O-CB 3.49Å; S203-A207 PolarHBondContact O-N 3.04Å; S203-E373 WeakPolarHBondContact CB-OE2 3.42Å
204	K	88.2	Confident	72.8	Confident	196 Å²	196	82.9 Å²	82.9	85%	0.852	44%	0.438	S	S	*	.	H	α-helix	trans	-55.7	-42.9	174.7	-67.6	-176.5	179.9	-179.9	0	111.2	A207 A208	K204-A207 PolarHBondContact O-N 3.38Å; K204-A208 WeakPolarHBondContact O-CB 3.2Å; K204-A208 PolarHBondContact O-N 3.11Å
205	E	90.7	Very high	75.9	Confident	44 Å²	44	78.9 Å²	78.9	21%	0.206	42%	0.424	C	S	.	.	H	α-helix	trans	-65.4	-44.3	177.8	-55.8	-176.4	150.9	0	0	111.7	S203 A207 A208 V209 L371 T372 R613	S203-E205 PolarHBondContact O-N 2.93Å; E205-A207 VanDerWaalsContact C-N 3.35Å; E205-A207 PolarHBondContact O-N 2.98Å; E205-A208 PolarHBondContact O-N 3.22Å; E205-V209 WeakPolarHBondContact O-CG2 3.18Å; E205-V209 PolarHBondContact O-N 3.05Å; E205-L371 HydrophobicContact CB-CD2 3.78Å; E205-L371 WeakPolarHBondContact OE2-CA 3.22Å; E205-T372 PolarHBondContact OE1-OG1 3.41Å; E205-T372 PolarHBondContact OE2-N 2.77Å; E205-T372 PolarHBondContact OE2-OG1 2.96Å; E205-R613 IonicContact OE1-NH2 2.65Å
206	Q	92.3	Very high	78.8	Confident	3 Å²	3	74 Å²	74	1%	0.014	41%	0.409	C	S	.	.	H	α-helix	trans	-63.9	-38.6	176.8	-73.4	174.6	-12.9	0	0	112.4	L202 S203 V209 L210 T227 L232 L371	L202-Q206 HydrophobicContact CB-CB 4.07Å; L202-Q206 HydrophobicContact CD2-CB 4.22Å; S203-Q206 VanDerWaalsContact N-OE1 3.1Å; S203-Q206 PolarHBondContact O-N 2.85Å; S203-Q206 WeakPolarHBondContact OG-CB 3.3Å; S203-Q206 VanDerWaalsContact OG-CG 3.27Å; S203-Q206 WeakPolarHBondContact OG-CG 3.47Å; S203-Q206 PolarHBondContact OG-N 3.38Å; S203-Q206 VanDerWaalsContact OG-N 3.09Å; Q206-V209 PolarHBondContact O-N 3.25Å; Q206-L210 PolarHBondContact O-N 3.2Å; Q206-T227 PolarHBondContact NE2-O 2.8Å; Q206-L232 HydrophobicContact CB-CD1 4.11Å; Q206-L232 HydrophobicContact CB-CD2 4.26Å; Q206-L232 HydrophobicContact CG-CD2 4.19Å; Q206-L232 WeakPolarHBondContact O-CD1 3.32Å; Q206-L371 HydrophobicContact CG-CD1 4.41Å; Q206-L371 HydrophobicContact CG-CD2 4.06Å
207	A	91.6	Very high	81.8	Confident	45 Å²	45	73.4 Å²	73.4	37%	0.372	39%	0.393	S	S	.	.	H	α-helix	trans	-67.4	-38.6	175.5	0	0	0	0	0	111.9	L202 S203 K204 E205 L210 S211	L202-A207 HydrophobicContact CB-CB 4.48Å; S203-A207 WeakPolarHBondContact O-CB 3.49Å; S203-A207 PolarHBondContact O-N 3.04Å; K204-A207 PolarHBondContact O-N 3.38Å; E205-A207 VanDerWaalsContact C-N 3.35Å; E205-A207 PolarHBondContact O-N 2.98Å; A207-L210 PolarHBondContact O-N 3.27Å; A207-S211 WeakPolarHBondContact O-CB 3.24Å; A207-S211 PolarHBondContact O-N 2.91Å
208	A	91.4	Very high	84.8	Confident	44 Å²	44	70 Å²	70	36%	0.364	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-43.1	175.1	0	0	0	0	0	111.9	K204 E205 S211 A212 M369	K204-A208 WeakPolarHBondContact O-CB 3.2Å; K204-A208 PolarHBondContact O-N 3.11Å; E205-A208 PolarHBondContact O-N 3.22Å; A208-S211 PolarHBondContact O-N 3Å; A208-A212 PolarHBondContact O-N 3.08Å; A208-M369 HydrophobicContact CB-CE 3.91Å
209	V	93.9	Very high	87.7	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.012	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-47.2	173.1	174.5	0	0	0	0	110.9	E205 Q206 S211 A212 V213 V219 F221 L232 I236 M369 L371	E205-V209 WeakPolarHBondContact O-CG2 3.18Å; E205-V209 PolarHBondContact O-N 3.05Å; Q206-V209 PolarHBondContact O-N 3.25Å; V209-S211 VanDerWaalsContact C-N 3.31Å; V209-S211 PolarHBondContact O-N 3.37Å; V209-A212 PolarHBondContact O-N 3.04Å; V209-V213 HydrophobicContact CG1-CG2 4.47Å; V209-V213 WeakPolarHBondContact O-CG2 3.31Å; V209-V213 PolarHBondContact O-N 2.91Å; V209-V219 HydrophobicContact CG1-CG1 4.38Å; V209-F221 HydrophobicContact CG1-CB 4.06Å; V209-F221 HydrophobicContact CG1-CD1 3.65Å; V209-F221 HydrophobicContact CG1-CD2 4.48Å; V209-F221 HydrophobicContact CG1-CE1 4.17Å; V209-F221 HydrophobicContact CG1-CG 3.81Å; V209-F221 HydrophobicContact CG2-CB 4.03Å; V209-F221 HydrophobicContact CG2-CG 4.45Å; V209-L232 HydrophobicContact CB-CD2 3.82Å; V209-L232 HydrophobicContact CG1-CD2 3.7Å; V209-L232 HydrophobicContact CG2-CD2 4.28Å; V209-I236 HydrophobicContact CG1-CD1 4.39Å; V209-M369 HydrophobicContact CB-SD 4.17Å; V209-M369 HydrophobicContact CG2-CB 3.88Å; V209-M369 HydrophobicContact CG2-CG 4.34Å; V209-M369 HydrophobicContact CG2-SD 3.62Å; V209-L371 HydrophobicContact CG2-CD2 4.3Å
210	L	93.8	Very high	90.1	Very high	21 Å²	21	57.6 Å²	57.6	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-59.4	-42.5	178.1	179.7	62.1	0	0	0	111.7	L202 Q206 A207 V213 L214 L232 R235 I236	L202-L210 HydrophobicContact CD1-CD2 3.75Å; Q206-L210 PolarHBondContact O-N 3.2Å; A207-L210 PolarHBondContact O-N 3.27Å; L210-V213 PolarHBondContact O-N 3.13Å; L210-L214 HydrophobicContact CD1-CD1 4.21Å; L210-L214 HydrophobicContact CD1-CG 4.25Å; L210-L214 HydrophobicContact CG-CD1 4.08Å; L210-L214 VanDerWaalsContact O-CG 3.29Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 3.34Å; L210-L232 HydrophobicContact CB-CD1 4.49Å; L210-R235 HydrophobicContact CD2-CG 4.47Å; L210-I236 HydrophobicContact CD1-CB 4.43Å; L210-I236 HydrophobicContact CD1-CG1 3.71Å
211	S	92.9	Very high	91.9	Very high	78 Å²	78	48.4 Å²	48.4	55%	0.545	27%	0.271	S	S	.	.	H	α-helix	trans	-62.5	-45.6	176.6	179.3	0	0	0	0	112.1	A207 A208 V209 V213 L214 S215	A207-S211 WeakPolarHBondContact O-CB 3.24Å; A207-S211 PolarHBondContact O-N 2.91Å; A208-S211 PolarHBondContact O-N 3Å; V209-S211 VanDerWaalsContact C-N 3.31Å; V209-S211 PolarHBondContact O-N 3.37Å; S211-V213 VanDerWaalsContact C-N 3.32Å; S211-V213 PolarHBondContact O-N 3.45Å; S211-L214 PolarHBondContact O-N 3.39Å; S211-S215 PolarHBondContact O-N 3.28Å
212	A	92.3	Very high	92.7	Very high	13 Å²	13	39.6 Å²	39.6	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-42.2	176.5	0	0	0	0	0	111.9	A208 V209 S215 K217 V219 M369	A208-A212 PolarHBondContact O-N 3.08Å; V209-A212 PolarHBondContact O-N 3.04Å; A212-S215 PolarHBondContact O-N 3.02Å; A212-S215 PolarHBondContact O-OG 2.81Å; A212-K217 PolarHBondContact O-N 2.88Å; A212-V219 HydrophobicContact CB-CG2 3.9Å; A212-M369 HydrophobicContact CB-SD 4.14Å
213	V	94.8	Very high	93	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-44.5	175.8	172.8	0	0	0	0	111.4	V209 L210 S211 S215 G216 V219 I236 L240 Q332 I334	V209-V213 HydrophobicContact CG1-CG2 4.47Å; V209-V213 WeakPolarHBondContact O-CG2 3.31Å; V209-V213 PolarHBondContact O-N 2.91Å; L210-V213 PolarHBondContact O-N 3.13Å; S211-V213 VanDerWaalsContact C-N 3.32Å; S211-V213 PolarHBondContact O-N 3.45Å; V213-S215 PolarHBondContact O-N 3.28Å; V213-G216 PolarHBondContact O-N 3.37Å; V213-V219 HydrophobicContact CG2-CB 4.06Å; V213-V219 HydrophobicContact CG2-CG1 4.5Å; V213-V219 HydrophobicContact CG2-CG2 3.93Å; V213-I236 HydrophobicContact CG1-CG2 3.83Å; V213-I236 HydrophobicContact CG2-CD1 4.27Å; V213-L240 HydrophobicContact CG1-CD1 4.25Å; V213-L240 HydrophobicContact CG1-CD2 4.48Å; V213-Q332 PolarHBondContact O-NE2 3.49Å; V213-I334 HydrophobicContact CG1-CD1 3.59Å; V213-I334 HydrophobicContact CG1-CG1 3.82Å; V213-I334 HydrophobicContact CG2-CG1 4.13Å; V213-I334 HydrophobicContact CG2-CG2 4.2Å
214	L	93.3	Very high	93.1	Very high	97 Å²	97	37.4 Å²	37.4	51%	0.508	22%	0.221	S	C	.	.	H	α-helix	trans	-66.5	-23.8	178.3	-69.4	175.3	0	0	0	113.2	L210 S211 G216 L240	L210-L214 HydrophobicContact CD1-CD1 4.21Å; L210-L214 HydrophobicContact CD1-CG 4.25Å; L210-L214 HydrophobicContact CG-CD1 4.08Å; L210-L214 VanDerWaalsContact O-CG 3.29Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 3.34Å; S211-L214 PolarHBondContact O-N 3.39Å; L214-G216 PolarHBondContact O-N 2.67Å; L214-L240 HydrophobicContact CD2-CD2 4.28Å
215	S	93.1	Very high	93	Very high	73 Å²	73	28.3 Å²	28.3	51%	0.51	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	0.1	172.4	74.5	0	0	0	0	114.3	S211 A212 V213 K217	S211-S215 PolarHBondContact O-N 3.28Å; A212-S215 PolarHBondContact O-N 3.02Å; A212-S215 PolarHBondContact O-OG 2.81Å; V213-S215 PolarHBondContact O-N 3.28Å; S215-K217 WeakPolarHBondContact OG-CG 3.34Å
216	G	92.7	Very high	92.6	Very high	43 Å²	43	26.5 Å²	26.5	44%	0.443	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	7.7	177.6	0	0	0	0	0	114.9	V213 L214 Q332	V213-G216 PolarHBondContact O-N 3.37Å; L214-G216 PolarHBondContact O-N 2.67Å; G216-Q332 VanDerWaalsContact C-NE2 3.26Å
217	K	93.7	Very high	92.5	Very high	99 Å²	99	26.4 Å²	26.4	43%	0.43	18%	0.175	S	C	.	.			trans	-74.7	151.2	179.6	-65	-177.7	-174	-176.6	0	112	A212 S215 V219 Q332 V367	A212-K217 PolarHBondContact O-N 2.88Å; S215-K217 WeakPolarHBondContact OG-CG 3.34Å; K217-V219 HydrophobicContact CB-CG2 4.18Å; K217-V219 PolarHBondContact O-N 3.06Å; K217-Q332 PolarHBondContact O-NE2 3.46Å; K217-V367 HydrophobicContact CB-CG2 4.2Å; K217-V367 HydrophobicContact CD-CG2 3.66Å; K217-V367 HydrophobicContact CG-CG2 4.49Å
218	N	96.3	Very high	92.2	Very high	16 Å²	16	25.3 Å²	25.3	9%	0.086	17%	0.169	C	C	.	.			trans	-80.4	109.3	168.9	-70.2	-14.2	0	0	0	109.6	Q332 L333 V364 Q366 V367	N218-Q332 VanDerWaalsContact OD1-CA 3.27Å; N218-Q332 WeakPolarHBondContact OD1-CA 3.29Å; N218-L333 CarbonylContact C-O 3.51Å; N218-L333 VanDerWaalsContact CA-O 3.3Å; N218-L333 WeakPolarHBondContact CA-O 3.27Å; N218-L333 PolarHBondContact OD1-N 2.93Å; N218-V364 WeakPolarHBondContact CB-O 3.46Å; N218-V364 PolarHBondContact ND2-O 3.45Å; N218-Q366 HydrophobicContact CB-CB 4.42Å; N218-Q366 HydrophobicContact CB-CG 4.17Å; N218-Q366 PolarHBondContact O-N 3.13Å; N218-V367 PolarHBondContact O-N 3.4Å
219	V	96.1	Very high	92.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	126.3	-170.1	-177.8	0	0	0	0	110.1	V209 A212 V213 K217 F221 L333 I334 V335 V367 M369	V209-V219 HydrophobicContact CG1-CG1 4.38Å; A212-V219 HydrophobicContact CB-CG2 3.9Å; V213-V219 HydrophobicContact CG2-CB 4.06Å; V213-V219 HydrophobicContact CG2-CG1 4.5Å; V213-V219 HydrophobicContact CG2-CG2 3.93Å; K217-V219 HydrophobicContact CB-CG2 4.18Å; K217-V219 PolarHBondContact O-N 3.06Å; V219-F221 HydrophobicContact CG1-CB 4.43Å; V219-F221 HydrophobicContact CG1-CD1 4.38Å; V219-L333 PolarHBondContact N-O 3.15Å; V219-I334 WeakPolarHBondContact O-CA 3.04Å; V219-V335 PolarHBondContact O-N 3.32Å; V219-V367 WeakPolarHBondContact CA-O 3.34Å; V219-V367 HydrophobicContact CG2-CB 4.36Å; V219-M369 HydrophobicContact CG1-SD 4.35Å
220	F	96.4	Very high	91.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.5	157.6	170.3	-115.8	0	0	0	108.5	T222 V303 V335 F339 W361 I365 V367 N368 M369 F605 L609	F220-T222 HydrophobicContact CE1-CG2 3.93Å; F220-T222 HydrophobicContact CZ-CG2 4.19Å; F220-V303 HydrophobicContact CE2-CG1 3.9Å; F220-V335 CarbonylContact C-O 3.41Å; F220-V335 WeakPolarHBondContact CA-O 3.23Å; F220-V335 HydrophobicContact CD2-CB 4.12Å; F220-V335 HydrophobicContact CD2-CG1 3.93Å; F220-F339 HydrophobicContact CE1-CE2 4.27Å; F220-F339 AromaticContact CE2-CE2 3.92Å; F220-F339 HydrophobicContact CE2-CE2 3.92Å; F220-F339 AromaticContact CZ-CD2 3.95Å; F220-F339 HydrophobicContact CZ-CD2 3.95Å; F220-F339 AromaticContact CZ-CE2 3.5Å; F220-F339 HydrophobicContact CZ-CE2 3.5Å; F220-W361 HydrophobicContact CB-CH2 4.39Å; F220-W361 HydrophobicContact CB-CZ2 4.07Å; F220-W361 AromaticContact CD1-CZ2 3.98Å; F220-W361 HydrophobicContact CD1-CZ2 3.98Å; F220-W361 AromaticContact CD2-CH2 3.74Å; F220-W361 HydrophobicContact CD2-CH2 3.74Å; F220-W361 AromaticContact CD2-CZ2 3.9Å; F220-W361 HydrophobicContact CD2-CZ2 3.9Å; F220-W361 HydrophobicContact CE1-CZ2 4.36Å; F220-W361 HydrophobicContact CE2-CH2 4.11Å; F220-W361 HydrophobicContact CE2-CZ2 4.3Å; F220-W361 HydrophobicContact CG-CH2 4.01Å; F220-W361 AromaticContact CG-CZ2 3.71Å; F220-W361 HydrophobicContact CG-CZ2 3.71Å; F220-W361 HydrophobicContact CZ-CZ2 4.5Å; F220-I365 HydrophobicContact CB-CD1 4.47Å; F220-I365 HydrophobicContact CB-CG2 3.51Å; F220-V367 PolarHBondContact N-O 2.96Å; F220-N368 HydrophobicContact CD1-CB 4.46Å; F220-N368 WeakPolarHBondContact CD1-OD1 3.42Å; F220-N368 CarbonylContact O-C 3.56Å; F220-N368 VanDerWaalsContact O-CA 3.28Å; F220-N368 WeakPolarHBondContact O-CA 3.36Å; F220-M369 PolarHBondContact O-N 3.11Å; F220-F605 HydrophobicContact CE1-CE1 4.02Å; F220-F605 HydrophobicContact CE1-CZ 4.03Å; F220-L609 HydrophobicContact CE1-CD1 4.28Å
221	F	95.2	Very high	91.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.4	169.9	70.4	-87.7	0	0	0	111.7	V209 V219 K229 L232 L233 I236 I334 V335 C336 M369 L371	V209-F221 HydrophobicContact CG1-CB 4.06Å; V209-F221 HydrophobicContact CG1-CD1 3.65Å; V209-F221 HydrophobicContact CG1-CD2 4.48Å; V209-F221 HydrophobicContact CG1-CE1 4.17Å; V209-F221 HydrophobicContact CG1-CG 3.81Å; V209-F221 HydrophobicContact CG2-CB 4.03Å; V209-F221 HydrophobicContact CG2-CG 4.45Å; V219-F221 HydrophobicContact CG1-CB 4.43Å; V219-F221 HydrophobicContact CG1-CD1 4.38Å; F221-K229 HydrophobicContact CE2-CB 4.11Å; F221-K229 HydrophobicContact CE2-CG 4.32Å; F221-L232 HydrophobicContact CD2-CD2 4.22Å; F221-L232 HydrophobicContact CE2-CD2 3.96Å; F221-L232 HydrophobicContact CZ-CD2 4.27Å; F221-L233 HydrophobicContact CE1-CD2 3.88Å; F221-L233 HydrophobicContact CZ-CD2 3.58Å; F221-L233 HydrophobicContact CZ-CG 3.88Å; F221-I236 HydrophobicContact CE1-CD1 4.17Å; F221-I236 HydrophobicContact CZ-CD1 4.42Å; F221-I334 HydrophobicContact CE1-CG2 4.02Å; F221-V335 PolarHBondContact N-O 3.32Å; F221-C336 HydrophobicContact CD1-CB 4.1Å; F221-C336 HydrophobicContact CD2-CB 3.89Å; F221-C336 HydrophobicContact CE1-CB 3.71Å; F221-C336 HydrophobicContact CE2-CB 3.47Å; F221-C336 VanDerWaalsContact CE2-CB 3.47Å; F221-C336 HydrophobicContact CG-CB 4.19Å; F221-C336 HydrophobicContact CZ-CB 3.39Å; F221-C336 WeakPolarHBondContact O-CA 3.46Å; F221-C336 VanDerWaalsContact O-CB 3.28Å; F221-C336 WeakPolarHBondContact O-CB 3.46Å; F221-M369 CarbonylContact C-O 3.48Å; F221-M369 WeakPolarHBondContact CA-O 3.16Å; F221-M369 HydrophobicContact CB-CB 4.2Å; F221-L371 HydrophobicContact CD2-CD1 4.29Å
222	T	94.7	Very high	91.3	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	-180	-171.7	-168.1	0	0	0	0	110.5	F220 G337 M369 E370 L371 Y606	F220-T222 HydrophobicContact CE1-CG2 3.93Å; F220-T222 HydrophobicContact CZ-CG2 4.19Å; T222-G337 WeakPolarHBondContact CA-O 3.35Å; T222-G337 WeakPolarHBondContact CB-O 3.3Å; T222-G337 PolarHBondContact OG1-O 3.25Å; T222-M369 PolarHBondContact N-O 3.13Å; T222-E370 HydrophobicContact CG2-CB 4.21Å; T222-E370 HydrophobicContact CG2-CG 4.29Å; T222-L371 PolarHBondContact O-N 2.75Å; T222-Y606 HydrophobicContact CG2-CE1 3.61Å; T222-Y606 PolarHBondContact OG1-OH 3.3Å
223	G	91.4	Very high	91.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157	162.7	178.4	0	0	0	0	0	110.3	K229 L371	G223-K229 PolarHBondContact O-NZ 2.87Å; G223-L371 WeakPolarHBondContact CA-O 3.33Å
224	S	90.4	Very high	90.9	Very high	10 Å²	10	26.7 Å²	26.7	7%	0.07	16%	0.157	C	C	.	.	S	Bend	trans	-54.8	162.3	178.1	-55.8	0	0	0	0	112.4	G226 T227 K229 R390	S224-G226 PolarHBondContact O-N 3.42Å; S224-T227 WeakPolarHBondContact O-CG2 3.45Å; S224-T227 PolarHBondContact O-N 2.94Å; S224-T227 PolarHBondContact O-OG1 2.9Å; S224-K229 PolarHBondContact O-NZ 2.78Å; S224-R390 WeakPolarHBondContact OG-CD 3.46Å; S224-R390 PolarHBondContact OG-NH1 3.05Å
225	A	85.9	Confident	90.8	Very high	5 Å²	5	28 Å²	28	4%	0.041	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	133.3	166.9	0	0	0	0	0	110.5	Y574 S578	A225-Y574 HydrophobicContact CB-CE1 4.36Å; A225-Y574 WeakPolarHBondContact CB-OH 3.41Å; A225-Y574 PolarHBondContact N-OH 3.06Å; A225-S578 VanDerWaalsContact CB-CB 3.48Å; A225-S578 WeakPolarHBondContact CB-OG 3.42Å
226	G	82.9	Confident	90.8	Very high	7 Å²	7	24.6 Å²	24.6	7%	0.072	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	1.9	177.4	0	0	0	0	0	116.7	S224 G228 R375 R376	S224-G226 PolarHBondContact O-N 3.42Å; G226-G228 PolarHBondContact O-N 2.87Å; G226-R375 PolarHBondContact O-N 3.06Å; G226-R376 PolarHBondContact O-N 3.05Å
227	T	89.1	Confident	90.6	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	12%	0.121	C	C	.	.	S	Bend	trans	-77.7	4	177.6	59	0	0	0	0	115.2	Q206 S224 E373 V374	Q206-T227 PolarHBondContact NE2-O 2.8Å; S224-T227 WeakPolarHBondContact O-CG2 3.45Å; S224-T227 PolarHBondContact O-N 2.94Å; S224-T227 PolarHBondContact O-OG1 2.9Å; T227-E373 VanDerWaalsContact CA-O 3.31Å; T227-E373 WeakPolarHBondContact CA-O 3.44Å; T227-V374 HydrophobicContact CG2-CG2 4.05Å
228	G	86.8	Confident	90.4	Very high	22 Å²	22	22.8 Å²	22.8	23%	0.227	13%	0.131	C	C	.	.			trans	81.6	21.9	177	0	0	0	0	0	115.6	G226 S230 F231 L232	G226-G228 PolarHBondContact O-N 2.87Å; G228-S230 PolarHBondContact O-N 2.84Å; G228-F231 WeakPolarHBondContact O-CB 3.23Å; G228-F231 PolarHBondContact O-N 2.87Å; G228-F231 VanDerWaalsContact O-N 3.12Å; G228-L232 PolarHBondContact O-N 2.86Å
229	K	90	Very high	90.2	Very high	12 Å²	12	24.3 Å²	24.3	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-49.1	-55.5	176.9	-64.7	-176.2	-67.5	-78.4	0	113.5	F221 G223 S224 F231 L232 L233 L371	F221-K229 HydrophobicContact CE2-CB 4.11Å; F221-K229 HydrophobicContact CE2-CG 4.32Å; G223-K229 PolarHBondContact O-NZ 2.87Å; S224-K229 PolarHBondContact O-NZ 2.78Å; K229-F231 VanDerWaalsContact C-N 3.28Å; K229-F231 PolarHBondContact O-N 2.66Å; K229-L232 WeakPolarHBondContact O-CB 2.95Å; K229-L232 PolarHBondContact O-N 2.93Å; K229-L233 PolarHBondContact O-N 3.26Å; K229-L371 HydrophobicContact CG-CD1 4.11Å
230	S	84.4	Confident	90	Very high	34 Å²	34	25 Å²	25	24%	0.238	15%	0.146	C	C	.	.	H	α-helix	trans	-68.6	-26.2	-179.3	-42.8	0	0	0	0	112.9	G228 K234 D301	G228-S230 PolarHBondContact O-N 2.84Å; S230-K234 WeakPolarHBondContact O-CG 3.49Å; S230-K234 PolarHBondContact O-N 3.12Å; S230-D301 PolarHBondContact OG-OD2 2.91Å
231	F	86.5	Confident	89.8	Confident	71 Å²	71	28 Å²	28	31%	0.311	17%	0.166	S	C	.	.	H	α-helix	trans	-67.7	-45.3	171.9	171.5	-97.3	0	0	0	110.9	R200 L202 G228 K229 L233 K234 R235	R200-F231 HydrophobicContact CB-CZ 4.09Å; L202-F231 HydrophobicContact CD2-CE1 3.89Å; G228-F231 WeakPolarHBondContact O-CB 3.23Å; G228-F231 PolarHBondContact O-N 2.87Å; G228-F231 VanDerWaalsContact O-N 3.12Å; K229-F231 VanDerWaalsContact C-N 3.28Å; K229-F231 PolarHBondContact O-N 2.66Å; F231-L233 VanDerWaalsContact C-N 3.35Å; F231-L233 PolarHBondContact O-N 2.91Å; F231-K234 PolarHBondContact O-N 3.08Å; F231-R235 PolarHBondContact O-N 3.48Å
232	L	91.4	Very high	89.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-42	174.5	176.3	59.8	0	0	0	111.6	L202 Q206 V209 L210 F221 G228 K229 K234 R235 I236 L371	L202-L232 HydrophobicContact CD2-CD1 4.27Å; Q206-L232 HydrophobicContact CB-CD1 4.11Å; Q206-L232 HydrophobicContact CB-CD2 4.26Å; Q206-L232 HydrophobicContact CG-CD2 4.19Å; Q206-L232 WeakPolarHBondContact O-CD1 3.32Å; V209-L232 HydrophobicContact CB-CD2 3.82Å; V209-L232 HydrophobicContact CG1-CD2 3.7Å; V209-L232 HydrophobicContact CG2-CD2 4.28Å; L210-L232 HydrophobicContact CB-CD1 4.49Å; F221-L232 HydrophobicContact CD2-CD2 4.22Å; F221-L232 HydrophobicContact CE2-CD2 3.96Å; F221-L232 HydrophobicContact CZ-CD2 4.27Å; G228-L232 PolarHBondContact O-N 2.86Å; K229-L232 WeakPolarHBondContact O-CB 2.95Å; K229-L232 PolarHBondContact O-N 2.93Å; L232-K234 VanDerWaalsContact C-N 3.34Å; L232-K234 PolarHBondContact O-N 2.85Å; L232-R235 WeakPolarHBondContact O-CA 3.49Å; L232-R235 WeakPolarHBondContact O-CB 3.38Å; L232-R235 PolarHBondContact O-N 3.3Å; L232-I236 HydrophobicContact CD1-CD1 4.23Å; L232-I236 HydrophobicContact CD1-CG1 4.29Å; L232-I236 HydrophobicContact CG-CD1 3.9Å; L232-I236 HydrophobicContact CG-CG1 4.44Å; L232-I236 WeakPolarHBondContact O-CG1 3.33Å; L232-I236 PolarHBondContact O-N 3.07Å; L232-L371 HydrophobicContact CD2-CD1 4.35Å
233	L	91.4	Very high	88.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.6	-44.7	174.4	-82.9	-168.9	0	0	0	113	F221 K229 F231 R235 I236 L237 I258 I299 D301 I334 C336	F221-L233 HydrophobicContact CE1-CD2 3.88Å; F221-L233 HydrophobicContact CZ-CD2 3.58Å; F221-L233 HydrophobicContact CZ-CG 3.88Å; K229-L233 PolarHBondContact O-N 3.26Å; F231-L233 VanDerWaalsContact C-N 3.35Å; F231-L233 PolarHBondContact O-N 2.91Å; L233-R235 PolarHBondContact O-N 3.47Å; L233-I236 HydrophobicContact CD2-CD1 4.43Å; L233-I236 PolarHBondContact O-N 3.24Å; L233-L237 WeakPolarHBondContact O-CB 3.46Å; L233-L237 WeakPolarHBondContact O-CG 3.08Å; L233-L237 PolarHBondContact O-N 3.08Å; L233-I258 HydrophobicContact CD1-CG2 4.18Å; L233-I299 HydrophobicContact CD1-CG2 3.95Å; L233-I299 HydrophobicContact CD2-CG2 3.52Å; L233-I299 HydrophobicContact CG-CG2 4.35Å; L233-D301 HydrophobicContact CD1-CB 3.65Å; L233-I334 HydrophobicContact CD2-CG2 4.2Å; L233-C336 WeakPolarHBondContact CD1-SG 3.26Å
234	K	87.6	Confident	88.8	Confident	70 Å²	70	43.6 Å²	43.6	30%	0.304	25%	0.248	S	C	.	.	H	α-helix	trans	-60.8	-35.4	176.6	-72.8	176.2	-178.6	-177.6	0	111.8	S230 F231 L232 G238 H257	S230-K234 WeakPolarHBondContact O-CG 3.49Å; S230-K234 PolarHBondContact O-N 3.12Å; F231-K234 PolarHBondContact O-N 3.08Å; L232-K234 VanDerWaalsContact C-N 3.34Å; L232-K234 PolarHBondContact O-N 2.85Å; K234-G238 PolarHBondContact O-N 3.39Å; K234-G238 VanDerWaalsContact O-N 3.11Å; K234-H257 WeakPolarHBondContact CE-O 3.36Å; K234-H257 PolarHBondContact NZ-O 3.28Å
235	R	90.1	Very high	88.9	Confident	126 Å²	126	44 Å²	44	48%	0.475	25%	0.249	S	C	.	.	H	α-helix	trans	-70	-43.5	175.8	-169.9	63.2	173.8	126.2	-4.3	111.9	L202 L210 F231 L232 L233 G238 S239	L202-R235 HydrophobicContact CD1-CG 4.17Å; L202-R235 HydrophobicContact CD2-CG 4.32Å; L210-R235 HydrophobicContact CD2-CG 4.47Å; F231-R235 PolarHBondContact O-N 3.48Å; L232-R235 WeakPolarHBondContact O-CA 3.49Å; L232-R235 WeakPolarHBondContact O-CB 3.38Å; L232-R235 PolarHBondContact O-N 3.3Å; L233-R235 PolarHBondContact O-N 3.47Å; R235-G238 PolarHBondContact O-N 3.36Å; R235-S239 PolarHBondContact O-N 2.98Å; R235-S239 VanDerWaalsContact O-N 3.15Å; R235-S239 PolarHBondContact O-OG 3.23Å
236	I	93.1	Very high	89.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-47.7	174	-69.6	164.9	0	0	0	110.2	V209 L210 V213 F221 L232 L233 G238 S239 L240 I299 I334	V209-I236 HydrophobicContact CG1-CD1 4.39Å; L210-I236 HydrophobicContact CD1-CB 4.43Å; L210-I236 HydrophobicContact CD1-CG1 3.71Å; V213-I236 HydrophobicContact CG1-CG2 3.83Å; V213-I236 HydrophobicContact CG2-CD1 4.27Å; F221-I236 HydrophobicContact CE1-CD1 4.17Å; F221-I236 HydrophobicContact CZ-CD1 4.42Å; L232-I236 HydrophobicContact CD1-CD1 4.23Å; L232-I236 HydrophobicContact CD1-CG1 4.29Å; L232-I236 HydrophobicContact CG-CD1 3.9Å; L232-I236 HydrophobicContact CG-CG1 4.44Å; L232-I236 WeakPolarHBondContact O-CG1 3.33Å; L232-I236 PolarHBondContact O-N 3.07Å; L233-I236 HydrophobicContact CD2-CD1 4.43Å; L233-I236 PolarHBondContact O-N 3.24Å; I236-G238 VanDerWaalsContact C-N 3.27Å; I236-G238 PolarHBondContact O-N 2.81Å; I236-S239 WeakPolarHBondContact O-CA 3.22Å; I236-S239 PolarHBondContact O-N 3.26Å; I236-L240 HydrophobicContact CG2-CD1 3.64Å; I236-L240 HydrophobicContact CG2-CG 4.16Å; I236-L240 WeakPolarHBondContact O-CG 3.43Å; I236-L240 PolarHBondContact O-N 2.91Å; I236-I299 HydrophobicContact CG2-CD1 4.31Å; I236-I334 HydrophobicContact CD1-CG2 4.43Å; I236-I334 HydrophobicContact CG2-CD1 4.28Å
237	L	90.1	Very high	89.5	Confident	42 Å²	42	45.6 Å²	45.6	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-57.3	-39.1	176.1	-81	167.5	0	0	0	112.8	L233 S239 T245 A247 I258 I299	L233-L237 WeakPolarHBondContact O-CB 3.46Å; L233-L237 WeakPolarHBondContact O-CG 3.08Å; L233-L237 PolarHBondContact O-N 3.08Å; L237-S239 VanDerWaalsContact C-N 3.25Å; L237-S239 PolarHBondContact O-N 3.2Å; L237-T245 HydrophobicContact CD2-CG2 3.73Å; L237-A247 HydrophobicContact CD1-CB 4.05Å; L237-A247 HydrophobicContact CD2-CB 4.02Å; L237-I258 HydrophobicContact CD1-CB 4.45Å; L237-I299 HydrophobicContact CD1-CD1 4.46Å; L237-I299 HydrophobicContact CD2-CD1 3.48Å; L237-I299 VanDerWaalsContact CD2-CD1 3.48Å; L237-I299 HydrophobicContact CG-CD1 3.63Å
238	G	88.9	Confident	89.6	Confident	63 Å²	63	45.6 Å²	45.6	65%	0.649	26%	0.256	S	S	*	.	H	α-helix	trans	-71.9	-16	175.3	0	0	0	0	0	114.5	K234 R235 I236	K234-G238 PolarHBondContact O-N 3.39Å; K234-G238 VanDerWaalsContact O-N 3.11Å; R235-G238 PolarHBondContact O-N 3.36Å; I236-G238 VanDerWaalsContact C-N 3.27Å; I236-G238 PolarHBondContact O-N 2.81Å
239	S	91.4	Very high	89.7	Confident	48 Å²	48	44.5 Å²	44.5	34%	0.336	25%	0.245	S	C	.	.	H	α-helix	trans	-99.6	-19	179.4	-71	0	0	0	0	113.5	R235 I236 L237	R235-S239 PolarHBondContact O-N 2.98Å; R235-S239 VanDerWaalsContact O-N 3.15Å; R235-S239 PolarHBondContact O-OG 3.23Å; I236-S239 WeakPolarHBondContact O-CA 3.22Å; I236-S239 PolarHBondContact O-N 3.26Å; L237-S239 VanDerWaalsContact C-N 3.25Å; L237-S239 PolarHBondContact O-N 3.2Å
240	L	92.5	Very high	89.5	Confident	14 Å²	14	44.8 Å²	44.8	7%	0.073	25%	0.249	C	C	.	.	S	Bend	trans	-93	155.3	178.9	-69.1	177.9	0	0	0	112.4	V213 L214 I236 T245 H297 I334	V213-L240 HydrophobicContact CG1-CD1 4.25Å; V213-L240 HydrophobicContact CG1-CD2 4.48Å; L214-L240 HydrophobicContact CD2-CD2 4.28Å; I236-L240 HydrophobicContact CG2-CD1 3.64Å; I236-L240 HydrophobicContact CG2-CG 4.16Å; I236-L240 WeakPolarHBondContact O-CG 3.43Å; I236-L240 PolarHBondContact O-N 2.91Å; L240-T245 HydrophobicContact CB-CG2 4.21Å; L240-T245 HydrophobicContact CD1-CG2 4.14Å; L240-H297 HydrophobicContact CD1-CB 4.22Å; L240-I334 HydrophobicContact CD1-CD1 3.55Å
241	P	91.1	Very high	89.3	Confident	63 Å²	63	45.3 Å²	45.3	41%	0.409	25%	0.251	S	S	.	.			trans	-64.9	122.3	179.3	24.5	-33.5	0	0	0	111.5	K243 S244 T245 H297	P241-K243 VanDerWaalsContact C-N 3.33Å; P241-K243 PolarHBondContact O-N 2.88Å; P241-S244 PolarHBondContact O-N 2.75Å; P241-T245 WeakPolarHBondContact O-CB 3.44Å; P241-T245 PolarHBondContact O-N 2.68Å; P241-T245 PolarHBondContact O-OG1 2.73Å; P241-H297 VanDerWaalsContact CG-CE1 3.49Å; P241-H297 WeakPolarHBondContact CG-CE1 3.41Å
242	P	86.1	Confident	88.4	Confident	116 Å²	116	42.9 Å²	42.9	75%	0.753	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-22.6	-167.8	26.6	-35.6	0	0	0	114.2
243	K	84.8	Confident	87.4	Confident	196 Å²	196	44.3 Å²	44.3	85%	0.852	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-24.1	-178.5	-68	-172.1	178.6	-174.3	0	113.8	P241	P241-K243 VanDerWaalsContact C-N 3.33Å; P241-K243 PolarHBondContact O-N 2.88Å
244	S	90.9	Very high	86.7	Confident	16 Å²	16	44.5 Å²	44.5	11%	0.112	26%	0.256	C	S	.	.	S	Bend	trans	-120.2	14.9	-175	60.2	0	0	0	0	112.8	P241 R296 H297	P241-S244 PolarHBondContact O-N 2.75Å; S244-R296 PolarHBondContact O-N 3.35Å; S244-H297 PolarHBondContact O-N 3.12Å; S244-H297 VanDerWaalsContact O-N 3.07Å; S244-H297 PolarHBondContact O-ND1 2.98Å
245	T	92.4	Very high	86.1	Confident	17 Å²	17	41.3 Å²	41.3	10%	0.104	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	121.9	-179.5	-58	0	0	0	0	108.7	L237 L240 P241 H297 I299	L237-T245 HydrophobicContact CD2-CG2 3.73Å; L240-T245 HydrophobicContact CB-CG2 4.21Å; L240-T245 HydrophobicContact CD1-CG2 4.14Å; P241-T245 WeakPolarHBondContact O-CB 3.44Å; P241-T245 PolarHBondContact O-N 2.68Å; P241-T245 PolarHBondContact O-OG1 2.73Å; T245-H297 WeakPolarHBondContact CA-O 3.39Å; T245-H297 HydrophobicContact CG2-CB 4.13Å; T245-H297 PolarHBondContact OG1-ND1 3.35Å; T245-I299 HydrophobicContact CG2-CD1 4.23Å; T245-I299 HydrophobicContact CG2-CG1 4.45Å
246	F	90.1	Very high	85	Confident	32 Å²	32	37.3 Å²	37.3	14%	0.14	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117.5	-179.4	-71.8	-100.7	0	0	0	109.5	F266 H291 C295 H297 L298 I299	F246-F266 HydrophobicContact CB-CD2 4.15Å; F246-F266 HydrophobicContact CB-CE2 3.94Å; F246-F266 AromaticContact CD1-CD2 3.72Å; F246-F266 HydrophobicContact CD1-CD2 3.72Å; F246-F266 AromaticContact CD1-CE2 3.65Å; F246-F266 HydrophobicContact CD1-CE2 3.65Å; F246-F266 HydrophobicContact CD2-CE2 4.26Å; F246-F266 HydrophobicContact CE1-CD2 4.38Å; F246-F266 HydrophobicContact CE1-CE2 4.18Å; F246-F266 HydrophobicContact CG-CD2 4.08Å; F246-F266 AromaticContact CG-CE2 3.69Å; F246-F266 HydrophobicContact CG-CE2 3.69Å; F246-H291 HydrophobicContact CE1-CB 4.31Å; F246-H291 HydrophobicContact CZ-CB 4.49Å; F246-C295 HydrophobicContact CD2-CB 3.65Å; F246-C295 VanDerWaalsContact CD2-SG 3.53Å; F246-C295 HydrophobicContact CE2-CB 3.76Å; F246-H297 PolarHBondContact N-O 3.39Å; F246-L298 HydrophobicContact CB-CD1 4.2Å; F246-I299 PolarHBondContact O-N 3.12Å
247	A	89.9	Confident	84	Confident	15 Å²	15	38.8 Å²	38.8	12%	0.124	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.9	172.6	0	0	0	0	0	109.7	L237 I258 G260 T261	L237-A247 HydrophobicContact CD1-CB 4.05Å; L237-A247 HydrophobicContact CD2-CB 4.02Å; A247-I258 HydrophobicContact CB-CD1 3.99Å; A247-I258 HydrophobicContact CB-CG1 4.26Å; A247-G260 CarbonylContact O-C 3.59Å; A247-G260 WeakPolarHBondContact O-CA 2.85Å; A247-T261 PolarHBondContact O-N 3.13Å
248	T	90.9	Very high	83.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	158.3	175.7	75	0	0	0	0	112.5	I258 T261 F266 L298 I299 I300 D301	T248-I258 WeakPolarHBondContact O-CD1 3.48Å; T248-T261 WeakPolarHBondContact CA-O 3.33Å; T248-T261 HydrophobicContact CG2-CG2 4.45Å; T248-F266 HydrophobicContact CG2-CB 3.72Å; T248-F266 HydrophobicContact CG2-CD1 4.42Å; T248-F266 HydrophobicContact CG2-CD2 4.47Å; T248-F266 HydrophobicContact CG2-CG 3.95Å; T248-L298 HydrophobicContact CG2-CD1 3.68Å; T248-I299 CarbonylContact C-O 3.57Å; T248-I299 WeakPolarHBondContact CA-O 3.28Å; T248-I299 WeakPolarHBondContact CB-O 3.5Å; T248-I299 PolarHBondContact N-O 2.82Å; T248-I299 PolarHBondContact OG1-O 2.87Å; T248-I300 WeakPolarHBondContact O-CA 3.49Å; T248-D301 PolarHBondContact O-N 3.23Å
249	A	89.1	Confident	82.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	167.7	170	0	0	0	0	0	111.2	A254 A255 T261 T262 L263 D301	A249-A254 HydrophobicContact CB-CB 3.65Å; A249-A255 HydrophobicContact CB-CB 3.97Å; A249-T261 PolarHBondContact N-O 3.01Å; A249-T261 VanDerWaalsContact N-O 3.17Å; A249-T262 CarbonylContact O-C 3.45Å; A249-T262 WeakPolarHBondContact O-CA 3.41Å; A249-L263 PolarHBondContact O-N 3.34Å; A249-D301 VanDerWaalsContact CA-O 3.29Å; A249-D301 WeakPolarHBondContact CA-O 3.31Å; A249-D301 HydrophobicContact CB-CB 4.02Å
250	S	86.6	Confident	81.8	Confident	17 Å²	17	36.7 Å²	36.7	12%	0.119	23%	0.233	C	C	.	.	S	Bend	trans	-66.6	-37.1	176.3	50.5	0	0	0	0	113.4	D301 E302 M305	S250-D301 PolarHBondContact N-O 2.84Å; S250-E302 VanDerWaalsContact CB-O 3.26Å; S250-E302 WeakPolarHBondContact CB-O 3.4Å; S250-E302 VanDerWaalsContact OG-CB 3.31Å; S250-E302 WeakPolarHBondContact OG-CB 3.37Å; S250-E302 PolarHBondContact OG-O 2.9Å; S250-M305 WeakPolarHBondContact OG-CE 3.33Å
251	T	79.9	Confident	81.1	Confident	46 Å²	46	37.7 Å²	37.7	28%	0.282	24%	0.24	S	C	.	.	S	Bend	trans	-114	154.6	176.4	56.4	0	0	0	0	113.4	V253 A254 A255 M305	T251-V253 VanDerWaalsContact C-N 3.29Å; T251-V253 PolarHBondContact O-N 3.35Å; T251-A254 PolarHBondContact O-N 2.98Å; T251-A254 VanDerWaalsContact OG1-CB 3.32Å; T251-A254 WeakPolarHBondContact OG1-CB 3.33Å; T251-A254 PolarHBondContact OG1-N 3.19Å; T251-A255 WeakPolarHBondContact O-CB 3.47Å; T251-A255 PolarHBondContact O-N 3.38Å; T251-M305 HydrophobicContact CG2-CE 3.29Å; T251-M305 HydrophobicContact CG2-SD 4.23Å
252	G	68.6	Low	80.8	Confident	19 Å²	19	35.3 Å²	35.3	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-37.3	175.9	0	0	0	0	0	113	A255 C256	G252-A255 PolarHBondContact O-N 2.99Å; G252-C256 PolarHBondContact O-N 3.03Å; G252-C256 PolarHBondContact O-SG 3.14Å
253	V	70.6	Confident	81	Confident	31 Å²	31	29.8 Å²	29.8	19%	0.188	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-50.9	176.3	178	0	0	0	0	110.5	T251 A255 C256 H257	T251-V253 VanDerWaalsContact C-N 3.29Å; T251-V253 PolarHBondContact O-N 3.35Å; V253-A255 VanDerWaalsContact C-N 3.31Å; V253-A255 PolarHBondContact O-N 3.19Å; V253-C256 PolarHBondContact O-N 3.4Å; V253-H257 PolarHBondContact O-N 3.28Å; V253-H257 PolarHBondContact O-ND1 3.24Å
254	A	75.9	Confident	81	Confident	4 Å²	4	23.6 Å²	23.6	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-39.8	177.1	0	0	0	0	0	112	A249 T251 C256 H257 I258 E302	A249-A254 HydrophobicContact CB-CB 3.65Å; T251-A254 PolarHBondContact O-N 2.98Å; T251-A254 VanDerWaalsContact OG1-CB 3.32Å; T251-A254 WeakPolarHBondContact OG1-CB 3.33Å; T251-A254 PolarHBondContact OG1-N 3.19Å; A254-C256 PolarHBondContact O-N 2.77Å; A254-H257 WeakPolarHBondContact O-CB 3.31Å; A254-H257 PolarHBondContact O-N 3.09Å; A254-H257 VanDerWaalsContact O-N 3.12Å; A254-I258 PolarHBondContact O-N 3.24Å; A254-E302 HydrophobicContact CB-CB 4.48Å; A254-E302 HydrophobicContact CB-CG 3.94Å
255	A	74.4	Confident	80.5	Confident	2 Å²	2	23.5 Å²	23.5	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-44.7	176.7	0	0	0	0	0	111.7	A249 T251 G252 V253 H257 I258 G259 G260 T261	A249-A255 HydrophobicContact CB-CB 3.97Å; T251-A255 WeakPolarHBondContact O-CB 3.47Å; T251-A255 PolarHBondContact O-N 3.38Å; G252-A255 PolarHBondContact O-N 2.99Å; V253-A255 VanDerWaalsContact C-N 3.31Å; V253-A255 PolarHBondContact O-N 3.19Å; A255-H257 VanDerWaalsContact C-N 3.26Å; A255-H257 PolarHBondContact O-N 3.38Å; A255-I258 VanDerWaalsContact O-CG1 3.31Å; A255-I258 WeakPolarHBondContact O-CG1 3.5Å; A255-I258 PolarHBondContact O-N 3.05Å; A255-G259 PolarHBondContact O-N 3.15Å; A255-G259 VanDerWaalsContact O-N 3.1Å; A255-G260 PolarHBondContact O-N 2.68Å; A255-T261 VanDerWaalsContact CB-O 3.23Å; A255-T261 WeakPolarHBondContact CB-O 3.34Å
256	C	67.3	Low	80.2	Confident	42 Å²	42	22.8 Å²	22.8	28%	0.284	16%	0.157	S	C	.	.	H	α-helix	trans	-60	-35.5	175.7	-69.6	0	0	0	0	112.3	G252 V253 A254 I258 G259	G252-C256 PolarHBondContact O-N 3.03Å; G252-C256 PolarHBondContact O-SG 3.14Å; V253-C256 PolarHBondContact O-N 3.4Å; A254-C256 PolarHBondContact O-N 2.77Å; C256-I258 VanDerWaalsContact C-N 3.26Å; C256-I258 PolarHBondContact O-N 2.97Å; C256-G259 PolarHBondContact O-N 3.08Å; C256-G259 VanDerWaalsContact O-N 3.15Å
257	H	72.4	Confident	80	Confident	31 Å²	31	21.2 Å²	21.2	14%	0.144	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-31.3	-179.5	-79.1	83.3	0	0	0	113.4	K234 V253 A254 A255 N490	K234-H257 WeakPolarHBondContact CE-O 3.36Å; K234-H257 PolarHBondContact NZ-O 3.28Å; V253-H257 PolarHBondContact O-N 3.28Å; V253-H257 PolarHBondContact O-ND1 3.24Å; A254-H257 WeakPolarHBondContact O-CB 3.31Å; A254-H257 PolarHBondContact O-N 3.09Å; A254-H257 VanDerWaalsContact O-N 3.12Å; A255-H257 VanDerWaalsContact C-N 3.26Å; A255-H257 PolarHBondContact O-N 3.38Å; H257-N490 PolarHBondContact CD2-ND2 3Å; H257-N490 PolarHBondContact CE1-ND2 3.49Å; H257-N490 PolarHBondContact NE2-ND2 3.44Å
258	I	77.2	Confident	79.7	Confident	13 Å²	13	20.7 Å²	20.7	7%	0.067	15%	0.146	C	C	.	.	H	α-helix	trans	-100	2.2	177	64.7	172.1	0	0	0	113.1	L233 L237 A247 T248 A254 A255 C256 D301	L233-I258 HydrophobicContact CD1-CG2 4.18Å; L237-I258 HydrophobicContact CD1-CB 4.45Å; A247-I258 HydrophobicContact CB-CD1 3.99Å; A247-I258 HydrophobicContact CB-CG1 4.26Å; T248-I258 WeakPolarHBondContact O-CD1 3.48Å; A254-I258 PolarHBondContact O-N 3.24Å; A255-I258 VanDerWaalsContact O-CG1 3.31Å; A255-I258 WeakPolarHBondContact O-CG1 3.5Å; A255-I258 PolarHBondContact O-N 3.05Å; C256-I258 VanDerWaalsContact C-N 3.26Å; C256-I258 PolarHBondContact O-N 2.97Å; I258-D301 HydrophobicContact CD1-CB 4Å
259	G	70.1	Confident	79.3	Confident	72 Å²	72	20.8 Å²	20.8	74%	0.742	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.5	27.7	-178.4	0	0	0	0	0	114	A255 C256	A255-G259 PolarHBondContact O-N 3.15Å; A255-G259 VanDerWaalsContact O-N 3.1Å; C256-G259 PolarHBondContact O-N 3.08Å; C256-G259 VanDerWaalsContact O-N 3.15Å
260	G	77.3	Confident	78.8	Confident	25 Å²	25	23 Å²	23	26%	0.258	17%	0.169	S	C	.	.			trans	-110.3	-165.6	-177.8	0	0	0	0	0	114.6	A247 A255	A247-G260 CarbonylContact O-C 3.59Å; A247-G260 WeakPolarHBondContact O-CA 2.85Å; A255-G260 PolarHBondContact O-N 2.68Å
261	T	78.1	Confident	78.2	Confident	35 Å²	35	25.1 Å²	25.1	22%	0.215	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	174.3	172.9	-168.8	0	0	0	0	111	A247 T248 A249 A255 S265 F266	A247-T261 PolarHBondContact O-N 3.13Å; T248-T261 WeakPolarHBondContact CA-O 3.33Å; T248-T261 HydrophobicContact CG2-CG2 4.45Å; A249-T261 PolarHBondContact N-O 3.01Å; A249-T261 VanDerWaalsContact N-O 3.17Å; A255-T261 VanDerWaalsContact CB-O 3.23Å; A255-T261 WeakPolarHBondContact CB-O 3.34Å; T261-S265 WeakPolarHBondContact OG1-CB 3.48Å; T261-S265 PolarHBondContact OG1-OG 3.33Å; T261-F266 HydrophobicContact CG2-CB 3.99Å
262	T	84.8	Confident	78.1	Confident	12 Å²	12	23.3 Å²	23.3	7%	0.074	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	150.3	173.3	65.8	0	0	0	0	111.1	A249 H264 S265 F266	A249-T262 CarbonylContact O-C 3.45Å; A249-T262 WeakPolarHBondContact O-CA 3.41Å; T262-H264 PolarHBondContact O-N 2.87Å; T262-S265 PolarHBondContact O-N 2.75Å; T262-S265 VanDerWaalsContact O-N 3.1Å; T262-S265 VanDerWaalsContact OG1-CB 3.3Å; T262-S265 WeakPolarHBondContact OG1-CB 3.32Å; T262-S265 PolarHBondContact OG1-N 3.3Å; T262-F266 PolarHBondContact O-N 2.69Å
263	L	88.6	Confident	78.7	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-37.7	177.2	-176.4	58.9	0	0	0	111.9	A249 F266 A267 L298 I300 V306 F310 L314	A249-L263 PolarHBondContact O-N 3.34Å; L263-F266 HydrophobicContact CD1-CD1 4.38Å; L263-F266 PolarHBondContact O-N 3.32Å; L263-A267 VanDerWaalsContact O-CB 3.32Å; L263-A267 WeakPolarHBondContact O-CB 3.16Å; L263-A267 PolarHBondContact O-N 3.38Å; L263-L298 HydrophobicContact CD1-CD2 4.43Å; L263-I300 HydrophobicContact CD1-CD1 4.2Å; L263-I300 HydrophobicContact CD1-CG1 4.28Å; L263-I300 HydrophobicContact CD2-CD1 4.17Å; L263-I300 HydrophobicContact CD2-CG2 4.17Å; L263-V306 HydrophobicContact CD2-CG1 4.32Å; L263-V306 HydrophobicContact CD2-CG2 4.2Å; L263-F310 HydrophobicContact CD2-CE1 3.94Å; L263-F310 HydrophobicContact CG-CE1 4.06Å; L263-L314 HydrophobicContact CD1-CD1 4.04Å; L263-L314 HydrophobicContact CD2-CD1 3.7Å; L263-L314 HydrophobicContact CG-CD1 3.85Å
264	H	85.1	Confident	79.4	Confident	66 Å²	66	26.5 Å²	26.5	31%	0.306	20%	0.196	S	C	.	.	H	α-helix	trans	-62.8	-45.3	174.6	-63.9	89.3	0	0	0	112.8	T262 A267 G268 G270 F310	T262-H264 PolarHBondContact O-N 2.87Å; H264-A267 PolarHBondContact O-N 3.37Å; H264-G268 PolarHBondContact O-N 3.06Å; H264-G270 PolarHBondContact CD2-O 2.84Å; H264-F310 AromaticContact CD2-CE1 3.99Å; H264-F310 AromaticContact CD2-CE2 3.69Å; H264-F310 AromaticContact CD2-CZ 3.38Å; H264-F310 WeakPolarHBondContact CD2-CZ 3.44Å; H264-F310 AromaticContact CG-CZ 3.94Å; H264-F310 AromaticContact NE2-CE1 3.78Å; H264-F310 AromaticContact NE2-CE2 3.86Å; H264-F310 AromaticContact NE2-CZ 3.59Å
265	S	80.7	Confident	80.1	Confident	13 Å²	13	29.9 Å²	29.9	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-66.1	-38.9	177.9	162.6	0	0	0	0	111.8	T261 T262 K527	T261-S265 WeakPolarHBondContact OG1-CB 3.48Å; T261-S265 PolarHBondContact OG1-OG 3.33Å; T262-S265 PolarHBondContact O-N 2.75Å; T262-S265 VanDerWaalsContact O-N 3.1Å; T262-S265 VanDerWaalsContact OG1-CB 3.3Å; T262-S265 WeakPolarHBondContact OG1-CB 3.32Å; T262-S265 PolarHBondContact OG1-N 3.3Å; S265-K527 PolarHBondContact OG-O 2.94Å; S265-K527 VanDerWaalsContact OG-O 3.06Å
266	F	85.9	Confident	80.9	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.009	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-50.2	173	166.8	-99	0	0	0	111.8	F246 T248 T261 T262 L263 G268 H291 W292 C295 L298	F246-F266 HydrophobicContact CB-CD2 4.15Å; F246-F266 HydrophobicContact CB-CE2 3.94Å; F246-F266 AromaticContact CD1-CD2 3.72Å; F246-F266 HydrophobicContact CD1-CD2 3.72Å; F246-F266 AromaticContact CD1-CE2 3.65Å; F246-F266 HydrophobicContact CD1-CE2 3.65Å; F246-F266 HydrophobicContact CD2-CE2 4.26Å; F246-F266 HydrophobicContact CE1-CD2 4.38Å; F246-F266 HydrophobicContact CE1-CE2 4.18Å; F246-F266 HydrophobicContact CG-CD2 4.08Å; F246-F266 AromaticContact CG-CE2 3.69Å; F246-F266 HydrophobicContact CG-CE2 3.69Å; T248-F266 HydrophobicContact CG2-CB 3.72Å; T248-F266 HydrophobicContact CG2-CD1 4.42Å; T248-F266 HydrophobicContact CG2-CD2 4.47Å; T248-F266 HydrophobicContact CG2-CG 3.95Å; T261-F266 HydrophobicContact CG2-CB 3.99Å; T262-F266 PolarHBondContact O-N 2.69Å; L263-F266 HydrophobicContact CD1-CD1 4.38Å; L263-F266 PolarHBondContact O-N 3.32Å; F266-G268 VanDerWaalsContact C-N 3.31Å; F266-G268 PolarHBondContact O-N 2.84Å; F266-H291 HydrophobicContact CD2-CB 4.46Å; F266-H291 HydrophobicContact CE2-CB 4.13Å; F266-W292 HydrophobicContact CE1-CD2 4.39Å; F266-W292 HydrophobicContact CE1-CE3 4.22Å; F266-W292 AromaticContact CE1-CH2 3.94Å; F266-W292 HydrophobicContact CE1-CH2 3.94Å; F266-W292 HydrophobicContact CE1-CZ2 4.1Å; F266-W292 AromaticContact CE1-CZ3 3.99Å; F266-W292 HydrophobicContact CE1-CZ3 3.99Å; F266-W292 HydrophobicContact CZ-CD2 4.46Å; F266-W292 HydrophobicContact CZ-CE3 4.31Å; F266-W292 HydrophobicContact CZ-CZ3 4.47Å; F266-C295 HydrophobicContact CE2-CB 4.4Å; F266-C295 HydrophobicContact CZ-CB 4.18Å; F266-L298 HydrophobicContact CD1-CD1 3.94Å; F266-L298 HydrophobicContact CD1-CD2 4.48Å; F266-L298 HydrophobicContact CE1-CD1 3.73Å; F266-L298 HydrophobicContact CE1-CD2 3.9Å; F266-L298 HydrophobicContact CE1-CG 4.46Å; F266-L298 HydrophobicContact CE2-CD1 4.39Å; F266-L298 HydrophobicContact CG-CD1 4.37Å; F266-L298 HydrophobicContact CZ-CD1 3.97Å
267	A	87	Confident	82	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-33.5	-175.7	0	0	0	0	0	112.9	L263 H264 I269 V288 W292 L314	L263-A267 VanDerWaalsContact O-CB 3.32Å; L263-A267 WeakPolarHBondContact O-CB 3.16Å; L263-A267 PolarHBondContact O-N 3.38Å; H264-A267 PolarHBondContact O-N 3.37Å; A267-I269 VanDerWaalsContact C-N 3.28Å; A267-I269 HydrophobicContact CB-CD1 4.46Å; A267-I269 HydrophobicContact CB-CG1 4.02Å; A267-I269 PolarHBondContact O-N 2.91Å; A267-V288 WeakPolarHBondContact O-CG1 3.29Å; A267-W292 HydrophobicContact CB-CZ2 3.9Å; A267-W292 PolarHBondContact O-NE1 2.95Å; A267-W292 VanDerWaalsContact O-NE1 3.09Å; A267-L314 HydrophobicContact CB-CD2 3.36Å
268	G	82.3	Confident	82.8	Confident	3 Å²	3	42 Å²	42	3%	0.031	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	18.2	177.5	0	0	0	0	0	114.8	H264 F266	H264-G268 PolarHBondContact O-N 3.06Å; F266-G268 VanDerWaalsContact C-N 3.31Å; F266-G268 PolarHBondContact O-N 2.84Å
269	I	83.1	Confident	83.4	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.015	27%	0.269	C	S	.	.	S	Bend	trans	-103.8	17.2	-176.3	65.8	173.2	0	0	0	113.7	A267 G272 C279 A283 F310 L314	A267-I269 VanDerWaalsContact C-N 3.28Å; A267-I269 HydrophobicContact CB-CD1 4.46Å; A267-I269 HydrophobicContact CB-CG1 4.02Å; A267-I269 PolarHBondContact O-N 2.91Å; I269-G272 PolarHBondContact O-N 2.94Å; I269-C279 HydrophobicContact CB-CB 4.13Å; I269-C279 HydrophobicContact CD1-CB 4.46Å; I269-C279 HydrophobicContact CG2-CB 4.05Å; I269-C279 VanDerWaalsContact CG2-O 3.26Å; I269-C279 WeakPolarHBondContact CG2-O 3.37Å; I269-A283 HydrophobicContact CG2-CB 4.13Å; I269-F310 HydrophobicContact CD1-CE2 3.79Å; I269-F310 HydrophobicContact CD1-CZ 4.48Å; I269-F310 HydrophobicContact CG1-CE2 4.12Å; I269-L314 HydrophobicContact CD1-CD2 3.85Å
270	G	78.1	Confident	84.4	Confident	46 Å²	46	39 Å²	39	47%	0.474	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	-137.6	-177.3	0	0	0	0	0	112.7	H264 G272	H264-G270 PolarHBondContact CD2-O 2.84Å; G270-G272 PolarHBondContact O-N 3.13Å
271	S	75.9	Confident	84.9	Confident	62 Å²	62	43.9 Å²	43.9	43%	0.434	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-10	175.9	55.8	0	0	0	0	113.8	S273	S271-S273 PolarHBondContact O-N 2.93Å; S271-S273 PolarHBondContact OG-N 3.39Å; S271-S273 PolarHBondContact OG-OG 3.14Å
272	G	77.5	Confident	85.2	Confident	7 Å²	7	44.3 Å²	44.3	7%	0.072	26%	0.257	C	S	.	.	S	Bend	trans	65.4	16.7	-173.5	0	0	0	0	0	114.1	I269 G270 K313	I269-G272 PolarHBondContact O-N 2.94Å; G270-G272 PolarHBondContact O-N 3.13Å; G272-K313 WeakPolarHBondContact O-CD 3.36Å; G272-K313 WeakPolarHBondContact O-CE 3.22Å; G272-K313 PolarHBondContact O-NZ 3.28Å
273	S	81.6	Confident	85.4	Confident	94 Å²	94	43.8 Å²	43.8	66%	0.657	25%	0.253	S	S	*	.			trans	-80.1	-24.9	176.3	55	0	0	0	0	113	S271	S271-S273 PolarHBondContact O-N 2.93Å; S271-S273 PolarHBondContact OG-N 3.39Å; S271-S273 PolarHBondContact OG-OG 3.14Å
274	A	84.7	Confident	85.3	Confident	24 Å²	24	48.6 Å²	48.6	20%	0.198	28%	0.276	C	S	.	.	S	Bend	trans	-62.6	157.5	179.3	0	0	0	0	0	112.8	Q278 K313	A274-Q278 HydrophobicContact CB-CB 4.15Å; A274-K313 PolarHBondContact O-NZ 2.93Å
275	P	90.4	Very high	85.3	Confident	75 Å²	75	51.8 Å²	51.8	49%	0.487	29%	0.285	S	S	.	.			trans	-53.8	155	171.7	-25.2	34.5	0	0	0	112.7	E277 Q278 C279	P275-E277 VanDerWaalsContact C-N 3.28Å; P275-E277 PolarHBondContact O-N 3.29Å; P275-Q278 PolarHBondContact O-N 3.3Å; P275-C279 PolarHBondContact O-N 2.88Å; P275-C279 VanDerWaalsContact O-N 3.07Å
276	L	90.1	Very high	85.3	Confident	73 Å²	73	56.5 Å²	56.5	38%	0.382	32%	0.315	S	S	.	.	H	α-helix	trans	-55.8	-42.5	-175.8	177.3	62.9	0	0	0	112.3	Q278 C279 V280 K313 V317	L276-Q278 PolarHBondContact O-N 3.28Å; L276-C279 WeakPolarHBondContact O-CB 3.48Å; L276-C279 PolarHBondContact O-N 2.94Å; L276-C279 VanDerWaalsContact O-N 3.15Å; L276-V280 HydrophobicContact CD1-CG2 4.2Å; L276-V280 HydrophobicContact CG-CG2 4.38Å; L276-V280 WeakPolarHBondContact O-CG2 3.32Å; L276-V280 PolarHBondContact O-N 3.45Å; L276-K313 HydrophobicContact CD1-CG 4.15Å; L276-V317 HydrophobicContact CD1-CG2 3.9Å
277	E	90.6	Very high	84.8	Confident	154 Å²	154	57.2 Å²	57.2	72%	0.72	32%	0.322	S	S	*	.	H	α-helix	trans	-57.1	-51.1	-179.8	-68.7	162.9	-172.3	0	0	111.5	P275 C279 V280 E281	P275-E277 VanDerWaalsContact C-N 3.28Å; P275-E277 PolarHBondContact O-N 3.29Å; E277-C279 VanDerWaalsContact C-N 3.32Å; E277-C279 PolarHBondContact O-N 3.03Å; E277-V280 WeakPolarHBondContact O-CB 3.26Å; E277-V280 PolarHBondContact O-N 3.26Å; E277-V280 VanDerWaalsContact O-N 3.08Å; E277-E281 PolarHBondContact O-N 3.38Å
278	Q	89.6	Confident	84.6	Confident	102 Å²	102	57.4 Å²	57.4	48%	0.477	32%	0.323	S	S	.	.	H	α-helix	trans	-61.6	-39.9	176	-65.3	-179	11	0	0	111.7	A274 P275 L276 V280 E281 L282	A274-Q278 HydrophobicContact CB-CB 4.15Å; P275-Q278 PolarHBondContact O-N 3.3Å; L276-Q278 PolarHBondContact O-N 3.28Å; Q278-V280 VanDerWaalsContact C-N 3.31Å; Q278-V280 PolarHBondContact O-N 3.38Å; Q278-E281 PolarHBondContact O-N 2.86Å; Q278-L282 VanDerWaalsContact O-CG 3.27Å; Q278-L282 WeakPolarHBondContact O-CG 2.98Å; Q278-L282 PolarHBondContact O-N 3Å
279	C	89.9	Confident	84.8	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-36.7	175.1	-70.9	0	0	0	0	112.5	I269 P275 L276 E277 L282 A283 K313 V317	I269-C279 HydrophobicContact CB-CB 4.13Å; I269-C279 HydrophobicContact CD1-CB 4.46Å; I269-C279 HydrophobicContact CG2-CB 4.05Å; I269-C279 VanDerWaalsContact CG2-O 3.26Å; I269-C279 WeakPolarHBondContact CG2-O 3.37Å; P275-C279 PolarHBondContact O-N 2.88Å; P275-C279 VanDerWaalsContact O-N 3.07Å; L276-C279 WeakPolarHBondContact O-CB 3.48Å; L276-C279 PolarHBondContact O-N 2.94Å; L276-C279 VanDerWaalsContact O-N 3.15Å; E277-C279 VanDerWaalsContact C-N 3.32Å; E277-C279 PolarHBondContact O-N 3.03Å; C279-L282 PolarHBondContact O-N 3.31Å; C279-A283 WeakPolarHBondContact O-CB 3.2Å; C279-A283 PolarHBondContact O-N 3.06Å; C279-K313 HydrophobicContact CB-CD 4.36Å; C279-V317 HydrophobicContact CB-CG2 4.04Å
280	V	90.6	Very high	85	Confident	21 Å²	21	66.1 Å²	66.1	13%	0.127	36%	0.364	C	S	.	.	H	α-helix	trans	-66.7	-43.9	174.9	172.5	0	0	0	0	110.5	L276 E277 Q278 L282 A283 Q284 V317	L276-V280 HydrophobicContact CD1-CG2 4.2Å; L276-V280 HydrophobicContact CG-CG2 4.38Å; L276-V280 WeakPolarHBondContact O-CG2 3.32Å; L276-V280 PolarHBondContact O-N 3.45Å; E277-V280 WeakPolarHBondContact O-CB 3.26Å; E277-V280 PolarHBondContact O-N 3.26Å; E277-V280 VanDerWaalsContact O-N 3.08Å; Q278-V280 VanDerWaalsContact C-N 3.31Å; Q278-V280 PolarHBondContact O-N 3.38Å; V280-L282 VanDerWaalsContact C-N 3.34Å; V280-L282 PolarHBondContact O-N 3.41Å; V280-A283 CarbonylContact O-C 3.52Å; V280-A283 PolarHBondContact O-N 3.18Å; V280-A283 VanDerWaalsContact O-N 3.12Å; V280-Q284 HydrophobicContact CG1-CG 4.37Å; V280-Q284 WeakPolarHBondContact O-CG 3.31Å; V280-Q284 PolarHBondContact O-N 3.39Å; V280-V317 HydrophobicContact CG2-CG2 4.05Å
281	E	88.1	Confident	85.3	Confident	129 Å²	129	65.1 Å²	65.1	60%	0.603	35%	0.348	S	S	*	.	H	α-helix	trans	-58.1	-45.1	174.8	-70.6	177	175.9	0	0	112	E277 Q278 A283 Q284	E277-E281 PolarHBondContact O-N 3.38Å; Q278-E281 PolarHBondContact O-N 2.86Å; E281-A283 VanDerWaalsContact C-N 3.3Å; E281-A283 PolarHBondContact O-N 3.16Å; E281-Q284 PolarHBondContact O-N 2.94Å
282	L	85.5	Confident	86	Confident	44 Å²	44	62.2 Å²	62.2	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-40.7	175	-69.2	176.4	0	0	0	111.9	Q278 C279 V280 Q284 R285	Q278-L282 VanDerWaalsContact O-CG 3.27Å; Q278-L282 WeakPolarHBondContact O-CG 2.98Å; Q278-L282 PolarHBondContact O-N 3Å; C279-L282 PolarHBondContact O-N 3.31Å; V280-L282 VanDerWaalsContact C-N 3.34Å; V280-L282 PolarHBondContact O-N 3.41Å; L282-Q284 VanDerWaalsContact C-N 3.3Å; L282-Q284 PolarHBondContact O-N 3.21Å; L282-R285 WeakPolarHBondContact O-CB 3.45Å; L282-R285 WeakPolarHBondContact O-CD 3.34Å; L282-R285 VanDerWaalsContact O-CG 3.31Å; L282-R285 WeakPolarHBondContact O-CG 3.43Å; L282-R285 PolarHBondContact O-N 2.79Å
283	A	87.4	Confident	86.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-73	-21	178.9	0	0	0	0	0	113.6	I269 C279 V280 E281 R285 V288 L289 V317 V321	I269-A283 HydrophobicContact CG2-CB 4.13Å; C279-A283 WeakPolarHBondContact O-CB 3.2Å; C279-A283 PolarHBondContact O-N 3.06Å; V280-A283 CarbonylContact O-C 3.52Å; V280-A283 PolarHBondContact O-N 3.18Å; V280-A283 VanDerWaalsContact O-N 3.12Å; E281-A283 VanDerWaalsContact C-N 3.3Å; E281-A283 PolarHBondContact O-N 3.16Å; A283-R285 VanDerWaalsContact C-N 3.31Å; A283-V288 HydrophobicContact CB-CG1 4.44Å; A283-V288 CarbonylContact O-C 3.54Å; A283-L289 WeakPolarHBondContact O-CA 3.44Å; A283-L289 PolarHBondContact O-N 2.82Å; A283-L289 VanDerWaalsContact O-N 3.13Å; A283-V317 HydrophobicContact CB-CG1 3.49Å; A283-V317 VanDerWaalsContact CB-CG1 3.49Å; A283-V321 HydrophobicContact CB-CG2 3.75Å
284	Q	87.6	Confident	87.2	Confident	103 Å²	103	63 Å²	63	48%	0.481	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.8	175.9	-76.5	-179.8	3.7	0	0	113.9	V280 E281 L282	V280-Q284 HydrophobicContact CG1-CG 4.37Å; V280-Q284 WeakPolarHBondContact O-CG 3.31Å; V280-Q284 PolarHBondContact O-N 3.39Å; E281-Q284 PolarHBondContact O-N 2.94Å; L282-Q284 VanDerWaalsContact C-N 3.3Å; L282-Q284 PolarHBondContact O-N 3.21Å
285	R	85.3	Confident	87.6	Confident	132 Å²	132	61.8 Å²	61.8	50%	0.498	32%	0.319	S	S	.	.	S	Bend	trans	-54.3	136.2	173.8	-68.9	176	177.3	-176.7	-2.6	110.3	L282 A283 A287 V288 L289	L282-R285 WeakPolarHBondContact O-CB 3.45Å; L282-R285 WeakPolarHBondContact O-CD 3.34Å; L282-R285 VanDerWaalsContact O-CG 3.31Å; L282-R285 WeakPolarHBondContact O-CG 3.43Å; L282-R285 PolarHBondContact O-N 2.79Å; A283-R285 VanDerWaalsContact C-N 3.31Å; R285-A287 VanDerWaalsContact C-N 3.32Å; R285-A287 PolarHBondContact O-N 3.17Å; R285-V288 HydrophobicContact CB-CG2 4.43Å; R285-V288 PolarHBondContact O-N 3.36Å; R285-L289 WeakPolarHBondContact O-CB 3.46Å; R285-L289 PolarHBondContact O-N 2.9Å
286	P	79.1	Confident	87.9	Confident	112 Å²	112	66.5 Å²	66.5	73%	0.727	33%	0.327	S	S	*	.	H	α-helix	trans	-48.8	-45.1	-164.6	-31.4	34	0	0	0	115.5	Q290	P286-Q290 WeakPolarHBondContact O-CB 3.36Å; P286-Q290 PolarHBondContact O-N 2.96Å
287	A	76.4	Confident	88.2	Confident	18 Å²	18	64.1 Å²	64.1	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-72.2	-36.8	179.8	0	0	0	0	0	114.2	R285 Q290 H291 G530 G531	R285-A287 VanDerWaalsContact C-N 3.32Å; R285-A287 PolarHBondContact O-N 3.17Å; A287-Q290 PolarHBondContact O-N 2.79Å; A287-H291 PolarHBondContact O-N 2.65Å; A287-G530 WeakPolarHBondContact CB-O 3.08Å; A287-G531 VanDerWaalsContact CB-N 3.35Å
288	V	82.3	Confident	88.5	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-73.9	-40.6	178.9	-177.1	0	0	0	0	109.6	A267 A283 R285 Q290 H291 W292	A267-V288 WeakPolarHBondContact O-CG1 3.29Å; A283-V288 HydrophobicContact CB-CG1 4.44Å; A283-V288 CarbonylContact O-C 3.54Å; R285-V288 HydrophobicContact CB-CG2 4.43Å; R285-V288 PolarHBondContact O-N 3.36Å; V288-Q290 VanDerWaalsContact C-N 3.28Å; V288-Q290 PolarHBondContact O-N 2.78Å; V288-H291 WeakPolarHBondContact O-CB 3.43Å; V288-H291 PolarHBondContact O-N 2.91Å; V288-W292 PolarHBondContact O-N 2.75Å
289	L	87.8	Confident	88.8	Confident	59 Å²	59	52 Å²	52	31%	0.309	26%	0.257	S	S	.	.	H	α-helix	trans	-56.8	-43	172.2	178	61.7	0	0	0	111.2	A283 R285 H291 W292 T293 V321	A283-L289 WeakPolarHBondContact O-CA 3.44Å; A283-L289 PolarHBondContact O-N 2.82Å; A283-L289 VanDerWaalsContact O-N 3.13Å; R285-L289 WeakPolarHBondContact O-CB 3.46Å; R285-L289 PolarHBondContact O-N 2.9Å; L289-H291 VanDerWaalsContact C-N 3.31Å; L289-H291 PolarHBondContact O-N 2.82Å; L289-W292 PolarHBondContact O-N 3.38Å; L289-T293 HydrophobicContact CD1-CG2 3.87Å; L289-T293 HydrophobicContact CG-CG2 4.32Å; L289-T293 WeakPolarHBondContact O-CB 3.48Å; L289-T293 VanDerWaalsContact O-CG2 3.31Å; L289-T293 WeakPolarHBondContact O-CG2 3.39Å; L289-T293 PolarHBondContact O-N 2.92Å; L289-T293 PolarHBondContact O-OG1 3.37Å; L289-V321 HydrophobicContact CD1-CG1 3.38Å
290	Q	85.5	Confident	89	Confident	130 Å²	130	52 Å²	52	61%	0.607	26%	0.257	S	S	*	.	H	α-helix	trans	-61.5	-38.8	175.5	-167.4	-177.3	4.3	0	0	112	P286 A287 V288 T293 S294	P286-Q290 WeakPolarHBondContact O-CB 3.36Å; P286-Q290 PolarHBondContact O-N 2.96Å; A287-Q290 PolarHBondContact O-N 2.79Å; V288-Q290 VanDerWaalsContact C-N 3.28Å; V288-Q290 PolarHBondContact O-N 2.78Å; Q290-T293 WeakPolarHBondContact CA-OG1 3.49Å; Q290-T293 PolarHBondContact O-OG1 3.33Å; Q290-S294 WeakPolarHBondContact O-CB 3.33Å; Q290-S294 PolarHBondContact O-N 3.48Å; Q290-S294 PolarHBondContact O-OG 2.91Å
291	H	85.4	Confident	89.1	Confident	26 Å²	26	51 Å²	51	12%	0.12	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-50.9	174.7	-65.3	168.7	0	0	0	111.3	F246 F266 A287 V288 L289 T293 S294 C295	F246-H291 HydrophobicContact CE1-CB 4.31Å; F246-H291 HydrophobicContact CZ-CB 4.49Å; F266-H291 HydrophobicContact CD2-CB 4.46Å; F266-H291 HydrophobicContact CE2-CB 4.13Å; A287-H291 PolarHBondContact O-N 2.65Å; V288-H291 WeakPolarHBondContact O-CB 3.43Å; V288-H291 PolarHBondContact O-N 2.91Å; L289-H291 VanDerWaalsContact C-N 3.31Å; L289-H291 PolarHBondContact O-N 2.82Å; H291-T293 PolarHBondContact O-N 3.2Å; H291-S294 PolarHBondContact O-OG 2.81Å; H291-C295 WeakPolarHBondContact O-CB 3.43Å; H291-C295 PolarHBondContact O-N 2.8Å
292	W	91.1	Very high	89.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-40.9	-179.9	-78.8	110.3	0	0	0	113.1	F266 A267 V288 L289 L314 V317 A318 V321 R322 F328 I331	F266-W292 HydrophobicContact CE1-CD2 4.39Å; F266-W292 HydrophobicContact CE1-CE3 4.22Å; F266-W292 AromaticContact CE1-CH2 3.94Å; F266-W292 HydrophobicContact CE1-CH2 3.94Å; F266-W292 HydrophobicContact CE1-CZ2 4.1Å; F266-W292 AromaticContact CE1-CZ3 3.99Å; F266-W292 HydrophobicContact CE1-CZ3 3.99Å; F266-W292 HydrophobicContact CZ-CD2 4.46Å; F266-W292 HydrophobicContact CZ-CE3 4.31Å; F266-W292 HydrophobicContact CZ-CZ3 4.47Å; A267-W292 HydrophobicContact CB-CZ2 3.9Å; A267-W292 PolarHBondContact O-NE1 2.95Å; A267-W292 VanDerWaalsContact O-NE1 3.09Å; V288-W292 PolarHBondContact O-N 2.75Å; L289-W292 PolarHBondContact O-N 3.38Å; W292-L314 HydrophobicContact CH2-CD2 4.18Å; W292-L314 HydrophobicContact CZ2-CD2 4.13Å; W292-V317 HydrophobicContact CZ2-CG1 4.24Å; W292-A318 HydrophobicContact CE3-CB 4Å; W292-A318 HydrophobicContact CH2-CB 4.18Å; W292-A318 HydrophobicContact CZ3-CB 3.5Å; W292-V321 HydrophobicContact CB-CG1 3.67Å; W292-V321 HydrophobicContact CG-CG1 4.17Å; W292-R322 PolarHBondContact O-NH1 2.91Å; W292-F328 HydrophobicContact CH2-CE1 4.11Å; W292-F328 HydrophobicContact CH2-CZ 4.4Å; W292-F328 HydrophobicContact CZ3-CD1 4.41Å; W292-F328 AromaticContact CZ3-CE1 3.76Å; W292-F328 HydrophobicContact CZ3-CE1 3.76Å; W292-F328 HydrophobicContact CZ3-CZ 4.47Å; W292-I331 HydrophobicContact CE3-CD1 3.93Å; W292-I331 HydrophobicContact CZ3-CD1 4.08Å
293	T	91.6	Very high	89.7	Confident	70 Å²	70	43.1 Å²	43.1	43%	0.429	21%	0.213	S	C	.	.	H	α-helix	trans	-75.2	-39.9	-178.3	51.9	0	0	0	0	112.8	L289 Q290 H291 R322	L289-T293 HydrophobicContact CD1-CG2 3.87Å; L289-T293 HydrophobicContact CG-CG2 4.32Å; L289-T293 WeakPolarHBondContact O-CB 3.48Å; L289-T293 VanDerWaalsContact O-CG2 3.31Å; L289-T293 WeakPolarHBondContact O-CG2 3.39Å; L289-T293 PolarHBondContact O-N 2.92Å; L289-T293 PolarHBondContact O-OG1 3.37Å; Q290-T293 WeakPolarHBondContact CA-OG1 3.49Å; Q290-T293 PolarHBondContact O-OG1 3.33Å; H291-T293 PolarHBondContact O-N 3.2Å; T293-R322 PolarHBondContact O-NH1 3.17Å
294	S	91.7	Very high	90	Very high	47 Å²	47	43.1 Å²	43.1	33%	0.329	21%	0.213	S	C	.	.	H	α-helix	trans	-78.1	-19.8	178.6	66.2	0	0	0	0	114.2	Q290 H291 R296	Q290-S294 WeakPolarHBondContact O-CB 3.33Å; Q290-S294 PolarHBondContact O-N 3.48Å; Q290-S294 PolarHBondContact O-OG 2.91Å; H291-S294 PolarHBondContact O-OG 2.81Å; S294-R296 PolarHBondContact O-N 3Å
295	C	94	Very high	90.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.			trans	-67.4	122.6	177.9	-170.8	0	0	0	0	111.2	F246 F266 H291 H297 R322 I331	F246-C295 HydrophobicContact CD2-CB 3.65Å; F246-C295 VanDerWaalsContact CD2-SG 3.53Å; F246-C295 HydrophobicContact CE2-CB 3.76Å; F266-C295 HydrophobicContact CE2-CB 4.4Å; F266-C295 HydrophobicContact CZ-CB 4.18Å; H291-C295 WeakPolarHBondContact O-CB 3.43Å; H291-C295 PolarHBondContact O-N 2.8Å; C295-H297 PolarHBondContact SG-O 2.99Å; C295-R322 PolarHBondContact O-NH1 3.44Å; C295-I331 HydrophobicContact CB-CD1 4.23Å
296	R	95.7	Very high	90.4	Very high	174 Å²	174	33.5 Å²	33.5	66%	0.657	17%	0.174	S	C	*	.	S	Bend	trans	-109.9	-28.9	169.1	-68.5	-173.7	177.7	178.5	-2.6	112.2	S244 S294 Q332	S244-R296 PolarHBondContact O-N 3.35Å; S294-R296 PolarHBondContact O-N 3Å; R296-Q332 WeakPolarHBondContact O-CB 3.32Å; R296-Q332 PolarHBondContact O-N 3.11Å
297	H	96.6	Very high	91	Very high	23 Å²	23	30.2 Å²	30.2	11%	0.106	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.2	-179.5	-36.2	73.8	0	0	0	108	L240 P241 S244 T245 F246 C295 Q332 I334	L240-H297 HydrophobicContact CD1-CB 4.22Å; P241-H297 VanDerWaalsContact CG-CE1 3.49Å; P241-H297 WeakPolarHBondContact CG-CE1 3.41Å; S244-H297 PolarHBondContact O-N 3.12Å; S244-H297 VanDerWaalsContact O-N 3.07Å; S244-H297 PolarHBondContact O-ND1 2.98Å; T245-H297 WeakPolarHBondContact CA-O 3.39Å; T245-H297 HydrophobicContact CG2-CB 4.13Å; T245-H297 PolarHBondContact OG1-ND1 3.35Å; F246-H297 PolarHBondContact N-O 3.39Å; C295-H297 PolarHBondContact SG-O 2.99Å; H297-Q332 WeakPolarHBondContact CA-O 3.4Å; H297-Q332 PolarHBondContact CD2-OE1 2.8Å; H297-I334 HydrophobicContact CB-CD1 4.4Å
298	L	96.6	Very high	91.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.1	175.8	178.1	63.8	0	0	0	109.2	F246 T248 L263 F266 I300 F328 I331 Q332 L333 I334	F246-L298 HydrophobicContact CB-CD1 4.2Å; T248-L298 HydrophobicContact CG2-CD1 3.68Å; L263-L298 HydrophobicContact CD1-CD2 4.43Å; F266-L298 HydrophobicContact CD1-CD1 3.94Å; F266-L298 HydrophobicContact CD1-CD2 4.48Å; F266-L298 HydrophobicContact CE1-CD1 3.73Å; F266-L298 HydrophobicContact CE1-CD2 3.9Å; F266-L298 HydrophobicContact CE1-CG 4.46Å; F266-L298 HydrophobicContact CE2-CD1 4.39Å; F266-L298 HydrophobicContact CG-CD1 4.37Å; F266-L298 HydrophobicContact CZ-CD1 3.97Å; L298-I300 HydrophobicContact CD2-CD1 4.32Å; L298-I300 HydrophobicContact CD2-CG1 4.47Å; L298-I300 HydrophobicContact CG-CG1 4.18Å; L298-F328 HydrophobicContact CD2-CE1 3.56Å; L298-F328 HydrophobicContact CD2-CZ 3.99Å; L298-I331 HydrophobicContact CB-CG2 3.72Å; L298-Q332 PolarHBondContact N-O 2.96Å; L298-L333 HydrophobicContact CB-CD2 3.75Å; L298-L333 HydrophobicContact CD2-CD2 3.87Å; L298-L333 HydrophobicContact CG-CD2 4.13Å; L298-I334 PolarHBondContact O-N 3.07Å
299	I	96	Very high	92.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.4	176.1	-54.6	-169.6	0	0	0	108.9	L233 I236 L237 T245 F246 T248 I334	L233-I299 HydrophobicContact CD1-CG2 3.95Å; L233-I299 HydrophobicContact CD2-CG2 3.52Å; L233-I299 HydrophobicContact CG-CG2 4.35Å; I236-I299 HydrophobicContact CG2-CD1 4.31Å; L237-I299 HydrophobicContact CD1-CD1 4.46Å; L237-I299 HydrophobicContact CD2-CD1 3.48Å; L237-I299 VanDerWaalsContact CD2-CD1 3.48Å; L237-I299 HydrophobicContact CG-CD1 3.63Å; T245-I299 HydrophobicContact CG2-CD1 4.23Å; T245-I299 HydrophobicContact CG2-CG1 4.45Å; F246-I299 PolarHBondContact O-N 3.12Å; T248-I299 CarbonylContact C-O 3.57Å; T248-I299 WeakPolarHBondContact CA-O 3.28Å; T248-I299 WeakPolarHBondContact CB-O 3.5Å; T248-I299 PolarHBondContact N-O 2.82Å; T248-I299 PolarHBondContact OG1-O 2.87Å; I299-I334 CarbonylContact C-O 3.52Å; I299-I334 VanDerWaalsContact CA-O 3.24Å; I299-I334 WeakPolarHBondContact CA-O 3.46Å; I299-I334 HydrophobicContact CD1-CD1 4.41Å; I299-I334 HydrophobicContact CG1-CB 4.14Å; I299-I334 HydrophobicContact CG1-CD1 4.02Å
300	I	95.6	Very high	92.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	104.6	176.9	-52.6	176.4	0	0	0	108.7	T248 L263 L298 V303 F311 I334 V335 C336	T248-I300 WeakPolarHBondContact O-CA 3.49Å; L263-I300 HydrophobicContact CD1-CD1 4.2Å; L263-I300 HydrophobicContact CD1-CG1 4.28Å; L263-I300 HydrophobicContact CD2-CD1 4.17Å; L263-I300 HydrophobicContact CD2-CG2 4.17Å; L298-I300 HydrophobicContact CD2-CD1 4.32Å; L298-I300 HydrophobicContact CD2-CG1 4.47Å; L298-I300 HydrophobicContact CG-CG1 4.18Å; I300-V303 HydrophobicContact CG2-CB 4.36Å; I300-V303 HydrophobicContact CG2-CG2 4.35Å; I300-F311 HydrophobicContact CD1-CE2 4.47Å; I300-I334 PolarHBondContact N-O 3.38Å; I300-V335 HydrophobicContact CB-CG1 4.4Å; I300-V335 HydrophobicContact CB-CG2 4.46Å; I300-V335 HydrophobicContact CD1-CG2 4.38Å; I300-C336 PolarHBondContact O-N 3.44Å
301	D	92.8	Very high	92.9	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.011	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	154.1	171.7	-160.8	6.4	0	0	0	111.7	S230 L233 T248 A249 S250 I258 V303 C336	S230-D301 PolarHBondContact OG-OD2 2.91Å; L233-D301 HydrophobicContact CD1-CB 3.65Å; T248-D301 PolarHBondContact O-N 3.23Å; A249-D301 VanDerWaalsContact CA-O 3.29Å; A249-D301 WeakPolarHBondContact CA-O 3.31Å; A249-D301 HydrophobicContact CB-CB 4.02Å; S250-D301 PolarHBondContact N-O 2.84Å; I258-D301 HydrophobicContact CD1-CB 4Å; D301-V303 VanDerWaalsContact C-N 3.33Å; D301-V303 PolarHBondContact O-N 2.78Å; D301-C336 CarbonylContact C-O 3.58Å; D301-C336 PolarHBondContact OD1-SG 3.49Å
302	E	91.8	Very high	93.4	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.028	14%	0.135	C	C	.	.			trans	50	49.4	-176.9	-59.4	-66.5	-177.9	0	0	112.8	S250 A254 S304 M305 C336 Q553	S250-E302 VanDerWaalsContact CB-O 3.26Å; S250-E302 WeakPolarHBondContact CB-O 3.4Å; S250-E302 VanDerWaalsContact OG-CB 3.31Å; S250-E302 WeakPolarHBondContact OG-CB 3.37Å; S250-E302 PolarHBondContact OG-O 2.9Å; A254-E302 HydrophobicContact CB-CB 4.48Å; A254-E302 HydrophobicContact CB-CG 3.94Å; E302-S304 PolarHBondContact O-N 3.31Å; E302-M305 HydrophobicContact CB-CE 4.42Å; E302-M305 PolarHBondContact O-N 2.89Å; E302-C336 PolarHBondContact N-O 2.95Å; E302-Q553 PolarHBondContact OE2-NE2 2.8Å
303	V	94.1	Very high	93.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-60.9	-14.3	-179.5	73.2	0	0	0	0	114	F220 I300 D301 M305 V306 V335 C336 F339 C355 W361	F220-V303 HydrophobicContact CE2-CG1 3.9Å; I300-V303 HydrophobicContact CG2-CB 4.36Å; I300-V303 HydrophobicContact CG2-CG2 4.35Å; D301-V303 VanDerWaalsContact C-N 3.33Å; D301-V303 PolarHBondContact O-N 2.78Å; V303-M305 PolarHBondContact O-N 3.05Å; V303-V306 HydrophobicContact CG2-CB 4.18Å; V303-V306 HydrophobicContact CG2-CG2 4.23Å; V303-V306 WeakPolarHBondContact O-CB 3.39Å; V303-V306 PolarHBondContact O-N 3.32Å; V303-V335 HydrophobicContact CB-CG1 3.58Å; V303-V335 HydrophobicContact CG1-CG1 3.7Å; V303-V335 HydrophobicContact CG2-CG1 3.58Å; V303-C336 PolarHBondContact N-O 2.97Å; V303-F339 HydrophobicContact CG1-CE1 4.12Å; V303-F339 HydrophobicContact CG1-CE2 4.25Å; V303-F339 HydrophobicContact CG1-CZ 3.7Å; V303-C355 HydrophobicContact CG2-CB 3.97Å; V303-W361 HydrophobicContact CG2-CZ3 4.28Å
304	S	92.2	Very high	93.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-59.6	-30.4	-178.9	69.6	0	0	0	0	113.1	E302 V306 D338 L342 P344	E302-S304 PolarHBondContact O-N 3.31Å; S304-V306 VanDerWaalsContact C-N 3.32Å; S304-D338 VanDerWaalsContact CB-O 3.24Å; S304-D338 WeakPolarHBondContact CB-O 3.47Å; S304-L342 CarbonylContact C-O 3.58Å; S304-L342 VanDerWaalsContact CB-O 3.29Å; S304-L342 WeakPolarHBondContact CB-O 3.35Å; S304-L342 PolarHBondContact OG-O 2.91Å; S304-P344 WeakPolarHBondContact O-CD 3.43Å; S304-P344 WeakPolarHBondContact O-CG 3.34Å
305	M	90	Very high	93.9	Very high	26 Å²	26	24.7 Å²	24.7	13%	0.128	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-91.2	9.4	178.6	-61.2	-175.4	-56.4	0	0	113.3	S250 T251 E302 V303 L342	S250-M305 WeakPolarHBondContact OG-CE 3.33Å; T251-M305 HydrophobicContact CG2-CE 3.29Å; T251-M305 HydrophobicContact CG2-SD 4.23Å; E302-M305 HydrophobicContact CB-CE 4.42Å; E302-M305 PolarHBondContact O-N 2.89Å; V303-M305 PolarHBondContact O-N 3.05Å; M305-L342 HydrophobicContact CG-CB 4.21Å; M305-L342 HydrophobicContact SD-CB 4.3Å
306	V	92.1	Very high	93.9	Very high	7 Å²	7	26 Å²	26	4%	0.042	12%	0.119	C	C	.	.	S	Bend	trans	-94.1	125.7	176	-178.9	0	0	0	0	109.1	L263 V303 S304 F310 C355	L263-V306 HydrophobicContact CD2-CG1 4.32Å; L263-V306 HydrophobicContact CD2-CG2 4.2Å; V303-V306 HydrophobicContact CG2-CB 4.18Å; V303-V306 HydrophobicContact CG2-CG2 4.23Å; V303-V306 WeakPolarHBondContact O-CB 3.39Å; V303-V306 PolarHBondContact O-N 3.32Å; S304-V306 VanDerWaalsContact C-N 3.32Å; V306-F310 HydrophobicContact CG1-CD1 4.06Å; V306-C355 HydrophobicContact CB-CB 4.35Å; V306-C355 VanDerWaalsContact O-CB 3.32Å; V306-C355 WeakPolarHBondContact O-CB 3.01Å; V306-C355 PolarHBondContact O-N 2.74Å
307	E	92.4	Very high	93.9	Very high	43 Å²	43	17.8 Å²	17.8	20%	0.201	9%	0.088	C	C	.	.	B	Isolated β-bridge	trans	-73.4	145.6	177.8	-63.8	169.1	-153.7	0	0	111.8	Q309 F310 F311 P344 K347	E307-Q309 PolarHBondContact O-N 2.93Å; E307-F310 HydrophobicContact CB-CB 4.21Å; E307-F310 PolarHBondContact O-N 3.34Å; E307-F311 PolarHBondContact O-N 2.81Å; E307-F311 VanDerWaalsContact O-N 3.08Å; E307-P344 HydrophobicContact CG-CB 3.58Å; E307-P344 HydrophobicContact CG-CG 4.31Å; E307-K347 IonicContact OE1-NZ 2.77Å
308	A	93.3	Very high	93.8	Very high	5 Å²	5	16.7 Å²	16.7	4%	0.041	8%	0.083	C	C	.	.	H	α-helix	trans	-58.2	-46.9	179.2	0	0	0	0	0	113.1	F310 F311 D312 S353 F354 A358	A308-F310 VanDerWaalsContact C-N 3.29Å; A308-F310 PolarHBondContact O-N 2.58Å; A308-F311 WeakPolarHBondContact O-CB 3.19Å; A308-F311 PolarHBondContact O-N 3.29Å; A308-F311 VanDerWaalsContact O-N 3.15Å; A308-D312 PolarHBondContact O-N 2.92Å; A308-S353 WeakPolarHBondContact CB-OG 3.2Å; A308-S353 PolarHBondContact N-O 3.05Å; A308-F354 VanDerWaalsContact CB-O 3.31Å; A308-F354 WeakPolarHBondContact CB-O 3.28Å; A308-A358 HydrophobicContact CB-CB 3.98Å
309	Q	91.4	Very high	93.8	Very high	138 Å²	138	21.2 Å²	21.2	65%	0.645	10%	0.1	S	C	*	.	H	α-helix	trans	-62.3	-38.5	-179.3	-62.3	-176.2	8.3	0	0	111.8	E307 D312 K313	E307-Q309 PolarHBondContact O-N 2.93Å; Q309-D312 PolarHBondContact O-N 3.12Å; Q309-K313 WeakPolarHBondContact O-CB 3.23Å; Q309-K313 PolarHBondContact O-N 3.42Å
310	F	92.1	Very high	93.7	Very high	11 Å²	11	24 Å²	24	5%	0.048	12%	0.119	C	C	.	.	H	α-helix	trans	-65.1	-42.5	175.7	-175.6	-112	0	0	0	111.2	L263 H264 I269 V306 E307 A308 K313 L314	L263-F310 HydrophobicContact CD2-CE1 3.94Å; L263-F310 HydrophobicContact CG-CE1 4.06Å; H264-F310 AromaticContact CD2-CE1 3.99Å; H264-F310 AromaticContact CD2-CE2 3.69Å; H264-F310 AromaticContact CD2-CZ 3.38Å; H264-F310 WeakPolarHBondContact CD2-CZ 3.44Å; H264-F310 AromaticContact CG-CZ 3.94Å; H264-F310 AromaticContact NE2-CE1 3.78Å; H264-F310 AromaticContact NE2-CE2 3.86Å; H264-F310 AromaticContact NE2-CZ 3.59Å; I269-F310 HydrophobicContact CD1-CE2 3.79Å; I269-F310 HydrophobicContact CD1-CZ 4.48Å; I269-F310 HydrophobicContact CG1-CE2 4.12Å; V306-F310 HydrophobicContact CG1-CD1 4.06Å; E307-F310 HydrophobicContact CB-CB 4.21Å; E307-F310 PolarHBondContact O-N 3.34Å; A308-F310 VanDerWaalsContact C-N 3.29Å; A308-F310 PolarHBondContact O-N 2.58Å; F310-K313 PolarHBondContact O-N 2.94Å; F310-L314 HydrophobicContact CD1-CD1 3.92Å; F310-L314 HydrophobicContact CD1-CG 4.37Å; F310-L314 HydrophobicContact CE1-CD1 3.56Å; F310-L314 HydrophobicContact CE1-CD2 4.42Å; F310-L314 HydrophobicContact CE1-CG 4.09Å; F310-L314 HydrophobicContact CE2-CD2 4.45Å; F310-L314 HydrophobicContact CZ-CD1 4.05Å; F310-L314 HydrophobicContact CZ-CD2 4.05Å; F310-L314 HydrophobicContact CZ-CG 4.15Å; F310-L314 WeakPolarHBondContact O-CG 3.44Å; F310-L314 PolarHBondContact O-N 2.9Å
311	F	95.3	Very high	93.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.3	-44.7	176.1	-170.8	-91.7	0	0	0	112.8	I300 E307 A308 K313 L314 E315 F328 L333 C355 A358 W361 V364	I300-F311 HydrophobicContact CD1-CE2 4.47Å; E307-F311 PolarHBondContact O-N 2.81Å; E307-F311 VanDerWaalsContact O-N 3.08Å; A308-F311 WeakPolarHBondContact O-CB 3.19Å; A308-F311 PolarHBondContact O-N 3.29Å; A308-F311 VanDerWaalsContact O-N 3.15Å; F311-K313 VanDerWaalsContact C-N 3.29Å; F311-K313 PolarHBondContact O-N 3.18Å; F311-L314 PolarHBondContact O-N 3.28Å; F311-E315 PolarHBondContact O-N 3.05Å; F311-F328 HydrophobicContact CE2-CE2 4.45Å; F311-F328 HydrophobicContact CZ-CE2 4.44Å; F311-L333 HydrophobicContact CE2-CD1 4.16Å; F311-L333 HydrophobicContact CZ-CD1 3.88Å; F311-C355 WeakPolarHBondContact CD2-SG 3.06Å; F311-A358 HydrophobicContact CB-CB 4.3Å; F311-A358 HydrophobicContact CD1-CB 3.94Å; F311-W361 HydrophobicContact CE1-CE3 4.29Å; F311-W361 HydrophobicContact CZ-CE3 4.19Å; F311-V364 HydrophobicContact CZ-CG1 4.43Å
312	D	94.9	Very high	93.7	Very high	32 Å²	32	27.8 Å²	27.8	17%	0.171	14%	0.135	C	C	.	.	H	α-helix	trans	-62.3	-37.1	175.9	-81.2	-26.4	0	0	0	112	A308 Q309 E315 S316 R359 S360	A308-D312 PolarHBondContact O-N 2.92Å; Q309-D312 PolarHBondContact O-N 3.12Å; D312-E315 PolarHBondContact O-N 2.86Å; D312-S316 PolarHBondContact O-N 3.06Å; D312-S316 VanDerWaalsContact O-N 3.11Å; D312-S316 PolarHBondContact O-OG 3.11Å; D312-R359 PolarHBondContact OD1-N 3.47Å; D312-R359 PolarHBondContact OD2-N 3.4Å; D312-S360 WeakPolarHBondContact OD1-CB 3.36Å; D312-S360 PolarHBondContact OD1-N 2.91Å; D312-S360 PolarHBondContact OD1-OG 2.98Å
313	K	94.1	Very high	93.8	Very high	41 Å²	41	38.8 Å²	38.8	18%	0.178	18%	0.176	C	C	.	.	H	α-helix	trans	-67.2	-43.6	175.6	-164.9	168.3	-64.7	-177.9	0	111.7	G272 A274 L276 C279 Q309 F310 F311 E315 S316 V317	G272-K313 WeakPolarHBondContact O-CD 3.36Å; G272-K313 WeakPolarHBondContact O-CE 3.22Å; G272-K313 PolarHBondContact O-NZ 3.28Å; A274-K313 PolarHBondContact O-NZ 2.93Å; L276-K313 HydrophobicContact CD1-CG 4.15Å; C279-K313 HydrophobicContact CB-CD 4.36Å; Q309-K313 WeakPolarHBondContact O-CB 3.23Å; Q309-K313 PolarHBondContact O-N 3.42Å; F310-K313 PolarHBondContact O-N 2.94Å; F311-K313 VanDerWaalsContact C-N 3.29Å; F311-K313 PolarHBondContact O-N 3.18Å; K313-E315 VanDerWaalsContact C-N 3.31Å; K313-E315 PolarHBondContact O-N 3.34Å; K313-S316 PolarHBondContact O-N 3.44Å; K313-V317 WeakPolarHBondContact O-CB 3.32Å; K313-V317 VanDerWaalsContact O-CG2 3.26Å; K313-V317 WeakPolarHBondContact O-CG2 3.28Å; K313-V317 PolarHBondContact O-N 3Å
314	L	95.1	Very high	93.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-41.3	174.7	-71.5	177.2	0	0	0	112.2	L263 A267 I269 W292 F310 F311 V317 A318 F328	L263-L314 HydrophobicContact CD1-CD1 4.04Å; L263-L314 HydrophobicContact CD2-CD1 3.7Å; L263-L314 HydrophobicContact CG-CD1 3.85Å; A267-L314 HydrophobicContact CB-CD2 3.36Å; I269-L314 HydrophobicContact CD1-CD2 3.85Å; W292-L314 HydrophobicContact CH2-CD2 4.18Å; W292-L314 HydrophobicContact CZ2-CD2 4.13Å; F310-L314 HydrophobicContact CD1-CD1 3.92Å; F310-L314 HydrophobicContact CD1-CG 4.37Å; F310-L314 HydrophobicContact CE1-CD1 3.56Å; F310-L314 HydrophobicContact CE1-CD2 4.42Å; F310-L314 HydrophobicContact CE1-CG 4.09Å; F310-L314 HydrophobicContact CE2-CD2 4.45Å; F310-L314 HydrophobicContact CZ-CD1 4.05Å; F310-L314 HydrophobicContact CZ-CD2 4.05Å; F310-L314 HydrophobicContact CZ-CG 4.15Å; F310-L314 WeakPolarHBondContact O-CG 3.44Å; F310-L314 PolarHBondContact O-N 2.9Å; F311-L314 PolarHBondContact O-N 3.28Å; L314-V317 PolarHBondContact O-N 3.44Å; L314-A318 VanDerWaalsContact O-CB 3.28Å; L314-A318 WeakPolarHBondContact O-CB 3.26Å; L314-A318 PolarHBondContact O-N 3.2Å; L314-F328 HydrophobicContact CB-CE2 4Å; L314-F328 HydrophobicContact CB-CZ 3.87Å
315	E	96	Very high	93.8	Very high	11 Å²	11	46.6 Å²	46.6	5%	0.051	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-46.2	177.1	-165.4	-76	152.1	0	0	111.5	F311 D312 K313 A318 R319 F328 V364	F311-E315 PolarHBondContact O-N 3.05Å; D312-E315 PolarHBondContact O-N 2.86Å; K313-E315 VanDerWaalsContact C-N 3.31Å; K313-E315 PolarHBondContact O-N 3.34Å; E315-A318 PolarHBondContact O-N 2.87Å; E315-R319 PolarHBondContact O-N 3.43Å; E315-R319 VanDerWaalsContact OE1-CD 3.24Å; E315-R319 WeakPolarHBondContact OE1-CD 3.42Å; E315-R319 IonicContact OE1-CZ 3.79Å; E315-R319 IonicContact OE1-NE 3.59Å; E315-R319 PolarHBondContact OE1-NE 3.45Å; E315-R319 IonicContact OE1-NH2 2.78Å; E315-R319 IonicContact OE2-CZ 3.95Å; E315-R319 VanDerWaalsContact OE2-CZ 3.28Å; E315-R319 IonicContact OE2-NE 2.97Å; E315-R319 PolarHBondContact OE2-NE 2.94Å; E315-R319 IonicContact OE2-NH2 3.33Å; E315-R319 PolarHBondContact OE2-NH2 2.91Å; E315-F328 HydrophobicContact CB-CD2 3.85Å; E315-F328 HydrophobicContact CB-CE2 4.2Å; E315-F328 HydrophobicContact CG-CB 4.5Å; E315-F328 HydrophobicContact CG-CD2 3.91Å; E315-F328 PolarHBondContact OE1-N 3.43Å; E315-V364 HydrophobicContact CG-CG2 3.89Å
316	S	94.8	Very high	94	Very high	28 Å²	28	50.8 Å²	50.8	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-41.5	179.4	-59.1	0	0	0	0	112	D312 K313 S320	D312-S316 PolarHBondContact O-N 3.06Å; D312-S316 VanDerWaalsContact O-N 3.11Å; D312-S316 PolarHBondContact O-OG 3.11Å; K313-S316 PolarHBondContact O-N 3.44Å; S316-S320 WeakPolarHBondContact O-CB 3.4Å; S316-S320 PolarHBondContact O-N 3.42Å; S316-S320 PolarHBondContact O-OG 3.29Å
317	V	94.8	Very high	94	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-45.6	174.2	169.8	0	0	0	0	110.4	L276 C279 V280 A283 W292 K313 L314 R319 S320 V321	L276-V317 HydrophobicContact CD1-CG2 3.9Å; C279-V317 HydrophobicContact CB-CG2 4.04Å; V280-V317 HydrophobicContact CG2-CG2 4.05Å; A283-V317 HydrophobicContact CB-CG1 3.49Å; A283-V317 VanDerWaalsContact CB-CG1 3.49Å; W292-V317 HydrophobicContact CZ2-CG1 4.24Å; K313-V317 WeakPolarHBondContact O-CB 3.32Å; K313-V317 VanDerWaalsContact O-CG2 3.26Å; K313-V317 WeakPolarHBondContact O-CG2 3.28Å; K313-V317 PolarHBondContact O-N 3Å; L314-V317 PolarHBondContact O-N 3.44Å; V317-R319 PolarHBondContact O-N 3.32Å; V317-S320 PolarHBondContact O-N 2.95Å; V317-V321 HydrophobicContact CG1-CG2 3.92Å; V317-V321 WeakPolarHBondContact O-CB 3.09Å; V317-V321 VanDerWaalsContact O-CG2 3.25Å; V317-V321 WeakPolarHBondContact O-CG2 3.29Å; V317-V321 PolarHBondContact O-N 3.03Å
318	A	95.5	Very high	94.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-44.5	-179.8	0	0	0	0	0	112.1	W292 L314 E315 R322 F328	W292-A318 HydrophobicContact CE3-CB 4Å; W292-A318 HydrophobicContact CH2-CB 4.18Å; W292-A318 HydrophobicContact CZ3-CB 3.5Å; L314-A318 VanDerWaalsContact O-CB 3.28Å; L314-A318 WeakPolarHBondContact O-CB 3.26Å; L314-A318 PolarHBondContact O-N 3.2Å; E315-A318 PolarHBondContact O-N 2.87Å; A318-R322 VanDerWaalsContact O-CB 3.23Å; A318-R322 WeakPolarHBondContact O-CB 3.34Å; A318-R322 VanDerWaalsContact O-CG 3.31Å; A318-R322 WeakPolarHBondContact O-CG 3.32Å; A318-R322 PolarHBondContact O-N 3.49Å; A318-R322 VanDerWaalsContact O-N 3.08Å; A318-F328 HydrophobicContact CB-CD1 3.83Å; A318-F328 HydrophobicContact CB-CE1 4.16Å; A318-F328 HydrophobicContact CB-CG 4.2Å; A318-F328 WeakPolarHBondContact CB-O 3.46Å
319	R	95.4	Very high	94.2	Very high	95 Å²	95	50.3 Å²	50.3	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-62.7	-44.6	175.1	-77.9	-164.7	-72.8	133.6	2.9	112.5	E315 V317 R323 S324 Q326	E315-R319 PolarHBondContact O-N 3.43Å; E315-R319 VanDerWaalsContact OE1-CD 3.24Å; E315-R319 WeakPolarHBondContact OE1-CD 3.42Å; E315-R319 IonicContact OE1-CZ 3.79Å; E315-R319 IonicContact OE1-NE 3.59Å; E315-R319 PolarHBondContact OE1-NE 3.45Å; E315-R319 IonicContact OE1-NH2 2.78Å; E315-R319 IonicContact OE2-CZ 3.95Å; E315-R319 VanDerWaalsContact OE2-CZ 3.28Å; E315-R319 IonicContact OE2-NE 2.97Å; E315-R319 PolarHBondContact OE2-NE 2.94Å; E315-R319 IonicContact OE2-NH2 3.33Å; E315-R319 PolarHBondContact OE2-NH2 2.91Å; V317-R319 PolarHBondContact O-N 3.32Å; R319-R323 WeakPolarHBondContact O-CA 3.29Å; R319-R323 PolarHBondContact O-N 3.3Å; R319-S324 WeakPolarHBondContact CA-O 3.34Å; R319-S324 VanDerWaalsContact CB-O 3.28Å; R319-S324 WeakPolarHBondContact CB-O 3.36Å; R319-S324 VanDerWaalsContact CG-O 3.27Å; R319-S324 WeakPolarHBondContact CG-O 3.23Å; R319-S324 PolarHBondContact O-N 3.26Å; R319-S324 VanDerWaalsContact O-N 3.08Å; R319-Q326 WeakPolarHBondContact CD-O 3.38Å; R319-Q326 VanDerWaalsContact CG-O 3.31Å; R319-Q326 WeakPolarHBondContact CG-O 3.43Å
320	S	93.8	Very high	94.3	Very high	58 Å²	58	46.1 Å²	46.1	41%	0.406	24%	0.239	S	C	.	.	H	α-helix	trans	-66.1	-49	-178.4	-56.4	0	0	0	0	111.9	S316 V317 R322 R323	S316-S320 WeakPolarHBondContact O-CB 3.4Å; S316-S320 PolarHBondContact O-N 3.42Å; S316-S320 PolarHBondContact O-OG 3.29Å; V317-S320 PolarHBondContact O-N 2.95Å; S320-R322 PolarHBondContact O-N 3.1Å; S320-R323 PolarHBondContact O-N 3.26Å
321	V	93.5	Very high	94.6	Very high	12 Å²	12	45.7 Å²	45.7	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-37.4	-178.2	173.3	0	0	0	0	111.7	A283 L289 W292 V317	A283-V321 HydrophobicContact CB-CG2 3.75Å; L289-V321 HydrophobicContact CD1-CG1 3.38Å; W292-V321 HydrophobicContact CB-CG1 3.67Å; W292-V321 HydrophobicContact CG-CG1 4.17Å; V317-V321 HydrophobicContact CG1-CG2 3.92Å; V317-V321 WeakPolarHBondContact O-CB 3.09Å; V317-V321 VanDerWaalsContact O-CG2 3.25Å; V317-V321 WeakPolarHBondContact O-CG2 3.29Å; V317-V321 PolarHBondContact O-N 3.03Å
322	R	94.6	Very high	94.7	Very high	70 Å²	70	46.6 Å²	46.6	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-90.1	-2	-179.6	-61.5	176	59.1	80.5	4.6	113.6	W292 T293 C295 A318 S320 S324 G329	W292-R322 PolarHBondContact O-NH1 2.91Å; T293-R322 PolarHBondContact O-NH1 3.17Å; C295-R322 PolarHBondContact O-NH1 3.44Å; A318-R322 VanDerWaalsContact O-CB 3.23Å; A318-R322 WeakPolarHBondContact O-CB 3.34Å; A318-R322 VanDerWaalsContact O-CG 3.31Å; A318-R322 WeakPolarHBondContact O-CG 3.32Å; A318-R322 PolarHBondContact O-N 3.49Å; A318-R322 VanDerWaalsContact O-N 3.08Å; S320-R322 PolarHBondContact O-N 3.1Å; R322-S324 VanDerWaalsContact C-N 3.25Å; R322-S324 PolarHBondContact O-N 2.96Å; R322-G329 PolarHBondContact NE-O 3.19Å
323	R	93.8	Very high	94.8	Very high	237 Å²	237	45 Å²	45	89%	0.894	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	47.1	-176.6	-56.8	-179.3	-178.8	-178.4	-1.2	112.1	R319 S320	R319-R323 WeakPolarHBondContact O-CA 3.29Å; R319-R323 PolarHBondContact O-N 3.3Å; S320-R323 PolarHBondContact O-N 3.26Å
324	S	93.6	Very high	94.9	Very high	33 Å²	33	43.1 Å²	43.1	23%	0.231	23%	0.225	C	C	.	.			trans	-129.1	137.6	-175.9	176.4	0	0	0	0	110.6	R319 R322 Q326	R319-S324 WeakPolarHBondContact CA-O 3.34Å; R319-S324 VanDerWaalsContact CB-O 3.28Å; R319-S324 WeakPolarHBondContact CB-O 3.36Å; R319-S324 VanDerWaalsContact CG-O 3.27Å; R319-S324 WeakPolarHBondContact CG-O 3.23Å; R319-S324 PolarHBondContact O-N 3.26Å; R319-S324 VanDerWaalsContact O-N 3.08Å; R322-S324 VanDerWaalsContact C-N 3.25Å; R322-S324 PolarHBondContact O-N 2.96Å; S324-Q326 VanDerWaalsContact C-N 3.31Å; S324-Q326 WeakPolarHBondContact OG-CB 3.38Å; S324-Q326 PolarHBondContact OG-N 3.41Å
325	T	92.6	Very high	95	Very high	131 Å²	131	43.1 Å²	43.1	80%	0.804	23%	0.225	S	C	*	.			trans	-82.5	-11.8	175.2	54.6	0	0	0	0	112.7
326	Q	94.3	Very high	94.9	Very high	114 Å²	114	42.6 Å²	42.6	53%	0.533	22%	0.222	S	C	.	.	S	Bend	trans	-66	148.2	178.5	-66.1	-65.9	-31.8	0	0	111	R319 S324 F328 G329	R319-Q326 WeakPolarHBondContact CD-O 3.38Å; R319-Q326 VanDerWaalsContact CG-O 3.31Å; R319-Q326 WeakPolarHBondContact CG-O 3.43Å; S324-Q326 VanDerWaalsContact C-N 3.31Å; S324-Q326 WeakPolarHBondContact OG-CB 3.38Å; S324-Q326 PolarHBondContact OG-N 3.41Å; Q326-F328 PolarHBondContact O-N 3.47Å; Q326-G329 WeakPolarHBondContact O-CA 3.48Å; Q326-G329 PolarHBondContact O-N 3.12Å
327	P	93.7	Very high	94.9	Very high	44 Å²	44	41.2 Å²	41.2	29%	0.286	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-50.6	131.3	176.8	-25.3	33.2	0	0	0	111.5	G329 G330 V364	P327-G329 PolarHBondContact O-N 2.73Å; P327-G329 VanDerWaalsContact O-N 3.13Å; P327-G330 PolarHBondContact O-N 3.49Å; P327-V364 HydrophobicContact CB-CG2 3.93Å
328	F	95.4	Very high	94.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	56	28.5	-179.2	-137.8	-89.8	0	0	0	113.9	W292 L298 F311 L314 E315 A318 Q326 G330 I331 L333 V364	W292-F328 HydrophobicContact CH2-CE1 4.11Å; W292-F328 HydrophobicContact CH2-CZ 4.4Å; W292-F328 HydrophobicContact CZ3-CD1 4.41Å; W292-F328 AromaticContact CZ3-CE1 3.76Å; W292-F328 HydrophobicContact CZ3-CE1 3.76Å; W292-F328 HydrophobicContact CZ3-CZ 4.47Å; L298-F328 HydrophobicContact CD2-CE1 3.56Å; L298-F328 HydrophobicContact CD2-CZ 3.99Å; F311-F328 HydrophobicContact CE2-CE2 4.45Å; F311-F328 HydrophobicContact CZ-CE2 4.44Å; L314-F328 HydrophobicContact CB-CE2 4Å; L314-F328 HydrophobicContact CB-CZ 3.87Å; E315-F328 HydrophobicContact CB-CD2 3.85Å; E315-F328 HydrophobicContact CB-CE2 4.2Å; E315-F328 HydrophobicContact CG-CB 4.5Å; E315-F328 HydrophobicContact CG-CD2 3.91Å; E315-F328 PolarHBondContact OE1-N 3.43Å; A318-F328 HydrophobicContact CB-CD1 3.83Å; A318-F328 HydrophobicContact CB-CE1 4.16Å; A318-F328 HydrophobicContact CB-CG 4.2Å; A318-F328 WeakPolarHBondContact CB-O 3.46Å; Q326-F328 PolarHBondContact O-N 3.47Å; F328-G330 VanDerWaalsContact C-N 3.25Å; F328-G330 PolarHBondContact O-N 3.3Å; F328-I331 HydrophobicContact CD1-CB 4.17Å; F328-I331 HydrophobicContact CD1-CD1 4.21Å; F328-I331 PolarHBondContact O-N 2.76Å; F328-L333 HydrophobicContact CD1-CD2 3.83Å; F328-L333 HydrophobicContact CD1-CG 4.43Å; F328-L333 HydrophobicContact CD2-CD1 3.89Å; F328-L333 HydrophobicContact CE1-CD2 3.93Å; F328-L333 HydrophobicContact CE2-CD1 4.12Å; F328-L333 HydrophobicContact CG-CD1 4.11Å; F328-L333 HydrophobicContact CG-CD2 4.17Å; F328-L333 HydrophobicContact CG-CG 4.28Å; F328-L333 HydrophobicContact CZ-CD2 4.35Å; F328-V364 HydrophobicContact CB-CG1 4.32Å; F328-V364 HydrophobicContact CD2-CG1 4.47Å
329	G	93.8	Very high	94.7	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.021	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	68.1	21	-177.7	0	0	0	0	0	114.2	R322 Q326 P327 I331	R322-G329 PolarHBondContact NE-O 3.19Å; Q326-G329 WeakPolarHBondContact O-CA 3.48Å; Q326-G329 PolarHBondContact O-N 3.12Å; P327-G329 PolarHBondContact O-N 2.73Å; P327-G329 VanDerWaalsContact O-N 3.13Å; G329-I331 VanDerWaalsContact C-N 3.35Å
330	G	94.4	Very high	94.6	Very high	49 Å²	49	37.3 Å²	37.3	51%	0.505	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	77.7	16.5	-178.4	0	0	0	0	0	114.4	P327 F328	P327-G330 PolarHBondContact O-N 3.49Å; F328-G330 VanDerWaalsContact C-N 3.25Å; F328-G330 PolarHBondContact O-N 3.3Å
331	I	96.7	Very high	94.5	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-77.3	134.4	171.8	-62.5	174.6	0	0	0	108.8	W292 C295 L298 F328 G329 L333	W292-I331 HydrophobicContact CE3-CD1 3.93Å; W292-I331 HydrophobicContact CZ3-CD1 4.08Å; C295-I331 HydrophobicContact CB-CD1 4.23Å; L298-I331 HydrophobicContact CB-CG2 3.72Å; F328-I331 HydrophobicContact CD1-CB 4.17Å; F328-I331 HydrophobicContact CD1-CD1 4.21Å; F328-I331 PolarHBondContact O-N 2.76Å; G329-I331 VanDerWaalsContact C-N 3.35Å; I331-L333 HydrophobicContact CG2-CD2 4.3Å; I331-L333 PolarHBondContact O-N 3Å
332	Q	97.4	Very high	94.3	Very high	19 Å²	19	34.1 Å²	34.1	9%	0.089	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	121.1	171.4	-171.7	-175.1	2.8	0	0	110.2	V213 G216 K217 N218 R296 H297 L298	V213-Q332 PolarHBondContact O-NE2 3.49Å; G216-Q332 VanDerWaalsContact C-NE2 3.26Å; K217-Q332 PolarHBondContact O-NE2 3.46Å; N218-Q332 VanDerWaalsContact OD1-CA 3.27Å; N218-Q332 WeakPolarHBondContact OD1-CA 3.29Å; R296-Q332 WeakPolarHBondContact O-CB 3.32Å; R296-Q332 PolarHBondContact O-N 3.11Å; H297-Q332 WeakPolarHBondContact CA-O 3.4Å; H297-Q332 PolarHBondContact CD2-OE1 2.8Å; L298-Q332 PolarHBondContact N-O 2.96Å
333	L	97.3	Very high	94.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.1	176.5	-68.9	-160	0	0	0	112.4	N218 V219 L298 F311 F328 I331 V335 V364 I365	N218-L333 CarbonylContact C-O 3.51Å; N218-L333 VanDerWaalsContact CA-O 3.3Å; N218-L333 WeakPolarHBondContact CA-O 3.27Å; N218-L333 PolarHBondContact OD1-N 2.93Å; V219-L333 PolarHBondContact N-O 3.15Å; L298-L333 HydrophobicContact CB-CD2 3.75Å; L298-L333 HydrophobicContact CD2-CD2 3.87Å; L298-L333 HydrophobicContact CG-CD2 4.13Å; F311-L333 HydrophobicContact CE2-CD1 4.16Å; F311-L333 HydrophobicContact CZ-CD1 3.88Å; F328-L333 HydrophobicContact CD1-CD2 3.83Å; F328-L333 HydrophobicContact CD1-CG 4.43Å; F328-L333 HydrophobicContact CD2-CD1 3.89Å; F328-L333 HydrophobicContact CE1-CD2 3.93Å; F328-L333 HydrophobicContact CE2-CD1 4.12Å; F328-L333 HydrophobicContact CG-CD1 4.11Å; F328-L333 HydrophobicContact CG-CD2 4.17Å; F328-L333 HydrophobicContact CG-CG 4.28Å; F328-L333 HydrophobicContact CZ-CD2 4.35Å; I331-L333 HydrophobicContact CG2-CD2 4.3Å; I331-L333 PolarHBondContact O-N 3Å; L333-V335 HydrophobicContact CB-CG2 4.16Å; L333-V335 HydrophobicContact CD1-CG2 4.45Å; L333-V364 HydrophobicContact CB-CG1 4.49Å; L333-V364 HydrophobicContact CD1-CG1 3.31Å; L333-V364 HydrophobicContact CG-CG1 3.92Å; L333-I365 HydrophobicContact CB-CD1 4.46Å
334	I	97.3	Very high	93.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	100.1	173	-58.6	147.7	0	0	0	107	V213 V219 F221 L233 I236 L240 H297 L298 I299 I300	V213-I334 HydrophobicContact CG1-CD1 3.59Å; V213-I334 HydrophobicContact CG1-CG1 3.82Å; V213-I334 HydrophobicContact CG2-CG1 4.13Å; V213-I334 HydrophobicContact CG2-CG2 4.2Å; V219-I334 WeakPolarHBondContact O-CA 3.04Å; F221-I334 HydrophobicContact CE1-CG2 4.02Å; L233-I334 HydrophobicContact CD2-CG2 4.2Å; I236-I334 HydrophobicContact CD1-CG2 4.43Å; I236-I334 HydrophobicContact CG2-CD1 4.28Å; L240-I334 HydrophobicContact CD1-CD1 3.55Å; H297-I334 HydrophobicContact CB-CD1 4.4Å; L298-I334 PolarHBondContact O-N 3.07Å; I299-I334 CarbonylContact C-O 3.52Å; I299-I334 VanDerWaalsContact CA-O 3.24Å; I299-I334 WeakPolarHBondContact CA-O 3.46Å; I299-I334 HydrophobicContact CD1-CD1 4.41Å; I299-I334 HydrophobicContact CG1-CB 4.14Å; I299-I334 HydrophobicContact CG1-CD1 4.02Å; I300-I334 PolarHBondContact N-O 3.38Å
335	V	96.5	Very high	93	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.7	-170.7	-174.5	0	0	0	0	109.3	V219 F220 F221 I300 V303 L333 W361 I365	V219-V335 PolarHBondContact O-N 3.32Å; F220-V335 CarbonylContact C-O 3.41Å; F220-V335 WeakPolarHBondContact CA-O 3.23Å; F220-V335 HydrophobicContact CD2-CB 4.12Å; F220-V335 HydrophobicContact CD2-CG1 3.93Å; F221-V335 PolarHBondContact N-O 3.32Å; I300-V335 HydrophobicContact CB-CG1 4.4Å; I300-V335 HydrophobicContact CB-CG2 4.46Å; I300-V335 HydrophobicContact CD1-CG2 4.38Å; V303-V335 HydrophobicContact CB-CG1 3.58Å; V303-V335 HydrophobicContact CG1-CG1 3.7Å; V303-V335 HydrophobicContact CG2-CG1 3.58Å; L333-V335 HydrophobicContact CB-CG2 4.16Å; L333-V335 HydrophobicContact CD1-CG2 4.45Å; V335-W361 HydrophobicContact CG1-CH2 4.03Å; V335-W361 HydrophobicContact CG1-CZ3 4.29Å; V335-I365 HydrophobicContact CB-CD1 4.46Å; V335-I365 HydrophobicContact CG2-CD1 3.86Å
336	C	94.9	Very high	92	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.6	170	71.2	0	0	0	0	114	F221 L233 I300 D301 E302 V303	F221-C336 HydrophobicContact CD1-CB 4.1Å; F221-C336 HydrophobicContact CD2-CB 3.89Å; F221-C336 HydrophobicContact CE1-CB 3.71Å; F221-C336 HydrophobicContact CE2-CB 3.47Å; F221-C336 VanDerWaalsContact CE2-CB 3.47Å; F221-C336 HydrophobicContact CG-CB 4.19Å; F221-C336 HydrophobicContact CZ-CB 3.39Å; F221-C336 WeakPolarHBondContact O-CA 3.46Å; F221-C336 VanDerWaalsContact O-CB 3.28Å; F221-C336 WeakPolarHBondContact O-CB 3.46Å; L233-C336 WeakPolarHBondContact CD1-SG 3.26Å; I300-C336 PolarHBondContact O-N 3.44Å; D301-C336 CarbonylContact C-O 3.58Å; D301-C336 PolarHBondContact OD1-SG 3.49Å; E302-C336 PolarHBondContact N-O 2.95Å; V303-C336 PolarHBondContact N-O 2.97Å
337	G	92.9	Very high	90.5	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.121	C	C	.	.			trans	162.5	-177.9	179.8	0	0	0	0	0	110.8	T222	T222-G337 WeakPolarHBondContact CA-O 3.35Å; T222-G337 WeakPolarHBondContact CB-O 3.3Å; T222-G337 PolarHBondContact OG1-O 3.25Å
338	D	93.8	Very high	89	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.142	C	C	.	.			trans	-134.9	109.3	176.4	-176.5	8.8	0	0	0	107.9	S304 L340 Q341 R390 Y606	S304-D338 VanDerWaalsContact CB-O 3.24Å; S304-D338 WeakPolarHBondContact CB-O 3.47Å; D338-L340 PolarHBondContact O-N 2.98Å; D338-L340 PolarHBondContact OD1-N 3.16Å; D338-Q341 HydrophobicContact CB-CB 4.48Å; D338-Q341 HydrophobicContact CB-CG 3.88Å; D338-Q341 VanDerWaalsContact CB-NE2 3.3Å; D338-Q341 WeakPolarHBondContact O-CB 3.34Å; D338-Q341 PolarHBondContact O-N 3Å; D338-Q341 PolarHBondContact OD2-NE2 3.42Å; D338-R390 IonicContact OD1-CZ 2.93Å; D338-R390 IonicContact OD1-NE 2.78Å; D338-R390 PolarHBondContact OD1-NE 3.26Å; D338-R390 IonicContact OD1-NH2 3.85Å; D338-R390 PolarHBondContact OD1-NH2 2.63Å; D338-R390 IonicContact OD2-CZ 3.62Å; D338-R390 IonicContact OD2-NE 3.76Å; D338-R390 PolarHBondContact OD2-NE 3.43Å; D338-R390 IonicContact OD2-NH2 3.87Å; D338-Y606 WeakPolarHBondContact CA-OH 3.32Å; D338-Y606 PolarHBondContact OD1-OH 2.87Å
339	F	94.1	Very high	87.3	Confident	3 Å²	3	35.9 Å²	35.9	1%	0.013	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.6	-175.8	-70	-71.9	0	0	0	112.8	F220 V303 Q341 F354 C355 F356 W361 V602 F605 Y606	F220-F339 HydrophobicContact CE1-CE2 4.27Å; F220-F339 AromaticContact CE2-CE2 3.92Å; F220-F339 HydrophobicContact CE2-CE2 3.92Å; F220-F339 AromaticContact CZ-CD2 3.95Å; F220-F339 HydrophobicContact CZ-CD2 3.95Å; F220-F339 AromaticContact CZ-CE2 3.5Å; F220-F339 HydrophobicContact CZ-CE2 3.5Å; V303-F339 HydrophobicContact CG1-CE1 4.12Å; V303-F339 HydrophobicContact CG1-CE2 4.25Å; V303-F339 HydrophobicContact CG1-CZ 3.7Å; F339-Q341 VanDerWaalsContact C-N 3.25Å; F339-F354 HydrophobicContact CD1-CD1 4.03Å; F339-C355 HydrophobicContact CE1-CB 3.83Å; F339-C355 HydrophobicContact CZ-CB 4Å; F339-F356 HydrophobicContact CB-CD1 4.43Å; F339-F356 HydrophobicContact CB-CE1 4.25Å; F339-F356 AromaticContact CD1-CD1 3.77Å; F339-F356 HydrophobicContact CD1-CD1 3.77Å; F339-F356 HydrophobicContact CD1-CE1 4.11Å; F339-F356 AromaticContact CD2-CD1 3.76Å; F339-F356 HydrophobicContact CD2-CD1 3.76Å; F339-F356 HydrophobicContact CD2-CE1 4.39Å; F339-F356 AromaticContact CE1-CD1 3.86Å; F339-F356 HydrophobicContact CE1-CD1 3.86Å; F339-F356 HydrophobicContact CE2-CB 4.12Å; F339-F356 AromaticContact CE2-CD1 3.82Å; F339-F356 HydrophobicContact CE2-CD1 3.82Å; F339-F356 HydrophobicContact CE2-CG 4.44Å; F339-F356 AromaticContact CG-CD1 3.74Å; F339-F356 HydrophobicContact CG-CD1 3.74Å; F339-F356 HydrophobicContact CG-CE1 4.02Å; F339-F356 HydrophobicContact CZ-CB 4.15Å; F339-F356 AromaticContact CZ-CD1 3.88Å; F339-F356 HydrophobicContact CZ-CD1 3.88Å; F339-W361 HydrophobicContact CE2-CH2 4.35Å; F339-W361 HydrophobicContact CE2-CZ2 4.4Å; F339-W361 HydrophobicContact CZ-CH2 4.11Å; F339-V602 HydrophobicContact CB-CG1 3.52Å; F339-V602 HydrophobicContact CB-CG2 4.24Å; F339-F605 HydrophobicContact CD2-CD1 4.34Å; F339-F605 AromaticContact CD2-CE1 3.96Å; F339-F605 HydrophobicContact CD2-CE1 3.96Å; F339-F605 HydrophobicContact CE2-CE1 4.16Å; F339-Y606 HydrophobicContact CB-CE2 4.03Å; F339-Y606 PolarHBondContact N-OH 3.22Å
340	L	92.5	Very high	85.9	Confident	9 Å²	9	43.1 Å²	43.1	5%	0.047	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.1	172	-67.1	169.1	0	0	0	113	D338 R390 Y574 A598 V602 L603 Y606	D338-L340 PolarHBondContact O-N 2.98Å; D338-L340 PolarHBondContact OD1-N 3.16Å; L340-R390 HydrophobicContact CB-CG 3.91Å; L340-R390 HydrophobicContact CD1-CG 3.81Å; L340-R390 HydrophobicContact CG-CG 4.49Å; L340-Y574 WeakPolarHBondContact O-CD1 3.42Å; L340-A598 HydrophobicContact CD2-CB 4.03Å; L340-V602 HydrophobicContact CD2-CB 4.02Å; L340-V602 HydrophobicContact CD2-CG1 3.47Å; L340-V602 VanDerWaalsContact CD2-CG1 3.47Å; L340-V602 HydrophobicContact CG-CG1 3.64Å; L340-L603 HydrophobicContact CD1-CD2 4.5Å; L340-L603 HydrophobicContact CD2-CD2 3.95Å; L340-L603 HydrophobicContact CD2-CG 4.39Å; L340-Y606 HydrophobicContact CD1-CD2 3.96Å; L340-Y606 HydrophobicContact CD1-CE2 4.09Å; L340-Y606 HydrophobicContact CG-CD2 4.05Å; L340-Y606 HydrophobicContact CG-CE2 3.88Å
341	Q	91	Very high	84.8	Confident	3 Å²	3	50.6 Å²	50.6	1%	0.014	24%	0.24	C	C	.	.	S	Bend	trans	-85.7	-144.2	168.7	-69.4	-175.7	45.4	0	0	110.4	D338 F339 Y574 V575	D338-Q341 HydrophobicContact CB-CB 4.48Å; D338-Q341 HydrophobicContact CB-CG 3.88Å; D338-Q341 VanDerWaalsContact CB-NE2 3.3Å; D338-Q341 WeakPolarHBondContact O-CB 3.34Å; D338-Q341 PolarHBondContact O-N 3Å; D338-Q341 PolarHBondContact OD2-NE2 3.42Å; F339-Q341 VanDerWaalsContact C-N 3.25Å; Q341-Y574 HydrophobicContact CG-CD1 4Å; Q341-Y574 HydrophobicContact CG-CE1 3.75Å; Q341-V575 HydrophobicContact CB-CG2 3.42Å; Q341-V575 VanDerWaalsContact CB-CG2 3.42Å; Q341-V575 HydrophobicContact CG-CG2 3.64Å
342	L	89.4	Confident	84.1	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-69.8	131	-179	-64.1	176.2	0	0	0	110.6	S304 M305 H550 Q553 Q572 V575	S304-L342 CarbonylContact C-O 3.58Å; S304-L342 VanDerWaalsContact CB-O 3.29Å; S304-L342 WeakPolarHBondContact CB-O 3.35Å; S304-L342 PolarHBondContact OG-O 2.91Å; M305-L342 HydrophobicContact CG-CB 4.21Å; M305-L342 HydrophobicContact SD-CB 4.3Å; L342-H550 HydrophobicContact CD1-CB 4.29Å; L342-Q553 VanDerWaalsContact CD1-OE1 3.31Å; L342-Q572 HydrophobicContact CD2-CB 3.87Å; L342-Q572 HydrophobicContact CD2-CG 4.09Å; L342-V575 HydrophobicContact CD1-CG1 4.47Å; L342-V575 HydrophobicContact CD2-CG2 4.44Å; L342-V575 HydrophobicContact CG-CB 4.43Å; L342-V575 HydrophobicContact CG-CG1 4.41Å; L342-V575 HydrophobicContact CG-CG2 4.07Å
343	P	90	Very high	83.8	Confident	14 Å²	14	52.9 Å²	52.9	9%	0.091	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-71.5	172.6	170.7	32.4	-35.9	0	0	0	111.1	F354 S570	P343-F354 HydrophobicContact CB-CE1 3.65Å; P343-F354 HydrophobicContact CB-CZ 3.92Å; P343-S570 WeakPolarHBondContact CD-O 3.48Å
344	P	86.9	Confident	83.6	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.019	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-60.3	142.7	169.7	-16.4	30.8	0	0	0	110.8	S304 E307 P346 A352	S304-P344 WeakPolarHBondContact O-CD 3.43Å; S304-P344 WeakPolarHBondContact O-CG 3.34Å; E307-P344 HydrophobicContact CG-CB 3.58Å; E307-P344 HydrophobicContact CG-CG 4.31Å; P344-P346 WeakPolarHBondContact O-CD 3.12Å; P344-A352 HydrophobicContact CB-CB 4.04Å
345	V	79.1	Confident	83.4	Confident	89 Å²	89	53.2 Å²	53.2	54%	0.539	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-73.3	117.7	-179.8	-178.2	0	0	0	0	108.8	K347	V345-K347 PolarHBondContact O-N 3.2Å
346	P	71.4	Confident	83.3	Confident	53 Å²	53	54.2 Å²	54.2	34%	0.344	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-66.3	132.1	178.9	27.4	-32.7	0	0	0	109.9	P344	P344-P346 WeakPolarHBondContact O-CD 3.12Å
347	K	62.8	Low	83.2	Confident	131 Å²	131	58 Å²	58	57%	0.57	28%	0.283	S	S	*	.	S	Bend	trans	-85.3	-19.1	176.3	-68.6	174.1	-175.2	149.2	0	112.5	E307 V345	E307-K347 IonicContact OE1-NZ 2.77Å; V345-K347 PolarHBondContact O-N 3.2Å
348	E	62.1	Low	83.3	Confident	153 Å²	153	58.2 Å²	58.2	72%	0.715	29%	0.286	S	S	*	.	S	Bend	trans	-138.1	-176.2	-177.9	-65.4	-174.6	-171.9	0	0	110.8	E350	E348-E350 PolarHBondContact O-N 2.8Å; E348-E350 VanDerWaalsContact O-N 3.13Å
349	K	58.2	Low	83.3	Confident	224 Å²	224	68.7 Å²	68.7	97%	0.974	33%	0.325	S	S	*	.	S	Bend	trans	-67	-5.2	176.6	-71.5	-176.8	178.5	178.6	0	113.9
350	E	65.9	Low	83.3	Confident	154 Å²	154	69.2 Å²	69.2	72%	0.72	33%	0.329	S	S	*	.	S	Bend	trans	-85.2	144.1	177.8	-66.9	-166.8	163.7	0	0	112.3	E348 A352	E348-E350 PolarHBondContact O-N 2.8Å; E348-E350 VanDerWaalsContact O-N 3.13Å; E350-A352 PolarHBondContact O-N 3Å
351	K	71.1	Confident	83.4	Confident	205 Å²	205	69.1 Å²	69.1	89%	0.891	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-66.4	124.9	176	-71.7	-175.3	177.6	-177.7	0	110	S353	K351-S353 PolarHBondContact O-N 3.07Å
352	A	82	Confident	83.4	Confident	32 Å²	32	78.3 Å²	78.3	26%	0.264	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-69.8	127.5	174.7	0	0	0	0	0	111	P344 E350	P344-A352 HydrophobicContact CB-CB 4.04Å; E350-A352 PolarHBondContact O-N 3Å
353	S	89.6	Confident	83.5	Confident	37 Å²	37	86.1 Å²	86.1	26%	0.259	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-74.4	137.4	174.3	55.6	0	0	0	0	111.8	A308 K351	A308-S353 WeakPolarHBondContact CB-OG 3.2Å; A308-S353 PolarHBondContact N-O 3.05Å; K351-S353 PolarHBondContact O-N 3.07Å
354	F	93.1	Very high	83.7	Confident	8 Å²	8	85.5 Å²	85.5	4%	0.035	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-72.1	149.3	179.3	-68.4	-83.2	0	0	0	112.9	A308 F339 P343 F356 Q357 D599 V602	A308-F354 VanDerWaalsContact CB-O 3.31Å; A308-F354 WeakPolarHBondContact CB-O 3.28Å; F339-F354 HydrophobicContact CD1-CD1 4.03Å; P343-F354 HydrophobicContact CB-CE1 3.65Å; P343-F354 HydrophobicContact CB-CZ 3.92Å; F354-F356 HydrophobicContact CB-CD1 3.59Å; F354-F356 HydrophobicContact CB-CE1 3.22Å; F354-F356 HydrophobicContact CB-CG 4.41Å; F354-F356 HydrophobicContact CB-CZ 3.8Å; F354-F356 HydrophobicContact CD1-CE1 4.17Å; F354-F356 AromaticContact CD2-CE1 3.99Å; F354-F356 HydrophobicContact CD2-CE1 3.99Å; F354-F356 HydrophobicContact CD2-CZ 4.04Å; F354-F356 HydrophobicContact CG-CD1 4.34Å; F354-F356 AromaticContact CG-CE1 3.56Å; F354-F356 HydrophobicContact CG-CE1 3.56Å; F354-F356 HydrophobicContact CG-CZ 4.06Å; F354-F356 PolarHBondContact O-N 2.78Å; F354-F356 VanDerWaalsContact O-N 3.08Å; F354-Q357 HydrophobicContact CB-CG 4.39Å; F354-Q357 VanDerWaalsContact O-CB 3.3Å; F354-Q357 WeakPolarHBondContact O-CB 3.28Å; F354-Q357 PolarHBondContact O-N 3.47Å; F354-D599 HydrophobicContact CE2-CB 4.12Å; F354-D599 HydrophobicContact CZ-CB 4.01Å; F354-V602 HydrophobicContact CD1-CG2 4.19Å; F354-V602 HydrophobicContact CD2-CG2 3.95Å; F354-V602 HydrophobicContact CE1-CG2 3.79Å; F354-V602 HydrophobicContact CE2-CG2 3.56Å; F354-V602 HydrophobicContact CG-CG2 4.26Å; F354-V602 HydrophobicContact CZ-CG2 3.46Å; F354-V602 VanDerWaalsContact CZ-CG2 3.46Å
355	C	93.9	Very high	84	Confident	0 Å²	0	85.8 Å²	85.8	0%	0	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-50.1	-38	179.2	-162.9	0	0	0	0	114.7	V303 V306 F311 F339 Q357 A358 W361	V303-C355 HydrophobicContact CG2-CB 3.97Å; V306-C355 HydrophobicContact CB-CB 4.35Å; V306-C355 VanDerWaalsContact O-CB 3.32Å; V306-C355 WeakPolarHBondContact O-CB 3.01Å; V306-C355 PolarHBondContact O-N 2.74Å; F311-C355 WeakPolarHBondContact CD2-SG 3.06Å; F339-C355 HydrophobicContact CE1-CB 3.83Å; F339-C355 HydrophobicContact CZ-CB 4Å; C355-Q357 PolarHBondContact O-N 3Å; C355-A358 WeakPolarHBondContact O-CB 3.02Å; C355-A358 PolarHBondContact O-N 2.9Å; C355-A358 VanDerWaalsContact O-N 3.09Å; C355-W361 HydrophobicContact CB-CZ3 4.31Å; C355-W361 VanDerWaalsContact SG-CZ3 3.59Å
356	F	93.8	Very high	84.6	Confident	21 Å²	21	87.5 Å²	87.5	9%	0.092	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-69.2	-15.2	179.3	67.6	-97.2	0	0	0	114.3	F339 F354 A358 W361 D601 V602 F605	F339-F356 HydrophobicContact CB-CD1 4.43Å; F339-F356 HydrophobicContact CB-CE1 4.25Å; F339-F356 AromaticContact CD1-CD1 3.77Å; F339-F356 HydrophobicContact CD1-CD1 3.77Å; F339-F356 HydrophobicContact CD1-CE1 4.11Å; F339-F356 AromaticContact CD2-CD1 3.76Å; F339-F356 HydrophobicContact CD2-CD1 3.76Å; F339-F356 HydrophobicContact CD2-CE1 4.39Å; F339-F356 AromaticContact CE1-CD1 3.86Å; F339-F356 HydrophobicContact CE1-CD1 3.86Å; F339-F356 HydrophobicContact CE2-CB 4.12Å; F339-F356 AromaticContact CE2-CD1 3.82Å; F339-F356 HydrophobicContact CE2-CD1 3.82Å; F339-F356 HydrophobicContact CE2-CG 4.44Å; F339-F356 AromaticContact CG-CD1 3.74Å; F339-F356 HydrophobicContact CG-CD1 3.74Å; F339-F356 HydrophobicContact CG-CE1 4.02Å; F339-F356 HydrophobicContact CZ-CB 4.15Å; F339-F356 AromaticContact CZ-CD1 3.88Å; F339-F356 HydrophobicContact CZ-CD1 3.88Å; F354-F356 HydrophobicContact CB-CD1 3.59Å; F354-F356 HydrophobicContact CB-CE1 3.22Å; F354-F356 HydrophobicContact CB-CG 4.41Å; F354-F356 HydrophobicContact CB-CZ 3.8Å; F354-F356 HydrophobicContact CD1-CE1 4.17Å; F354-F356 AromaticContact CD2-CE1 3.99Å; F354-F356 HydrophobicContact CD2-CE1 3.99Å; F354-F356 HydrophobicContact CD2-CZ 4.04Å; F354-F356 HydrophobicContact CG-CD1 4.34Å; F354-F356 AromaticContact CG-CE1 3.56Å; F354-F356 HydrophobicContact CG-CE1 3.56Å; F354-F356 HydrophobicContact CG-CZ 4.06Å; F354-F356 PolarHBondContact O-N 2.78Å; F354-F356 VanDerWaalsContact O-N 3.08Å; F356-A358 VanDerWaalsContact C-N 3.3Å; F356-W361 HydrophobicContact CB-CD2 4.25Å; F356-W361 HydrophobicContact CB-CG 4.41Å; F356-W361 HydrophobicContact CB-CZ2 4.43Å; F356-D601 HydrophobicContact CZ-CB 4.42Å; F356-V602 HydrophobicContact CE1-CG2 3.95Å; F356-V602 HydrophobicContact CZ-CG2 4.09Å; F356-F605 HydrophobicContact CB-CD2 4.02Å; F356-F605 HydrophobicContact CB-CE1 4.49Å; F356-F605 HydrophobicContact CB-CE2 3.73Å; F356-F605 HydrophobicContact CB-CZ 3.99Å; F356-F605 HydrophobicContact CD1-CD1 4.33Å; F356-F605 HydrophobicContact CD1-CG 4.31Å; F356-F605 HydrophobicContact CD2-CB 4.04Å; F356-F605 AromaticContact CD2-CD2 3.59Å; F356-F605 HydrophobicContact CD2-CD2 3.59Å; F356-F605 HydrophobicContact CD2-CE2 4.21Å; F356-F605 AromaticContact CD2-CG 3.82Å; F356-F605 HydrophobicContact CD2-CG 3.82Å; F356-F605 HydrophobicContact CE2-CB 3.78Å; F356-F605 HydrophobicContact CE2-CD2 4.23Å; F356-F605 HydrophobicContact CE2-CG 4.08Å; F356-F605 HydrophobicContact CG-CD1 4.31Å; F356-F605 AromaticContact CG-CD2 3.82Å; F356-F605 HydrophobicContact CG-CD2 3.82Å; F356-F605 HydrophobicContact CG-CE2 4.05Å; F356-F605 AromaticContact CG-CG 3.96Å; F356-F605 HydrophobicContact CG-CG 3.96Å; F356-F605 HydrophobicContact CG-CZ 4.39Å; F356-F605 HydrophobicContact CZ-CB 4.07Å; F356-F605 HydrophobicContact CZ-CG 4.44Å
357	Q	93.9	Very high	85.5	Confident	78 Å²	78	86.6 Å²	86.6	36%	0.364	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-83.9	-7.5	174.8	-59.9	174.5	-39.1	0	0	112	F354 C355 D601	F354-Q357 HydrophobicContact CB-CG 4.39Å; F354-Q357 VanDerWaalsContact O-CB 3.3Å; F354-Q357 WeakPolarHBondContact O-CB 3.28Å; F354-Q357 PolarHBondContact O-N 3.47Å; C355-Q357 PolarHBondContact O-N 3Å; Q357-D601 PolarHBondContact NE2-OD2 3.03Å
358	A	94.3	Very high	86.9	Confident	6 Å²	6	83 Å²	83	5%	0.05	38%	0.376	C	S	.	.	S	Bend	trans	-60.2	142	177.6	0	0	0	0	0	111.3	A308 F311 C355 F356 S360 W361	A308-A358 HydrophobicContact CB-CB 3.98Å; F311-A358 HydrophobicContact CB-CB 4.3Å; F311-A358 HydrophobicContact CD1-CB 3.94Å; C355-A358 WeakPolarHBondContact O-CB 3.02Å; C355-A358 PolarHBondContact O-N 2.9Å; C355-A358 VanDerWaalsContact O-N 3.09Å; F356-A358 VanDerWaalsContact C-N 3.3Å; A358-S360 PolarHBondContact O-N 2.86Å; A358-W361 HydrophobicContact CB-CB 4.24Å; A358-W361 WeakPolarHBondContact O-CB 3.16Å; A358-W361 PolarHBondContact O-N 3.49Å; A358-W361 VanDerWaalsContact O-N 3.08Å
359	R	93.9	Very high	88.3	Confident	220 Å²	220	78 Å²	78	83%	0.83	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-31.6	-178.8	-63.8	179.8	-179.7	-179.3	0.5	111.2	D312	D312-R359 PolarHBondContact OD1-N 3.47Å; D312-R359 PolarHBondContact OD2-N 3.4Å
360	S	94.1	Very high	89.9	Confident	14 Å²	14	68.1 Å²	68.1	10%	0.098	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-20	-179.5	-48.6	0	0	0	0	113.2	D312 A358 R362 K363 V364	D312-S360 WeakPolarHBondContact OD1-CB 3.36Å; D312-S360 PolarHBondContact OD1-N 2.91Å; D312-S360 PolarHBondContact OD1-OG 2.98Å; A358-S360 PolarHBondContact O-N 2.86Å; S360-R362 PolarHBondContact O-N 3.11Å; S360-K363 PolarHBondContact O-N 3.34Å; S360-V364 WeakPolarHBondContact O-CB 3.31Å; S360-V364 VanDerWaalsContact O-CG2 3.23Å; S360-V364 WeakPolarHBondContact O-CG2 3.45Å; S360-V364 PolarHBondContact O-N 3.47Å
361	W	94.5	Very high	91.1	Very high	7 Å²	7	60.9 Å²	60.9	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-54.4	-51.8	-172.3	-179.8	-93	0	0	0	112.4	F220 V303 F311 V335 F339 C355 F356 A358 K363 V364 I365	F220-W361 HydrophobicContact CB-CH2 4.39Å; F220-W361 HydrophobicContact CB-CZ2 4.07Å; F220-W361 AromaticContact CD1-CZ2 3.98Å; F220-W361 HydrophobicContact CD1-CZ2 3.98Å; F220-W361 AromaticContact CD2-CH2 3.74Å; F220-W361 HydrophobicContact CD2-CH2 3.74Å; F220-W361 AromaticContact CD2-CZ2 3.9Å; F220-W361 HydrophobicContact CD2-CZ2 3.9Å; F220-W361 HydrophobicContact CE1-CZ2 4.36Å; F220-W361 HydrophobicContact CE2-CH2 4.11Å; F220-W361 HydrophobicContact CE2-CZ2 4.3Å; F220-W361 HydrophobicContact CG-CH2 4.01Å; F220-W361 AromaticContact CG-CZ2 3.71Å; F220-W361 HydrophobicContact CG-CZ2 3.71Å; F220-W361 HydrophobicContact CZ-CZ2 4.5Å; V303-W361 HydrophobicContact CG2-CZ3 4.28Å; F311-W361 HydrophobicContact CE1-CE3 4.29Å; F311-W361 HydrophobicContact CZ-CE3 4.19Å; V335-W361 HydrophobicContact CG1-CH2 4.03Å; V335-W361 HydrophobicContact CG1-CZ3 4.29Å; F339-W361 HydrophobicContact CE2-CH2 4.35Å; F339-W361 HydrophobicContact CE2-CZ2 4.4Å; F339-W361 HydrophobicContact CZ-CH2 4.11Å; C355-W361 HydrophobicContact CB-CZ3 4.31Å; C355-W361 VanDerWaalsContact SG-CZ3 3.59Å; F356-W361 HydrophobicContact CB-CD2 4.25Å; F356-W361 HydrophobicContact CB-CG 4.41Å; F356-W361 HydrophobicContact CB-CZ2 4.43Å; A358-W361 HydrophobicContact CB-CB 4.24Å; A358-W361 WeakPolarHBondContact O-CB 3.16Å; A358-W361 PolarHBondContact O-N 3.49Å; A358-W361 VanDerWaalsContact O-N 3.08Å; W361-K363 VanDerWaalsContact C-N 3.27Å; W361-K363 PolarHBondContact O-N 3.39Å; W361-V364 PolarHBondContact O-N 3.41Å; W361-I365 HydrophobicContact CD2-CG1 3.88Å; W361-I365 HydrophobicContact CE3-CG1 4.1Å; W361-I365 HydrophobicContact CG-CG1 4.44Å; W361-I365 HydrophobicContact CH2-CG1 4.23Å; W361-I365 HydrophobicContact CZ2-CG1 4.02Å; W361-I365 HydrophobicContact CZ3-CG1 4.25Å; W361-I365 WeakPolarHBondContact O-CB 3.26Å; W361-I365 PolarHBondContact O-N 3.47Å
362	R	91.1	Very high	92	Very high	195 Å²	195	54.6 Å²	54.6	74%	0.736	26%	0.256	S	S	*	.	H	α-helix	trans	-67.1	-25.4	-179.1	-63.2	-173.4	-175.6	-180	5.4	113.8	S360	S360-R362 PolarHBondContact O-N 3.11Å
363	K	91.6	Very high	92.2	Very high	164 Å²	164	57.2 Å²	57.2	71%	0.713	26%	0.263	S	S	*	.	H	α-helix	trans	-81.5	-34.6	178.1	-63.3	-179.1	-178.9	179.1	0	111.4	S360 W361	S360-K363 PolarHBondContact O-N 3.34Å; W361-K363 VanDerWaalsContact C-N 3.27Å; W361-K363 PolarHBondContact O-N 3.39Å
364	V	94	Very high	92	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-87.6	-46.6	-174.2	178.2	0	0	0	0	111.3	N218 F311 E315 P327 F328 L333 S360 W361	N218-V364 WeakPolarHBondContact CB-O 3.46Å; N218-V364 PolarHBondContact ND2-O 3.45Å; F311-V364 HydrophobicContact CZ-CG1 4.43Å; E315-V364 HydrophobicContact CG-CG2 3.89Å; P327-V364 HydrophobicContact CB-CG2 3.93Å; F328-V364 HydrophobicContact CB-CG1 4.32Å; F328-V364 HydrophobicContact CD2-CG1 4.47Å; L333-V364 HydrophobicContact CB-CG1 4.49Å; L333-V364 HydrophobicContact CD1-CG1 3.31Å; L333-V364 HydrophobicContact CG-CG1 3.92Å; S360-V364 WeakPolarHBondContact O-CB 3.31Å; S360-V364 VanDerWaalsContact O-CG2 3.23Å; S360-V364 WeakPolarHBondContact O-CG2 3.45Å; S360-V364 PolarHBondContact O-N 3.47Å; W361-V364 PolarHBondContact O-N 3.41Å
365	I	93.8	Very high	91.5	Very high	10 Å²	10	61.1 Å²	61.1	5%	0.051	28%	0.275	C	S	.	.			trans	-84.8	117.8	-177.3	-57.9	-57.4	0	0	0	110	F220 L333 V335 W361 N368	F220-I365 HydrophobicContact CB-CD1 4.47Å; F220-I365 HydrophobicContact CB-CG2 3.51Å; L333-I365 HydrophobicContact CB-CD1 4.46Å; V335-I365 HydrophobicContact CB-CD1 4.46Å; V335-I365 HydrophobicContact CG2-CD1 3.86Å; W361-I365 HydrophobicContact CD2-CG1 3.88Å; W361-I365 HydrophobicContact CE3-CG1 4.1Å; W361-I365 HydrophobicContact CG-CG1 4.44Å; W361-I365 HydrophobicContact CH2-CG1 4.23Å; W361-I365 HydrophobicContact CZ2-CG1 4.02Å; W361-I365 HydrophobicContact CZ3-CG1 4.25Å; W361-I365 WeakPolarHBondContact O-CB 3.26Å; W361-I365 PolarHBondContact O-N 3.47Å; I365-N368 WeakPolarHBondContact CG2-OD1 3.43Å
366	Q	91.5	Very high	90.8	Very high	124 Å²	124	63.2 Å²	63.2	58%	0.579	28%	0.282	S	S	*	.			trans	-95.2	-36.4	-175.9	-66.8	170.6	-29.5	0	0	112.5	N218	N218-Q366 HydrophobicContact CB-CB 4.42Å; N218-Q366 HydrophobicContact CB-CG 4.17Å; N218-Q366 PolarHBondContact O-N 3.13Å
367	V	90.9	Very high	90.3	Very high	34 Å²	34	62.5 Å²	62.5	21%	0.206	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.6	-174.8	-173.9	0	0	0	0	109.8	K217 N218 V219 F220 M369	K217-V367 HydrophobicContact CB-CG2 4.2Å; K217-V367 HydrophobicContact CD-CG2 3.66Å; K217-V367 HydrophobicContact CG-CG2 4.49Å; N218-V367 PolarHBondContact O-N 3.4Å; V219-V367 WeakPolarHBondContact CA-O 3.34Å; V219-V367 HydrophobicContact CG2-CB 4.36Å; F220-V367 PolarHBondContact N-O 2.96Å; V367-M369 HydrophobicContact CG1-CG 3.75Å; V367-M369 HydrophobicContact CG1-SD 4.08Å
368	N	92.5	Very high	89.7	Confident	55 Å²	55	64.7 Å²	64.7	29%	0.294	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.8	174	-61.8	-63.2	0	0	0	109.6	F220 I365 L609	F220-N368 HydrophobicContact CD1-CB 4.46Å; F220-N368 WeakPolarHBondContact CD1-OD1 3.42Å; F220-N368 CarbonylContact O-C 3.56Å; F220-N368 VanDerWaalsContact O-CA 3.28Å; F220-N368 WeakPolarHBondContact O-CA 3.36Å; I365-N368 WeakPolarHBondContact CG2-OD1 3.43Å; N368-L609 HydrophobicContact CB-CD1 3.69Å; N368-L609 HydrophobicContact CB-CG 4.08Å
369	M	91.1	Very high	89.4	Confident	49 Å²	49	67.3 Å²	67.3	24%	0.241	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134	-179	-53.2	-174.9	97	0	0	111.1	A208 V209 A212 V219 F220 F221 T222 V367	A208-M369 HydrophobicContact CB-CE 3.91Å; V209-M369 HydrophobicContact CB-SD 4.17Å; V209-M369 HydrophobicContact CG2-CB 3.88Å; V209-M369 HydrophobicContact CG2-CG 4.34Å; V209-M369 HydrophobicContact CG2-SD 3.62Å; A212-M369 HydrophobicContact CB-SD 4.14Å; V219-M369 HydrophobicContact CG1-SD 4.35Å; F220-M369 PolarHBondContact O-N 3.11Å; F221-M369 CarbonylContact C-O 3.48Å; F221-M369 WeakPolarHBondContact CA-O 3.16Å; F221-M369 HydrophobicContact CB-CB 4.2Å; T222-M369 PolarHBondContact N-O 3.13Å; V367-M369 HydrophobicContact CG1-CG 3.75Å; V367-M369 HydrophobicContact CG1-SD 4.08Å
370	E	91.9	Very high	89.1	Confident	16 Å²	16	62.7 Å²	62.7	8%	0.075	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.1	178.1	-173.7	175.2	-168.3	0	0	110.1	T222 R390 L609 R610	T222-E370 HydrophobicContact CG2-CB 4.21Å; T222-E370 HydrophobicContact CG2-CG 4.29Å; E370-R390 IonicContact OE1-NH1 3.49Å; E370-L609 HydrophobicContact CB-CD2 4.19Å; E370-R610 IonicContact OE1-CZ 3.76Å; E370-R610 IonicContact OE1-NE 3.96Å; E370-R610 IonicContact OE1-NH2 3.73Å; E370-R610 PolarHBondContact OE1-NH2 2.78Å; E370-R610 IonicContact OE2-CZ 3.66Å; E370-R610 IonicContact OE2-NE 3.44Å; E370-R610 PolarHBondContact OE2-NE 3.26Å; E370-R610 VanDerWaalsContact OE2-NE 3.11Å; E370-R610 IonicContact OE2-NH2 3.11Å
371	L	91.4	Very high	88.8	Confident	3 Å²	3	68 Å²	68	2%	0.016	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.8	169.5	-57.6	179.1	0	0	0	109.2	E205 Q206 V209 F221 T222 G223 K229 L232	E205-L371 HydrophobicContact CB-CD2 3.78Å; E205-L371 WeakPolarHBondContact OE2-CA 3.22Å; Q206-L371 HydrophobicContact CG-CD1 4.41Å; Q206-L371 HydrophobicContact CG-CD2 4.06Å; V209-L371 HydrophobicContact CG2-CD2 4.3Å; F221-L371 HydrophobicContact CD2-CD1 4.29Å; T222-L371 PolarHBondContact O-N 2.75Å; G223-L371 WeakPolarHBondContact CA-O 3.33Å; K229-L371 HydrophobicContact CG-CD1 4.11Å; L232-L371 HydrophobicContact CD2-CD1 4.35Å
372	T	88.2	Confident	88.6	Confident	73 Å²	73	67.8 Å²	67.8	45%	0.448	33%	0.326	S	S	.	.			trans	-103.5	-31.2	-174.6	61.8	0	0	0	0	113	E205 V374	E205-T372 PolarHBondContact OE1-OG1 3.41Å; E205-T372 PolarHBondContact OE2-N 2.77Å; E205-T372 PolarHBondContact OE2-OG1 2.96Å; T372-V374 PolarHBondContact O-N 3.34Å
373	E	86.1	Confident	88.5	Confident	86 Å²	86	59.1 Å²	59.1	40%	0.402	29%	0.294	S	S	.	.			trans	-73.3	109.3	-177.3	-165.4	-166.7	145.9	0	0	112.1	S203 T227 R375	S203-E373 WeakPolarHBondContact CB-OE2 3.42Å; T227-E373 VanDerWaalsContact CA-O 3.31Å; T227-E373 WeakPolarHBondContact CA-O 3.44Å; E373-R375 HydrophobicContact CG-CG 4.41Å; E373-R375 IonicContact OE1-CZ 3.15Å; E373-R375 IonicContact OE1-NE 2.78Å; E373-R375 PolarHBondContact OE1-NE 3.5Å; E373-R375 IonicContact OE1-NH2 2.71Å; E373-R375 PolarHBondContact OE1-NH2 2.99Å; E373-R375 IonicContact OE2-CZ 3.23Å; E373-R375 IonicContact OE2-NE 3.38Å; E373-R375 IonicContact OE2-NH2 2.8Å; E373-R375 PolarHBondContact OE2-NH2 2.84Å
374	V	86.4	Confident	88.4	Confident	24 Å²	24	54 Å²	54	15%	0.145	28%	0.279	C	S	.	.			trans	-80.8	124.3	173.5	-178.7	0	0	0	0	109.5	T227 T372 I383	T227-V374 HydrophobicContact CG2-CG2 4.05Å; T372-V374 PolarHBondContact O-N 3.34Å; V374-I383 HydrophobicContact CB-CD1 4.37Å; V374-I383 HydrophobicContact CB-CG1 4.43Å; V374-I383 HydrophobicContact CB-CG2 4.3Å; V374-I383 HydrophobicContact CG1-CD1 4.43Å; V374-I383 HydrophobicContact CG1-CG1 4.19Å; V374-I383 HydrophobicContact CG2-CG2 4.17Å
375	R	81.6	Confident	88.3	Confident	104 Å²	104	54.5 Å²	54.5	39%	0.392	28%	0.281	S	S	.	.			trans	-114.5	-8.5	-177.6	-69	-170.1	170.3	-173.6	-2.3	114.7	K201 G226 E373	K201-R375 PolarHBondContact O-NH1 3.05Å; G226-R375 PolarHBondContact O-N 3.06Å; E373-R375 HydrophobicContact CG-CG 4.41Å; E373-R375 IonicContact OE1-CZ 3.15Å; E373-R375 IonicContact OE1-NE 2.78Å; E373-R375 PolarHBondContact OE1-NE 3.5Å; E373-R375 IonicContact OE1-NH2 2.71Å; E373-R375 PolarHBondContact OE1-NH2 2.99Å; E373-R375 IonicContact OE2-CZ 3.23Å; E373-R375 IonicContact OE2-NE 3.38Å; E373-R375 IonicContact OE2-NH2 2.8Å; E373-R375 PolarHBondContact OE2-NH2 2.84Å
376	R	80.8	Confident	88.2	Confident	43 Å²	43	54.4 Å²	54.4	16%	0.162	28%	0.281	C	S	.	.	S	Bend	trans	-77.4	-53.2	-178.1	177.3	-173.4	-65	147	2.6	110.9	G226 T556 S578	G226-R376 PolarHBondContact O-N 3.05Å; R376-T556 HydrophobicContact CG-CG2 3.84Å; R376-T556 PolarHBondContact NE-OG1 3.15Å; R376-T556 VanDerWaalsContact NE-OG1 3.14Å; R376-S578 PolarHBondContact NH1-O 3.27Å
377	Q	82	Confident	88.1	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.028	27%	0.272	C	S	.	.			trans	-86.5	143	175.5	-63.8	81	9.8	0	0	109.7	F382 I383 L386 S578 A580	Q377-F382 HydrophobicContact CB-CD1 4.17Å; Q377-F382 HydrophobicContact CG-CD1 3.56Å; Q377-F382 HydrophobicContact CG-CE1 3.63Å; Q377-I383 HydrophobicContact CB-CD1 4.32Å; Q377-I383 HydrophobicContact CB-CG1 3.76Å; Q377-L386 HydrophobicContact CG-CD1 4.09Å; Q377-S578 PolarHBondContact NE2-O 3.46Å; Q377-A580 PolarHBondContact NE2-O 3.09Å
378	T	82.9	Confident	88.1	Confident	124 Å²	124	52.1 Å²	52.1	76%	0.761	27%	0.273	S	S	*	.			trans	-100.4	-23.4	176.2	49.2	0	0	0	0	112.7
379	D	86.8	Confident	88.1	Confident	61 Å²	61	49.7 Å²	49.7	33%	0.326	26%	0.259	S	S	.	.			trans	-83.9	121.8	-178.6	173.7	18.8	0	0	0	111.6	N381 F382 I383	D379-N381 VanDerWaalsContact C-N 3.35Å; D379-N381 PolarHBondContact O-N 3.3Å; D379-N381 PolarHBondContact OD1-N 2.83Å; D379-F382 HydrophobicContact CB-CB 4.01Å; D379-F382 PolarHBondContact O-N 2.93Å; D379-F382 WeakPolarHBondContact OD2-CB 3.39Å; D379-F382 PolarHBondContact OD2-N 2.84Å; D379-I383 WeakPolarHBondContact O-CD1 3.43Å; D379-I383 WeakPolarHBondContact O-CG1 3.46Å; D379-I383 PolarHBondContact O-N 3.39Å
380	Q	87.4	Confident	88.2	Confident	123 Å²	123	47.8 Å²	47.8	58%	0.575	25%	0.25	S	C	*	.	H	α-helix	trans	-67.5	-33.4	-178.6	-167	62.4	24.3	0	0	112.8	I383 S384	Q380-I383 PolarHBondContact O-N 3.21Å; Q380-S384 WeakPolarHBondContact O-CB 3.44Å; Q380-S384 PolarHBondContact O-N 2.86Å; Q380-S384 PolarHBondContact O-OG 2.8Å
381	N	89.1	Confident	88.1	Confident	127 Å²	127	49.1 Å²	49.1	68%	0.679	26%	0.259	S	S	*	.	H	α-helix	trans	-67.7	-46.2	177.3	-71.4	-6.7	0	0	0	109.6	D379 I383 S384 L385	D379-N381 VanDerWaalsContact C-N 3.35Å; D379-N381 PolarHBondContact O-N 3.3Å; D379-N381 PolarHBondContact OD1-N 2.83Å; N381-I383 PolarHBondContact O-N 2.78Å; N381-S384 PolarHBondContact O-N 2.92Å; N381-L385 WeakPolarHBondContact O-CB 3.27Å; N381-L385 PolarHBondContact O-N 3.02Å
382	F	89	Confident	88	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-37.6	175.7	-171.9	-135.9	0	0	0	113.2	Q377 D379 L385 L386 A580 L583 L586	Q377-F382 HydrophobicContact CB-CD1 4.17Å; Q377-F382 HydrophobicContact CG-CD1 3.56Å; Q377-F382 HydrophobicContact CG-CE1 3.63Å; D379-F382 HydrophobicContact CB-CB 4.01Å; D379-F382 PolarHBondContact O-N 2.93Å; D379-F382 WeakPolarHBondContact OD2-CB 3.39Å; D379-F382 PolarHBondContact OD2-N 2.84Å; F382-L385 HydrophobicContact CD2-CD2 4.48Å; F382-L385 PolarHBondContact O-N 3.3Å; F382-L386 HydrophobicContact CD1-CD1 4.22Å; F382-L386 HydrophobicContact CD2-CD1 4.47Å; F382-L386 HydrophobicContact CD2-CG 4.24Å; F382-L386 HydrophobicContact CE1-CD1 3.83Å; F382-L386 HydrophobicContact CE2-CD1 4.1Å; F382-L386 HydrophobicContact CE2-CD2 4.08Å; F382-L386 HydrophobicContact CE2-CG 3.9Å; F382-L386 HydrophobicContact CZ-CD1 3.75Å; F382-L386 HydrophobicContact CZ-CD2 4.18Å; F382-L386 HydrophobicContact CZ-CG 4.05Å; F382-L386 WeakPolarHBondContact O-CB 3.33Å; F382-L386 WeakPolarHBondContact O-CG 3.34Å; F382-L386 PolarHBondContact O-N 2.89Å; F382-A580 HydrophobicContact CE1-CB 4.3Å; F382-A580 HydrophobicContact CZ-CB 4.06Å; F382-L583 HydrophobicContact CB-CB 4.35Å; F382-L583 HydrophobicContact CD2-CB 4.12Å; F382-L583 HydrophobicContact CD2-CD1 3.93Å; F382-L583 HydrophobicContact CE2-CD1 4.09Å; F382-L583 HydrophobicContact CG-CB 4.13Å; F382-L586 HydrophobicContact CE2-CD2 3.9Å; F382-L586 HydrophobicContact CZ-CD2 4.08Å
383	I	89.7	Confident	88	Confident	14 Å²	14	55.9 Å²	55.9	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-47.2	173.5	-70	163.4	0	0	0	110.7	V374 Q377 D379 Q380 N381 L385 L386 Q387	V374-I383 HydrophobicContact CB-CD1 4.37Å; V374-I383 HydrophobicContact CB-CG1 4.43Å; V374-I383 HydrophobicContact CB-CG2 4.3Å; V374-I383 HydrophobicContact CG1-CD1 4.43Å; V374-I383 HydrophobicContact CG1-CG1 4.19Å; V374-I383 HydrophobicContact CG2-CG2 4.17Å; Q377-I383 HydrophobicContact CB-CD1 4.32Å; Q377-I383 HydrophobicContact CB-CG1 3.76Å; D379-I383 WeakPolarHBondContact O-CD1 3.43Å; D379-I383 WeakPolarHBondContact O-CG1 3.46Å; D379-I383 PolarHBondContact O-N 3.39Å; Q380-I383 PolarHBondContact O-N 3.21Å; N381-I383 PolarHBondContact O-N 2.78Å; I383-L385 VanDerWaalsContact C-N 3.34Å; I383-L385 PolarHBondContact O-N 2.96Å; I383-L386 PolarHBondContact O-N 3.05Å; I383-Q387 HydrophobicContact CG2-CG 4.42Å; I383-Q387 VanDerWaalsContact O-CG 3.31Å; I383-Q387 WeakPolarHBondContact O-CG 3.47Å; I383-Q387 PolarHBondContact O-N 3.39Å
384	S	90	Very high	88	Confident	56 Å²	56	53.7 Å²	53.7	39%	0.392	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-41.5	-179.2	-55.7	0	0	0	0	111.3	Q380 N381 Q387 A388	Q380-S384 WeakPolarHBondContact O-CB 3.44Å; Q380-S384 PolarHBondContact O-N 2.86Å; Q380-S384 PolarHBondContact O-OG 2.8Å; N381-S384 PolarHBondContact O-N 2.92Å; S384-Q387 PolarHBondContact O-N 3.29Å; S384-A388 PolarHBondContact O-N 3.22Å
385	L	90.9	Very high	88	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-57.8	-50.7	172.7	-175.4	152.7	0	0	0	111.5	N381 F382 I383 Q387 A388 V389 V398 T401 L402	N381-L385 WeakPolarHBondContact O-CB 3.27Å; N381-L385 PolarHBondContact O-N 3.02Å; F382-L385 HydrophobicContact CD2-CD2 4.48Å; F382-L385 PolarHBondContact O-N 3.3Å; I383-L385 VanDerWaalsContact C-N 3.34Å; I383-L385 PolarHBondContact O-N 2.96Å; L385-Q387 VanDerWaalsContact C-N 3.28Å; L385-Q387 PolarHBondContact O-N 2.93Å; L385-A388 WeakPolarHBondContact O-CB 3.06Å; L385-A388 PolarHBondContact O-N 3.5Å; L385-V389 HydrophobicContact CD2-CG2 4.09Å; L385-V389 WeakPolarHBondContact O-CG2 3.45Å; L385-V389 PolarHBondContact O-N 3.32Å; L385-V398 HydrophobicContact CD1-CB 4.46Å; L385-V398 HydrophobicContact CD1-CG1 4.01Å; L385-V398 HydrophobicContact CD1-CG2 4.37Å; L385-V398 HydrophobicContact CD2-CG1 4.28Å; L385-V398 HydrophobicContact CG-CB 4.4Å; L385-V398 HydrophobicContact CG-CG1 3.74Å; L385-V398 HydrophobicContact CG-CG2 4.06Å; L385-T401 HydrophobicContact CD1-CG2 3.88Å; L385-L402 HydrophobicContact CD1-CD2 4.47Å; L385-L402 HydrophobicContact CD1-CG 4.36Å; L385-L402 HydrophobicContact CD2-CD2 4.1Å; L385-L402 HydrophobicContact CD2-CG 4.43Å
386	L	91.3	Very high	88.2	Confident	8 Å²	8	58.8 Å²	58.8	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-32.4	179	-72.8	177.1	0	0	0	112.5	Q377 F382 I383 R390 Y574 L577	Q377-L386 HydrophobicContact CG-CD1 4.09Å; F382-L386 HydrophobicContact CD1-CD1 4.22Å; F382-L386 HydrophobicContact CD2-CD1 4.47Å; F382-L386 HydrophobicContact CD2-CG 4.24Å; F382-L386 HydrophobicContact CE1-CD1 3.83Å; F382-L386 HydrophobicContact CE2-CD1 4.1Å; F382-L386 HydrophobicContact CE2-CD2 4.08Å; F382-L386 HydrophobicContact CE2-CG 3.9Å; F382-L386 HydrophobicContact CZ-CD1 3.75Å; F382-L386 HydrophobicContact CZ-CD2 4.18Å; F382-L386 HydrophobicContact CZ-CG 4.05Å; F382-L386 WeakPolarHBondContact O-CB 3.33Å; F382-L386 WeakPolarHBondContact O-CG 3.34Å; F382-L386 PolarHBondContact O-N 2.89Å; I383-L386 PolarHBondContact O-N 3.05Å; L386-R390 WeakPolarHBondContact O-CB 3.46Å; L386-R390 PolarHBondContact O-N 2.86Å; L386-Y574 VanDerWaalsContact O-CE2 3.31Å; L386-Y574 WeakPolarHBondContact O-CE2 3.16Å; L386-L577 HydrophobicContact CD2-CB 3.76Å
387	Q	90.9	Very high	88.5	Confident	85 Å²	85	64.1 Å²	64.1	40%	0.397	34%	0.337	S	S	.	.	H	α-helix	trans	-68.6	-38.4	174.2	-73.7	178.8	9	0	0	112.1	I383 S384 L385 R390 V391	I383-Q387 HydrophobicContact CG2-CG 4.42Å; I383-Q387 VanDerWaalsContact O-CG 3.31Å; I383-Q387 WeakPolarHBondContact O-CG 3.47Å; I383-Q387 PolarHBondContact O-N 3.39Å; S384-Q387 PolarHBondContact O-N 3.29Å; L385-Q387 VanDerWaalsContact C-N 3.28Å; L385-Q387 PolarHBondContact O-N 2.93Å; Q387-R390 WeakPolarHBondContact O-CB 3.4Å; Q387-R390 PolarHBondContact O-N 3.19Å; Q387-V391 PolarHBondContact O-N 2.83Å
388	A	91.3	Very high	88.7	Confident	26 Å²	26	64.4 Å²	64.4	22%	0.215	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-48.3	174.1	0	0	0	0	0	110.9	S384 L385 R390 V391 G392 R393	S384-A388 PolarHBondContact O-N 3.22Å; L385-A388 WeakPolarHBondContact O-CB 3.06Å; L385-A388 PolarHBondContact O-N 3.5Å; A388-R390 VanDerWaalsContact C-N 3.3Å; A388-R390 PolarHBondContact O-N 3.05Å; A388-V391 VanDerWaalsContact O-CG2 3.22Å; A388-V391 WeakPolarHBondContact O-CG2 3.3Å; A388-V391 PolarHBondContact O-N 2.77Å; A388-V391 VanDerWaalsContact O-N 3.14Å; A388-G392 PolarHBondContact O-N 2.99Å; A388-R393 CarbonylContact C-O 3.09Å; A388-R393 VanDerWaalsContact CB-O 3.3Å; A388-R393 WeakPolarHBondContact CB-O 3.24Å; A388-R393 PolarHBondContact O-N 2.91Å; A388-R393 VanDerWaalsContact O-O 3.08Å
389	V	91.2	Very high	88.8	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.018	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-39	175.6	173.6	0	0	0	0	111.7	L385 V391 G392 V398 Y574 L577 V596	L385-V389 HydrophobicContact CD2-CG2 4.09Å; L385-V389 WeakPolarHBondContact O-CG2 3.45Å; L385-V389 PolarHBondContact O-N 3.32Å; V389-V391 PolarHBondContact O-N 2.9Å; V389-G392 PolarHBondContact O-N 3.21Å; V389-G392 VanDerWaalsContact O-N 3.07Å; V389-V398 HydrophobicContact CG2-CG1 4.3Å; V389-Y574 HydrophobicContact CG1-CD2 4.2Å; V389-L577 HydrophobicContact CG1-CD1 3.88Å; V389-L577 HydrophobicContact CG2-CD1 4.4Å; V389-V596 HydrophobicContact CB-CG1 4.3Å; V389-V596 HydrophobicContact CG1-CG1 3.79Å
390	R	92.5	Very high	88.8	Confident	9 Å²	9	59.6 Å²	59.6	3%	0.034	32%	0.318	C	S	.	.	H	α-helix	trans	-56	-36.2	177.3	-174.3	-178.4	179.6	-135.6	-13.9	112.6	S224 D338 L340 E370 L386 Q387 A388 Y574	S224-R390 WeakPolarHBondContact OG-CD 3.46Å; S224-R390 PolarHBondContact OG-NH1 3.05Å; D338-R390 IonicContact OD1-CZ 2.93Å; D338-R390 IonicContact OD1-NE 2.78Å; D338-R390 PolarHBondContact OD1-NE 3.26Å; D338-R390 IonicContact OD1-NH2 3.85Å; D338-R390 PolarHBondContact OD1-NH2 2.63Å; D338-R390 IonicContact OD2-CZ 3.62Å; D338-R390 IonicContact OD2-NE 3.76Å; D338-R390 PolarHBondContact OD2-NE 3.43Å; D338-R390 IonicContact OD2-NH2 3.87Å; L340-R390 HydrophobicContact CB-CG 3.91Å; L340-R390 HydrophobicContact CD1-CG 3.81Å; L340-R390 HydrophobicContact CG-CG 4.49Å; E370-R390 IonicContact OE1-NH1 3.49Å; L386-R390 WeakPolarHBondContact O-CB 3.46Å; L386-R390 PolarHBondContact O-N 2.86Å; Q387-R390 WeakPolarHBondContact O-CB 3.4Å; Q387-R390 PolarHBondContact O-N 3.19Å; A388-R390 VanDerWaalsContact C-N 3.3Å; A388-R390 PolarHBondContact O-N 3.05Å; R390-Y574 HydrophobicContact CB-CD1 4.39Å; R390-Y574 HydrophobicContact CB-CD2 3.82Å; R390-Y574 HydrophobicContact CB-CE1 4.14Å; R390-Y574 HydrophobicContact CB-CE2 3.55Å; R390-Y574 HydrophobicContact CB-CG 4.24Å; R390-Y574 WeakPolarHBondContact CD-OH 3.49Å; R390-Y574 HydrophobicContact CG-CD1 4.17Å; R390-Y574 HydrophobicContact CG-CD2 4.44Å; R390-Y574 HydrophobicContact CG-CE1 3.69Å; R390-Y574 HydrophobicContact CG-CE2 4.01Å
391	V	91.3	Very high	88.8	Confident	45 Å²	45	56.2 Å²	56.2	27%	0.273	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	9	-178.8	-60.4	0	0	0	0	113.2	Q387 A388 V389 R393 L603	Q387-V391 PolarHBondContact O-N 2.83Å; A388-V391 VanDerWaalsContact O-CG2 3.22Å; A388-V391 WeakPolarHBondContact O-CG2 3.3Å; A388-V391 PolarHBondContact O-N 2.77Å; A388-V391 VanDerWaalsContact O-N 3.14Å; V389-V391 PolarHBondContact O-N 2.9Å; V391-R393 VanDerWaalsContact C-N 3.33Å; V391-R393 HydrophobicContact CG2-CB 4.1Å; V391-R393 HydrophobicContact CG2-CG 3.94Å; V391-L603 HydrophobicContact CB-CD2 4.07Å; V391-L603 HydrophobicContact CG1-CD2 4.22Å
392	G	88.8	Confident	88.5	Confident	29 Å²	29	50.2 Å²	50.2	30%	0.299	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	18.9	-179.8	0	0	0	0	0	114.2	A388 V389	A388-G392 PolarHBondContact O-N 2.99Å; V389-G392 PolarHBondContact O-N 3.21Å; V389-G392 VanDerWaalsContact O-N 3.07Å
393	R	88.1	Confident	88.3	Confident	189 Å²	189	54.1 Å²	54.1	71%	0.713	29%	0.294	S	S	*	.			trans	-103.2	120.8	178	-69	-177.9	-177.9	-174.9	-2.2	109.7	A388 V391	A388-R393 CarbonylContact C-O 3.09Å; A388-R393 VanDerWaalsContact CB-O 3.3Å; A388-R393 WeakPolarHBondContact CB-O 3.24Å; A388-R393 PolarHBondContact O-N 2.91Å; A388-R393 VanDerWaalsContact O-O 3.08Å; V391-R393 VanDerWaalsContact C-N 3.33Å; V391-R393 HydrophobicContact CG2-CB 4.1Å; V391-R393 HydrophobicContact CG2-CG 3.94Å
394	V	85.6	Confident	88.1	Confident	40 Å²	40	60.6 Å²	60.6	24%	0.242	32%	0.322	C	S	.	.			trans	-123.6	105.4	176.8	-170.6	0	0	0	0	107.4	V398 T399 F591 P593 V596	V394-V398 HydrophobicContact CG1-CB 4.22Å; V394-V398 HydrophobicContact CG1-CG1 3.89Å; V394-T399 WeakPolarHBondContact CG1-OG1 3.4Å; V394-F591 HydrophobicContact CG1-CE1 4.25Å; V394-F591 HydrophobicContact CG1-CZ 4Å; V394-P593 HydrophobicContact CG1-CB 4.42Å; V394-V596 HydrophobicContact CG2-CB 3.54Å; V394-V596 HydrophobicContact CG2-CG1 3.57Å; V394-V596 HydrophobicContact CG2-CG2 3.86Å
395	S	87.6	Confident	87.8	Confident	57 Å²	57	57.9 Å²	57.9	40%	0.399	30%	0.303	S	S	.	.			trans	-76.9	163.1	170.4	59.6	0	0	0	0	110.3	E397 V398 T399	S395-E397 PolarHBondContact O-N 3.1Å; S395-V398 PolarHBondContact O-N 3.45Å; S395-V398 VanDerWaalsContact O-N 3.07Å; S395-V398 WeakPolarHBondContact OG-CG2 3.24Å; S395-V398 PolarHBondContact OG-N 3.09Å; S395-T399 PolarHBondContact O-N 2.85Å; S395-T399 PolarHBondContact O-OG1 3.32Å
396	E	85.6	Confident	87.2	Confident	178 Å²	178	58.9 Å²	58.9	83%	0.832	31%	0.313	S	S	*	.	H	α-helix	trans	-56.8	-38.1	175.5	-66.7	-177.8	179	0	0	112	V398 T399 A400	E396-V398 PolarHBondContact O-N 3.39Å; E396-T399 PolarHBondContact O-N 3.07Å; E396-A400 WeakPolarHBondContact O-CB 3.48Å; E396-A400 PolarHBondContact O-N 2.83Å
397	E	86.1	Confident	86.4	Confident	154 Å²	154	68.1 Å²	68.1	72%	0.72	35%	0.348	S	S	*	.	H	α-helix	trans	-61.2	-42.1	175	-62.8	176.6	178	0	0	112.6	S395 A400 T401	S395-E397 PolarHBondContact O-N 3.1Å; E397-A400 PolarHBondContact O-N 3.28Å; E397-T401 WeakPolarHBondContact O-CB 3.44Å; E397-T401 PolarHBondContact O-N 3.15Å; E397-T401 PolarHBondContact O-OG1 3.24Å
398	V	86.1	Confident	85.8	Confident	13 Å²	13	66.6 Å²	66.6	8%	0.079	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-45.1	177	168.2	0	0	0	0	110	L385 V389 V394 S395 E396 T401 L402	L385-V398 HydrophobicContact CD1-CB 4.46Å; L385-V398 HydrophobicContact CD1-CG1 4.01Å; L385-V398 HydrophobicContact CD1-CG2 4.37Å; L385-V398 HydrophobicContact CD2-CG1 4.28Å; L385-V398 HydrophobicContact CG-CB 4.4Å; L385-V398 HydrophobicContact CG-CG1 3.74Å; L385-V398 HydrophobicContact CG-CG2 4.06Å; V389-V398 HydrophobicContact CG2-CG1 4.3Å; V394-V398 HydrophobicContact CG1-CB 4.22Å; V394-V398 HydrophobicContact CG1-CG1 3.89Å; S395-V398 PolarHBondContact O-N 3.45Å; S395-V398 VanDerWaalsContact O-N 3.07Å; S395-V398 WeakPolarHBondContact OG-CG2 3.24Å; S395-V398 PolarHBondContact OG-N 3.09Å; E396-V398 PolarHBondContact O-N 3.39Å; V398-T401 PolarHBondContact O-N 3.23Å; V398-L402 HydrophobicContact CG1-CD1 3.89Å; V398-L402 HydrophobicContact CG1-CG 4.4Å; V398-L402 WeakPolarHBondContact O-CG 3.28Å; V398-L402 PolarHBondContact O-N 2.95Å
399	T	86.6	Confident	84.8	Confident	25 Å²	25	74.1 Å²	74.1	15%	0.153	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-48.7	176.2	-61	0	0	0	0	111.1	V394 S395 E396 T401 L402 L403 F591 P593	V394-T399 WeakPolarHBondContact CG1-OG1 3.4Å; S395-T399 PolarHBondContact O-N 2.85Å; S395-T399 PolarHBondContact O-OG1 3.32Å; E396-T399 PolarHBondContact O-N 3.07Å; T399-T401 VanDerWaalsContact C-N 3.31Å; T399-T401 PolarHBondContact O-N 2.71Å; T399-L402 PolarHBondContact O-N 2.92Å; T399-L403 HydrophobicContact CG2-CD1 3.72Å; T399-L403 HydrophobicContact CG2-CG 4.28Å; T399-L403 WeakPolarHBondContact O-CB 3.45Å; T399-L403 VanDerWaalsContact O-CG 3.3Å; T399-L403 WeakPolarHBondContact O-CG 3.34Å; T399-L403 PolarHBondContact O-N 3.43Å; T399-F591 HydrophobicContact CG2-CD1 4.14Å; T399-F591 HydrophobicContact CG2-CE1 3.92Å; T399-P593 HydrophobicContact CG2-CG 3.94Å
400	A	86.4	Confident	83.8	Confident	58 Å²	58	74.1 Å²	74.1	48%	0.479	37%	0.372	S	S	.	.	H	α-helix	trans	-60.1	-42	178.3	0	0	0	0	0	111.8	E396 E397 L403 K404	E396-A400 WeakPolarHBondContact O-CB 3.48Å; E396-A400 PolarHBondContact O-N 2.83Å; E397-A400 PolarHBondContact O-N 3.28Å; A400-L403 PolarHBondContact O-N 3.12Å; A400-K404 VanDerWaalsContact O-CB 3.29Å; A400-K404 WeakPolarHBondContact O-CB 3.31Å; A400-K404 PolarHBondContact O-N 3Å
401	T	86.1	Confident	82.5	Confident	53 Å²	53	78.7 Å²	78.7	33%	0.325	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-43.5	177.7	-56.2	0	0	0	0	111.7	L385 E397 V398 T399 K404 S405 L583	L385-T401 HydrophobicContact CD1-CG2 3.88Å; E397-T401 WeakPolarHBondContact O-CB 3.44Å; E397-T401 PolarHBondContact O-N 3.15Å; E397-T401 PolarHBondContact O-OG1 3.24Å; V398-T401 PolarHBondContact O-N 3.23Å; T399-T401 VanDerWaalsContact C-N 3.31Å; T399-T401 PolarHBondContact O-N 2.71Å; T401-K404 PolarHBondContact O-N 3.41Å; T401-S405 PolarHBondContact O-N 3.5Å; T401-L583 HydrophobicContact CG2-CD1 4.33Å; T401-L583 HydrophobicContact CG2-CD2 3.71Å
402	L	84.5	Confident	81.2	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-69.4	-40.2	178.2	-70.7	174.1	0	0	0	112.1	L385 V398 T399 S405 L577 L586 V588 F591	L385-L402 HydrophobicContact CD1-CD2 4.47Å; L385-L402 HydrophobicContact CD1-CG 4.36Å; L385-L402 HydrophobicContact CD2-CD2 4.1Å; L385-L402 HydrophobicContact CD2-CG 4.43Å; V398-L402 HydrophobicContact CG1-CD1 3.89Å; V398-L402 HydrophobicContact CG1-CG 4.4Å; V398-L402 WeakPolarHBondContact O-CG 3.28Å; V398-L402 PolarHBondContact O-N 2.95Å; T399-L402 PolarHBondContact O-N 2.92Å; L402-S405 WeakPolarHBondContact O-CB 2.88Å; L402-S405 PolarHBondContact O-N 3.42Å; L402-S405 PolarHBondContact O-OG 3.4Å; L402-L577 HydrophobicContact CD1-CD1 4.49Å; L402-L577 HydrophobicContact CD2-CD2 3.97Å; L402-L586 HydrophobicContact CD2-CD2 4.41Å; L402-V588 HydrophobicContact CD2-CG2 4.18Å; L402-F591 HydrophobicContact CB-CD1 4.23Å; L402-F591 HydrophobicContact CB-CE1 4.39Å; L402-F591 HydrophobicContact CB-CG 4.4Å; L402-F591 HydrophobicContact CD1-CD2 4.29Å; L402-F591 HydrophobicContact CD1-CE1 4Å; L402-F591 HydrophobicContact CD1-CE2 3.73Å; L402-F591 HydrophobicContact CD1-CZ 3.57Å
403	L	84.6	Confident	79.8	Confident	83 Å²	83	88.1 Å²	88.1	44%	0.435	43%	0.425	S	S	.	.	H	α-helix	trans	-64.9	-40.3	175.2	-72.5	171.7	0	0	0	111.6	T399 A400 S405 A406 F591	T399-L403 HydrophobicContact CG2-CD1 3.72Å; T399-L403 HydrophobicContact CG2-CG 4.28Å; T399-L403 WeakPolarHBondContact O-CB 3.45Å; T399-L403 VanDerWaalsContact O-CG 3.3Å; T399-L403 WeakPolarHBondContact O-CG 3.34Å; T399-L403 PolarHBondContact O-N 3.43Å; A400-L403 PolarHBondContact O-N 3.12Å; L403-S405 PolarHBondContact O-N 3.06Å; L403-A406 WeakPolarHBondContact O-CB 3.39Å; L403-A406 PolarHBondContact O-N 3.08Å; L403-A406 VanDerWaalsContact O-N 3.11Å; L403-F591 HydrophobicContact CD2-CB 4.04Å; L403-F591 HydrophobicContact CD2-CD1 4.47Å; L403-F591 HydrophobicContact CG-CD1 4.4Å
404	K	85.7	Confident	78.6	Confident	150 Å²	150	82.5 Å²	82.5	65%	0.652	43%	0.426	S	S	*	.	H	α-helix	trans	-61.2	-30.8	175.1	-169.7	174.2	-178.7	178.9	0	112.1	A400 T401 A406 Y407	A400-K404 VanDerWaalsContact O-CB 3.29Å; A400-K404 WeakPolarHBondContact O-CB 3.31Å; A400-K404 PolarHBondContact O-N 3Å; T401-K404 PolarHBondContact O-N 3.41Å; K404-A406 PolarHBondContact O-N 2.88Å; K404-Y407 PolarHBondContact O-N 2.86Å
405	S	82.3	Confident	77.8	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-64.5	-19.4	177.4	84.8	0	0	0	0	114.1	T401 L402 L403 Y407 H408 L586 V588	T401-S405 PolarHBondContact O-N 3.5Å; L402-S405 WeakPolarHBondContact O-CB 2.88Å; L402-S405 PolarHBondContact O-N 3.42Å; L402-S405 PolarHBondContact O-OG 3.4Å; L403-S405 PolarHBondContact O-N 3.06Å; S405-Y407 PolarHBondContact O-N 2.95Å; S405-H408 WeakPolarHBondContact O-CB 3.37Å; S405-H408 PolarHBondContact O-N 2.72Å; S405-H408 VanDerWaalsContact O-N 3.12Å; S405-L586 WeakPolarHBondContact CB-O 3.44Å; S405-V588 PolarHBondContact OG-N 2.85Å
406	A	78.6	Confident	77.3	Confident	32 Å²	32	80.6 Å²	80.6	26%	0.264	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-58.3	-32	174.7	0	0	0	0	0	112.3	L403 K404 V588 M589	L403-A406 WeakPolarHBondContact O-CB 3.39Å; L403-A406 PolarHBondContact O-N 3.08Å; L403-A406 VanDerWaalsContact O-N 3.11Å; K404-A406 PolarHBondContact O-N 2.88Å; A406-V588 WeakPolarHBondContact CA-O 3.13Å; A406-V588 VanDerWaalsContact CB-O 3.31Å; A406-V588 WeakPolarHBondContact CB-O 3.28Å; A406-M589 HydrophobicContact CB-SD 4.46Å
407	Y	74.9	Confident	77.1	Confident	201 Å²	201	72.4 Å²	72.4	79%	0.788	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-87.8	-0.5	-178.5	-56.2	-76.9	0	0	0	113.8	K404 S405 Q409	K404-Y407 PolarHBondContact O-N 2.86Å; S405-Y407 PolarHBondContact O-N 2.95Å; Y407-Q409 PolarHBondContact O-N 3.41Å
408	H	78.9	Confident	77.1	Confident	53 Å²	53	65.1 Å²	65.1	25%	0.245	34%	0.338	C	S	.	.			trans	-66	130.5	177.7	-68.6	170.2	0	0	0	111.2	S405 I410 L583 L586	S405-H408 WeakPolarHBondContact O-CB 3.37Å; S405-H408 PolarHBondContact O-N 2.72Å; S405-H408 VanDerWaalsContact O-N 3.12Å; H408-I410 HydrophobicContact CB-CD1 4.15Å; H408-I410 HydrophobicContact CB-CG1 3.82Å; H408-I410 PolarHBondContact O-N 3.16Å; H408-L583 PolarHBondContact CE1-O 3.08Å; H408-L583 PolarHBondContact ND1-O 3.38Å; H408-L586 PolarHBondContact ND1-O 3.01Å
409	Q	70	Confident	77.3	Confident	185 Å²	185	69.4 Å²	69.4	86%	0.864	35%	0.353	S	S	*	.			trans	-84.3	99.1	167.4	-68.1	-171.9	1.5	0	0	109.2	Y407	Y407-Q409 PolarHBondContact O-N 3.41Å
410	I	69.3	Low	77.4	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.01	35%	0.346	C	S	.	.			trans	-97.1	-14.6	-172.3	-58.7	-174.3	0	0	0	112.2	H408 R412 A417 C559 L586 R587	H408-I410 HydrophobicContact CB-CD1 4.15Å; H408-I410 HydrophobicContact CB-CG1 3.82Å; H408-I410 PolarHBondContact O-N 3.16Å; I410-R412 PolarHBondContact O-N 2.92Å; I410-A417 HydrophobicContact CB-CB 4.46Å; I410-A417 HydrophobicContact CG2-CB 4Å; I410-C559 HydrophobicContact CG2-CB 3.56Å; I410-L586 WeakPolarHBondContact CD1-O 3.45Å; I410-R587 HydrophobicContact CD1-CB 3.16Å; I410-R587 HydrophobicContact CG1-CB 4.21Å
411	E	66.4	Low	77.4	Confident	106 Å²	106	66 Å²	66	50%	0.495	33%	0.327	S	S	.	.			trans	-71.8	117.8	-177.8	-57.8	-178.9	-175.7	0	0	108.8	L416 R587	E411-L416 VanDerWaalsContact CD-CD2 3.43Å; E411-L416 HydrophobicContact CG-CD2 4.15Å; E411-L416 WeakPolarHBondContact OE2-CD2 3.25Å; E411-R587 IonicContact OE1-NH2 2.65Å
412	R	63.6	Low	77.2	Confident	141 Å²	141	63.9 Å²	63.9	53%	0.532	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-124.9	136	178	-64.2	-170.7	-177.8	-173.1	2.5	109	I410 G414 I415 E584	I410-R412 PolarHBondContact O-N 2.92Å; R412-G414 VanDerWaalsContact C-N 3.26Å; R412-G414 PolarHBondContact O-N 2.78Å; R412-G414 VanDerWaalsContact O-N 3.15Å; R412-I415 PolarHBondContact O-N 2.87Å; R412-E584 IonicContact NH2-OE2 3.28Å
413	D	58.9	Low	77.2	Confident	131 Å²	131	67.1 Å²	67.1	70%	0.701	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	34.2	172.4	-53.6	-40.8	0	0	0	115.6	I415	D413-I415 PolarHBondContact O-N 2.97Å
414	G	62.9	Low	77.1	Confident	70 Å²	70	68.7 Å²	68.7	72%	0.722	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	8.1	-178.3	0	0	0	0	0	114.6	R412	R412-G414 VanDerWaalsContact C-N 3.26Å; R412-G414 PolarHBondContact O-N 2.78Å; R412-G414 VanDerWaalsContact O-N 3.15Å
415	I	68.5	Low	77.1	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.021	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-95	109.1	172.1	-64.8	170.9	0	0	0	107.6	R412 D413 V495 L512	R412-I415 PolarHBondContact O-N 2.87Å; D413-I415 PolarHBondContact O-N 2.97Å; I415-V495 HydrophobicContact CD1-CG2 4.09Å; I415-V495 HydrophobicContact CG1-CG2 3.37Å; I415-L512 HydrophobicContact CB-CD2 4.11Å; I415-L512 HydrophobicContact CD1-CB 4.49Å; I415-L512 HydrophobicContact CD1-CD2 3.58Å; I415-L512 HydrophobicContact CD1-CG 3.59Å; I415-L512 HydrophobicContact CG1-CD2 4.38Å; I415-L512 HydrophobicContact CG2-CD1 4.37Å; I415-L512 HydrophobicContact CG2-CD2 4.21Å; I415-L512 HydrophobicContact CG2-CG 4.3Å
416	L	78.3	Confident	77.2	Confident	54 Å²	54	69.3 Å²	69.3	28%	0.283	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-63.2	159.4	176.2	-61.1	172.8	0	0	0	109.7	E411 Q475 R493	E411-L416 VanDerWaalsContact CD-CD2 3.43Å; E411-L416 HydrophobicContact CG-CD2 4.15Å; E411-L416 WeakPolarHBondContact OE2-CD2 3.25Å; L416-Q475 PolarHBondContact O-NE2 2.83Å; L416-Q475 PolarHBondContact O-OE1 2.81Å; L416-R493 PolarHBondContact O-NH1 2.74Å; L416-R493 PolarHBondContact O-NH2 2.9Å
417	A	81.1	Confident	77.6	Confident	6 Å²	6	68.1 Å²	68.1	5%	0.05	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-66.2	145.1	170.3	0	0	0	0	0	110.7	I410 R419 E561	I410-A417 HydrophobicContact CB-CB 4.46Å; I410-A417 HydrophobicContact CG2-CB 4Å; A417-R419 PolarHBondContact O-N 2.83Å; A417-E561 HydrophobicContact CB-CB 3.95Å
418	T	85.6	Confident	78.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	122.5	171.9	-70.6	0	0	0	0	108.1	R493 A544 I547 C559 E561	T418-R493 VanDerWaalsContact N-NH2 3.11Å; T418-R493 PolarHBondContact OG1-NE 3.36Å; T418-R493 PolarHBondContact OG1-NH2 2.64Å; T418-A544 PolarHBondContact OG1-O 3.46Å; T418-I547 HydrophobicContact CG2-CB 4.41Å; T418-I547 HydrophobicContact CG2-CD1 4.19Å; T418-I547 HydrophobicContact CG2-CG1 3.8Å; T418-I547 HydrophobicContact CG2-CG2 4.09Å; T418-C559 PolarHBondContact N-O 3.27Å; T418-E561 PolarHBondContact O-N 3.46Å
419	R	89.4	Confident	78.7	Confident	104 Å²	104	64.7 Å²	64.7	39%	0.392	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.9	174.8	-172.5	174.4	-77.3	176.6	-5.7	110.8	A417 W545 A546 I547 E561	A417-R419 PolarHBondContact O-N 2.83Å; R419-W545 PolarHBondContact N-O 2.89Å; R419-A546 HydrophobicContact CB-CB 4.44Å; R419-A546 CarbonylContact O-C 3.53Å; R419-A546 WeakPolarHBondContact O-CA 3.34Å; R419-I547 PolarHBondContact O-N 2.81Å; R419-E561 CarbonylContact C-O 3.47Å; R419-E561 VanDerWaalsContact CA-O 3.26Å; R419-E561 WeakPolarHBondContact CA-O 3.28Å; R419-E561 IonicContact CZ-OE1 3.18Å; R419-E561 IonicContact NE-OE1 2.84Å; R419-E561 PolarHBondContact NE-OE1 3Å; R419-E561 IonicContact NH2-OE1 3.47Å; R419-E561 PolarHBondContact NH2-OE1 2.97Å
420	L	88.8	Confident	79.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	117.2	169.9	-60.9	-171.8	0	0	0	109.6	I547 I549 L557 V560 E561 I562 A576 R579	L420-I547 WeakPolarHBondContact CA-O 3.37Å; L420-I547 HydrophobicContact CD2-CD1 3.59Å; L420-I547 HydrophobicContact CD2-CG1 3.25Å; L420-I549 HydrophobicContact CB-CG1 3.95Å; L420-L557 HydrophobicContact CD2-CD1 4.04Å; L420-V560 HydrophobicContact CD1-CG2 3.57Å; L420-V560 HydrophobicContact CD2-CG2 4.14Å; L420-V560 HydrophobicContact CG-CG2 3.44Å; L420-V560 VanDerWaalsContact CG-CG2 3.44Å; L420-E561 PolarHBondContact N-O 3.45Å; L420-I562 HydrophobicContact CB-CG1 4.37Å; L420-I562 HydrophobicContact CD1-CD1 4.24Å; L420-I562 HydrophobicContact CD1-CG1 4.13Å; L420-I562 HydrophobicContact CG-CG1 4.37Å; L420-A576 HydrophobicContact CD1-CB 3.96Å; L420-R579 HydrophobicContact CD1-CB 4.44Å; L420-R579 HydrophobicContact CD1-CG 4.05Å
421	C	86.8	Confident	80.7	Confident	12 Å²	12	57.8 Å²	57.8	8%	0.081	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	153.1	177.2	-50.8	0	0	0	0	111.1	D426 V427 I547 S548 I549	C421-D426 HydrophobicContact CB-CB 4.11Å; C421-V427 HydrophobicContact CB-CG2 3.68Å; C421-I547 PolarHBondContact N-O 3.33Å; C421-S548 CarbonylContact O-C 3.54Å; C421-S548 VanDerWaalsContact O-CA 3.26Å; C421-S548 WeakPolarHBondContact O-CA 3.16Å; C421-I549 PolarHBondContact O-N 3.46Å
422	T	82.9	Confident	81.9	Confident	8 Å²	8	57.9 Å²	57.9	5%	0.049	30%	0.296	C	S	.	.	S	Bend	trans	-76.7	-46.3	176.6	53.6	0	0	0	0	111.1	I549 R566 V567	T422-I549 HydrophobicContact CG2-CD1 3.83Å; T422-R566 WeakPolarHBondContact CG2-O 3.45Å; T422-R566 PolarHBondContact OG1-O 2.98Å; T422-V567 HydrophobicContact CG2-CG2 4.05Å
423	H	83.5	Confident	83.2	Confident	67 Å²	67	54.3 Å²	54.3	31%	0.31	29%	0.288	S	S	.	.	S	Bend	trans	-94.3	151.4	-179.2	-60.9	-80.3	0	0	0	113.1	D426 V427	H423-D426 IonicContact CD2-OD2 3.48Å; H423-V427 WeakPolarHBondContact O-CG2 3.09Å
424	K	83.1	Confident	84.8	Confident	117 Å²	117	52 Å²	52	51%	0.509	27%	0.271	S	S	.	.	H	α-helix	trans	-72.9	-35.5	179	-173.2	-174.5	165	-153.2	0	111.8	D426 V427 E428	K424-D426 PolarHBondContact O-N 3.29Å; K424-V427 VanDerWaalsContact O-CB 3.3Å; K424-V427 WeakPolarHBondContact O-CB 3.46Å; K424-V427 PolarHBondContact O-N 3.07Å; K424-V427 VanDerWaalsContact O-N 3.12Å; K424-E428 WeakPolarHBondContact CE-OE1 3.48Å; K424-E428 IonicContact NZ-OE1 3.78Å; K424-E428 PolarHBondContact NZ-OE1 3.3Å; K424-E428 PolarHBondContact O-N 2.98Å; K424-E428 VanDerWaalsContact O-N 3.12Å
425	D	84.8	Confident	86.1	Confident	116 Å²	116	49.2 Å²	49.2	62%	0.62	24%	0.24	S	C	*	.	H	α-helix	trans	-65.5	-41.7	-176.9	-51	-33.1	0	0	0	110.9	V427 E428 L429	D425-V427 PolarHBondContact O-N 2.99Å; D425-E428 PolarHBondContact O-N 3.41Å; D425-E428 VanDerWaalsContact O-N 3.16Å; D425-L429 WeakPolarHBondContact O-CB 3.39Å; D425-L429 PolarHBondContact O-N 2.65Å
426	D	85.4	Confident	87.3	Confident	46 Å²	46	55.6 Å²	55.6	25%	0.246	27%	0.27	C	S	.	.	H	α-helix	trans	-57.6	-36.2	174	-64.2	-15.6	0	0	0	112	C421 H423 K424 T430 R566	C421-D426 HydrophobicContact CB-CB 4.11Å; H423-D426 IonicContact CD2-OD2 3.48Å; K424-D426 PolarHBondContact O-N 3.29Å; D426-T430 VanDerWaalsContact O-CB 3.24Å; D426-T430 WeakPolarHBondContact O-CB 3.33Å; D426-T430 PolarHBondContact O-N 3.21Å; D426-T430 PolarHBondContact O-OG1 3.32Å; D426-R566 IonicContact OD1-NH1 3.09Å; D426-R566 PolarHBondContact OD1-NH1 3.44Å; D426-R566 IonicContact OD2-NH1 3.37Å; D426-R566 PolarHBondContact OD2-NH1 3.2Å; D426-R566 VanDerWaalsContact OD2-NH1 3.09Å
427	V	87.5	Confident	87.9	Confident	8 Å²	8	59.6 Å²	59.6	5%	0.048	29%	0.287	C	S	.	.	H	α-helix	trans	-69	-45.6	178.2	174.4	0	0	0	0	111.1	C421 H423 K424 D425 N431 A546 I547	C421-V427 HydrophobicContact CB-CG2 3.68Å; H423-V427 WeakPolarHBondContact O-CG2 3.09Å; K424-V427 VanDerWaalsContact O-CB 3.3Å; K424-V427 WeakPolarHBondContact O-CB 3.46Å; K424-V427 PolarHBondContact O-N 3.07Å; K424-V427 VanDerWaalsContact O-N 3.12Å; D425-V427 PolarHBondContact O-N 2.99Å; V427-N431 WeakPolarHBondContact CG1-ND2 3.22Å; V427-N431 WeakPolarHBondContact O-CB 3.37Å; V427-N431 PolarHBondContact O-N 2.89Å; V427-N431 VanDerWaalsContact O-N 3.08Å; V427-N431 PolarHBondContact O-ND2 3.43Å; V427-A546 HydrophobicContact CB-CB 4.4Å; V427-A546 HydrophobicContact CG1-CB 4.15Å; V427-A546 VanDerWaalsContact CG1-O 3.3Å; V427-A546 WeakPolarHBondContact CG1-O 3.47Å; V427-A546 HydrophobicContact CG2-CB 4.45Å; V427-I547 VanDerWaalsContact CG2-C 3.45Å
428	E	86.4	Confident	88.3	Confident	86 Å²	86	61.2 Å²	61.2	40%	0.402	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-46	-179	-70.1	-177.3	178.9	0	0	110.5	K424 D425 T430 N431 Q432	K424-E428 WeakPolarHBondContact CE-OE1 3.48Å; K424-E428 IonicContact NZ-OE1 3.78Å; K424-E428 PolarHBondContact NZ-OE1 3.3Å; K424-E428 PolarHBondContact O-N 2.98Å; K424-E428 VanDerWaalsContact O-N 3.12Å; D425-E428 PolarHBondContact O-N 3.41Å; D425-E428 VanDerWaalsContact O-N 3.16Å; E428-T430 PolarHBondContact O-N 2.96Å; E428-N431 PolarHBondContact O-N 2.94Å; E428-Q432 WeakPolarHBondContact O-CB 3.31Å; E428-Q432 VanDerWaalsContact O-CG 3.26Å; E428-Q432 WeakPolarHBondContact O-CG 3.43Å; E428-Q432 PolarHBondContact O-N 3.38Å
429	L	89.1	Confident	88.5	Confident	96 Å²	96	66.3 Å²	66.3	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-57.9	-49.7	176	-174.1	71.6	0	0	0	111.8	D425 N431 Q432 N433	D425-L429 WeakPolarHBondContact O-CB 3.39Å; D425-L429 PolarHBondContact O-N 2.65Å; L429-N431 PolarHBondContact O-N 3.29Å; L429-Q432 PolarHBondContact O-N 3.46Å; L429-N433 VanDerWaalsContact O-CB 3.32Å; L429-N433 WeakPolarHBondContact O-CB 3.31Å; L429-N433 VanDerWaalsContact O-CG 3.22Å; L429-N433 PolarHBondContact O-N 3.27Å; L429-N433 PolarHBondContact O-ND2 2.91Å
430	T	89.8	Confident	88.3	Confident	33 Å²	33	64.2 Å²	64.2	20%	0.202	34%	0.338	C	S	.	.	H	α-helix	trans	-62.2	-45.5	-179.3	-59	0	0	0	0	111.5	D426 E428 K434 A546	D426-T430 VanDerWaalsContact O-CB 3.24Å; D426-T430 WeakPolarHBondContact O-CB 3.33Å; D426-T430 PolarHBondContact O-N 3.21Å; D426-T430 PolarHBondContact O-OG1 3.32Å; E428-T430 PolarHBondContact O-N 2.96Å; T430-K434 WeakPolarHBondContact O-CB 3.13Å; T430-K434 VanDerWaalsContact O-CG 3.31Å; T430-K434 WeakPolarHBondContact O-CG 3.4Å; T430-K434 PolarHBondContact O-N 3.39Å; T430-A546 HydrophobicContact CG2-CB 3.96Å
431	N	92.1	Very high	88.3	Confident	9 Å²	9	68.5 Å²	68.5	5%	0.048	37%	0.368	C	S	.	.	H	α-helix	trans	-66.9	-40.2	-179.8	-77.2	-50.2	0	0	0	111.9	V427 E428 L429 L435 L543 W545 A546	V427-N431 WeakPolarHBondContact CG1-ND2 3.22Å; V427-N431 WeakPolarHBondContact O-CB 3.37Å; V427-N431 PolarHBondContact O-N 2.89Å; V427-N431 VanDerWaalsContact O-N 3.08Å; V427-N431 PolarHBondContact O-ND2 3.43Å; E428-N431 PolarHBondContact O-N 2.94Å; L429-N431 PolarHBondContact O-N 3.29Å; N431-L435 WeakPolarHBondContact O-CB 3.43Å; N431-L435 PolarHBondContact O-N 3.46Å; N431-L543 HydrophobicContact CB-CB 4.1Å; N431-L543 HydrophobicContact CB-CD1 4Å; N431-W545 HydrophobicContact CB-CE3 4.47Å; N431-W545 WeakPolarHBondContact OD1-CB 3.37Å; N431-W545 PolarHBondContact OD1-N 3.27Å; N431-W545 VanDerWaalsContact OD1-N 3.1Å; N431-A546 PolarHBondContact ND2-O 3.13Å; N431-A546 PolarHBondContact OD1-N 3.27Å
432	Q	90.7	Very high	88.4	Confident	107 Å²	107	70.7 Å²	70.7	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-47.3	177.7	-74.4	176.5	11.2	0	0	111.5	E428 L429 K434 L435 Q436	E428-Q432 WeakPolarHBondContact O-CB 3.31Å; E428-Q432 VanDerWaalsContact O-CG 3.26Å; E428-Q432 WeakPolarHBondContact O-CG 3.43Å; E428-Q432 PolarHBondContact O-N 3.38Å; L429-Q432 PolarHBondContact O-N 3.46Å; Q432-K434 VanDerWaalsContact C-N 3.34Å; Q432-K434 PolarHBondContact O-N 2.86Å; Q432-L435 PolarHBondContact O-N 2.8Å; Q432-Q436 WeakPolarHBondContact O-CB 3.48Å; Q432-Q436 WeakPolarHBondContact O-CG 3.42Å; Q432-Q436 PolarHBondContact O-N 3.02Å
433	N	92.6	Very high	88.8	Confident	66 Å²	66	74.9 Å²	74.9	35%	0.353	40%	0.399	S	S	.	.	H	α-helix	trans	-59	-45.6	177.7	-73.6	-17.8	0	0	0	111.4	L429 L435 Q436 Q437	L429-N433 VanDerWaalsContact O-CB 3.32Å; L429-N433 WeakPolarHBondContact O-CB 3.31Å; L429-N433 VanDerWaalsContact O-CG 3.22Å; L429-N433 PolarHBondContact O-N 3.27Å; L429-N433 PolarHBondContact O-ND2 2.91Å; N433-L435 PolarHBondContact O-N 3.43Å; N433-Q436 PolarHBondContact O-N 3.34Å; N433-Q437 VanDerWaalsContact O-CG 3.24Å; N433-Q437 WeakPolarHBondContact O-CG 3.29Å; N433-Q437 PolarHBondContact O-N 2.95Å
434	K	91.2	Very high	89.2	Confident	83 Å²	83	74.8 Å²	74.8	36%	0.361	41%	0.409	S	S	.	.	H	α-helix	trans	-65.4	-37.3	177	-72.1	-66.6	-177.5	-174.6	0	112.7	T430 Q432 L438 W545	T430-K434 WeakPolarHBondContact O-CB 3.13Å; T430-K434 VanDerWaalsContact O-CG 3.31Å; T430-K434 WeakPolarHBondContact O-CG 3.4Å; T430-K434 PolarHBondContact O-N 3.39Å; Q432-K434 VanDerWaalsContact C-N 3.34Å; Q432-K434 PolarHBondContact O-N 2.86Å; K434-L438 PolarHBondContact O-N 2.8Å; K434-W545 HydrophobicContact CB-CB 4.44Å; K434-W545 HydrophobicContact CB-CD2 3.54Å; K434-W545 HydrophobicContact CB-CE3 3.74Å; K434-W545 HydrophobicContact CB-CG 3.86Å; K434-W545 HydrophobicContact CB-CH2 4.43Å; K434-W545 HydrophobicContact CB-CZ2 4.28Å; K434-W545 HydrophobicContact CB-CZ3 4.18Å; K434-W545 HydrophobicContact CG-CB 4.31Å; K434-W545 HydrophobicContact CG-CD2 4.25Å; K434-W545 HydrophobicContact CG-CG 4.03Å
435	L	91.4	Very high	89.6	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.063	39%	0.39	C	S	.	.	H	α-helix	trans	-67.9	-38.1	174.7	-171.7	66.6	0	0	0	112.1	N431 Q432 N433 L438 Q469 K471 A474 L543 W545	N431-L435 WeakPolarHBondContact O-CB 3.43Å; N431-L435 PolarHBondContact O-N 3.46Å; Q432-L435 PolarHBondContact O-N 2.8Å; N433-L435 PolarHBondContact O-N 3.43Å; L435-L438 HydrophobicContact CD1-CD1 4.47Å; L435-L438 PolarHBondContact O-N 2.88Å; L435-Q469 HydrophobicContact CD2-CB 3.91Å; L435-Q469 WeakPolarHBondContact CD2-O 3.37Å; L435-K471 HydrophobicContact CD1-CB 4.1Å; L435-K471 HydrophobicContact CD1-CD 4.38Å; L435-K471 HydrophobicContact CD1-CG 4.12Å; L435-K471 VanDerWaalsContact O-CD 3.31Å; L435-K471 WeakPolarHBondContact O-CD 3.28Å; L435-K471 WeakPolarHBondContact O-CE 3.48Å; L435-K471 PolarHBondContact O-NZ 3.25Å; L435-A474 HydrophobicContact CD1-CB 3.97Å; L435-L543 HydrophobicContact CD1-CD2 4.39Å; L435-L543 HydrophobicContact CD2-CD1 4.12Å; L435-W545 HydrophobicContact CB-CH2 4.22Å; L435-W545 HydrophobicContact CB-CZ3 3.91Å; L435-W545 HydrophobicContact CD1-CH2 4.01Å; L435-W545 HydrophobicContact CD1-CZ3 4.21Å
436	Q	91.9	Very high	89.9	Confident	138 Å²	138	70.5 Å²	70.5	65%	0.645	39%	0.387	S	S	*	.	H	α-helix	trans	-67	-40.9	178.3	-75.5	178.7	-3	0	0	111.9	Q432 N433 L438 K471	Q432-Q436 WeakPolarHBondContact O-CB 3.48Å; Q432-Q436 WeakPolarHBondContact O-CG 3.42Å; Q432-Q436 PolarHBondContact O-N 3.02Å; N433-Q436 PolarHBondContact O-N 3.34Å; Q436-L438 PolarHBondContact O-N 3.38Å; Q436-K471 PolarHBondContact O-NZ 3.13Å
437	Q	91.9	Very high	90.2	Very high	137 Å²	137	68.8 Å²	68.8	64%	0.64	38%	0.379	S	S	*	.	H	α-helix	trans	-62.5	-23.1	177.4	-74	170.8	7.6	0	0	113.9	N433	N433-Q437 VanDerWaalsContact O-CG 3.24Å; N433-Q437 WeakPolarHBondContact O-CG 3.29Å; N433-Q437 PolarHBondContact O-N 2.95Å
438	L	90.3	Very high	90.3	Very high	40 Å²	40	74.2 Å²	74.2	21%	0.209	41%	0.407	C	S	.	.	S	Bend	trans	-70.4	134.7	178.9	-74.4	174.8	0	0	0	112.1	K434 L435 Q436 K471 A474 W545	K434-L438 PolarHBondContact O-N 2.8Å; L435-L438 HydrophobicContact CD1-CD1 4.47Å; L435-L438 PolarHBondContact O-N 2.88Å; Q436-L438 PolarHBondContact O-N 3.38Å; L438-K471 HydrophobicContact CB-CB 4.44Å; L438-K471 HydrophobicContact CB-CD 3.96Å; L438-K471 HydrophobicContact CD1-CB 4.38Å; L438-K471 PolarHBondContact O-NZ 3.38Å; L438-A474 HydrophobicContact CD1-CB 4.09Å; L438-W545 HydrophobicContact CD1-CH2 3.67Å; L438-W545 HydrophobicContact CD1-CZ2 3.7Å; L438-W545 HydrophobicContact CG-CZ2 4.46Å
439	P	88.1	Confident	90.5	Very high	108 Å²	108	71.7 Å²	71.7	70%	0.701	40%	0.397	S	S	*	.			trans	-67.7	157.5	171.6	30.4	-34.5	0	0	0	110.9
440	G	86.5	Confident	90.2	Very high	59 Å²	59	70 Å²	70	61%	0.608	39%	0.392	S	S	*	.	S	Bend	trans	98.7	168	176.6	0	0	0	0	0	114.9
441	S	87.7	Confident	89.7	Confident	90 Å²	90	70.6 Å²	70.6	63%	0.629	40%	0.395	S	S	*	.			trans	-75.1	132.7	-175.5	51.3	0	0	0	0	111.8
442	S	89.9	Confident	88.9	Confident	58 Å²	58	75.4 Å²	75.4	41%	0.406	43%	0.426	S	S	.	.			trans	-74.8	131	172.6	-171.5	0	0	0	0	109.6
443	R	90.7	Very high	88.3	Confident	97 Å²	97	78.9 Å²	78.9	37%	0.366	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.7	171	-67.5	-169.5	179.3	-164.5	-0.2	109.3	F445 Q469 L470 F499	R443-F445 HydrophobicContact CB-CE2 3.99Å; R443-F445 HydrophobicContact CB-CZ 4.28Å; R443-Q469 WeakPolarHBondContact O-CA 3.46Å; R443-L470 PolarHBondContact N-O 2.89Å; R443-L470 PolarHBondContact O-N 3.26Å; R443-F499 HydrophobicContact CB-CE1 4.32Å; R443-F499 HydrophobicContact CB-CZ 4.27Å; R443-F499 HydrophobicContact CG-CE2 4.39Å; R443-F499 HydrophobicContact CG-CZ 4.45Å
444	A	91.9	Very high	87.6	Confident	64 Å²	64	78.4 Å²	78.4	53%	0.529	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.3	177.6	0	0	0	0	0	110.1	L467 I468 Q469	A444-L467 HydrophobicContact CB-CD1 4.01Å; A444-I468 WeakPolarHBondContact CA-O 3.49Å; A444-Q469 HydrophobicContact CB-CG 4.26Å
445	F	91.4	Very high	86.9	Confident	25 Å²	25	75.4 Å²	75.4	11%	0.11	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.5	175.2	-61.3	-86.9	0	0	0	108.4	R443 I468 L470 F499 G505 Q538 L539	R443-F445 HydrophobicContact CB-CE2 3.99Å; R443-F445 HydrophobicContact CB-CZ 4.28Å; F445-I468 PolarHBondContact N-O 3.37Å; F445-I468 PolarHBondContact O-N 3.04Å; F445-L470 HydrophobicContact CD2-CD1 4.29Å; F445-L470 HydrophobicContact CE2-CB 4.36Å; F445-L470 HydrophobicContact CE2-CD1 4.1Å; F445-L470 HydrophobicContact CE2-CG 4.5Å; F445-F499 HydrophobicContact CE2-CD1 4.46Å; F445-F499 AromaticContact CE2-CE1 3.9Å; F445-F499 HydrophobicContact CE2-CE1 3.9Å; F445-F499 HydrophobicContact CZ-CD1 4.06Å; F445-F499 AromaticContact CZ-CE1 3.96Å; F445-F499 HydrophobicContact CZ-CE1 3.96Å; F445-G505 WeakPolarHBondContact CZ-O 3.27Å; F445-Q538 PolarHBondContact O-NE2 2.91Å; F445-L539 HydrophobicContact CB-CD1 3.96Å; F445-L539 HydrophobicContact CD1-CD1 3.72Å; F445-L539 HydrophobicContact CD2-CD1 3.66Å; F445-L539 HydrophobicContact CE1-CD1 4.09Å; F445-L539 HydrophobicContact CE2-CD1 4.05Å; F445-L539 HydrophobicContact CG-CD1 3.48Å; F445-L539 VanDerWaalsContact CG-CD1 3.48Å; F445-L539 HydrophobicContact CG-CG 4.5Å; F445-L539 HydrophobicContact CZ-CD1 4.24Å
446	E	91.6	Very high	86.2	Confident	118 Å²	118	85.5 Å²	85.5	55%	0.551	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	138.2	175.7	-170.6	168	-162.8	0	0	110.8	R466 L467	E446-R466 IonicContact OE1-CZ 3.88Å; E446-R466 IonicContact OE1-NE 2.66Å; E446-R466 PolarHBondContact OE1-NE 3.13Å; E446-R466 IonicContact OE1-NH2 3.92Å; E446-R466 PolarHBondContact OE1-NH2 2.84Å; E446-L467 HydrophobicContact CB-CD1 4.33Å
447	A	91.5	Very high	85.3	Confident	10 Å²	10	81.2 Å²	81.2	8%	0.083	45%	0.449	C	S	.	.			trans	-73.4	145.3	178.5	0	0	0	0	0	111.1	R466 R536 Q537 Q538	A447-R466 HydrophobicContact CB-CG 4.39Å; A447-R466 VanDerWaalsContact CB-O 3.28Å; A447-R466 WeakPolarHBondContact CB-O 3.47Å; A447-R466 PolarHBondContact N-O 3.19Å; A447-R536 HydrophobicContact CB-CG 3.97Å; A447-Q537 WeakPolarHBondContact CA-O 3.48Å; A447-Q538 HydrophobicContact CB-CB 3.96Å; A447-Q538 HydrophobicContact CB-CG 4.2Å; A447-Q538 VanDerWaalsContact N-NE2 3.15Å
448	L	90	Very high	84.6	Confident	122 Å²	122	74.8 Å²	74.8	64%	0.639	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	106.5	168.8	-64.4	170.4	0	0	0	108.6	Q537	L448-Q537 HydrophobicContact CB-CB 4.25Å; L448-Q537 PolarHBondContact N-O 3.44Å; L448-Q537 PolarHBondContact O-N 3.26Å
449	D	89.3	Confident	84.1	Confident	34 Å²	34	76.1 Å²	76.1	18%	0.182	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	147.4	178	-69.8	-19.8	0	0	0	110.7	D451 I458 S535 R536	D449-D451 VanDerWaalsContact C-N 3.27Å; D449-D451 PolarHBondContact O-N 3Å; D449-I458 HydrophobicContact CB-CD1 3.94Å; D449-S535 CarbonylContact C-O 3.57Å; D449-S535 WeakPolarHBondContact CA-O 3.28Å; D449-R536 WeakPolarHBondContact OD1-CB 3.42Å; D449-R536 VanDerWaalsContact OD1-CG 3.26Å; D449-R536 WeakPolarHBondContact OD1-CG 3.4Å; D449-R536 IonicContact OD1-CZ 3.2Å; D449-R536 IonicContact OD1-NE 2.72Å; D449-R536 PolarHBondContact OD1-NE 2.84Å; D449-R536 IonicContact OD1-NH2 2.75Å; D449-R536 IonicContact OD2-CZ 3.41Å; D449-R536 IonicContact OD2-NE 3.23Å; D449-R536 PolarHBondContact OD2-NE 3.42Å; D449-R536 IonicContact OD2-NH2 3.98Å; D449-R536 PolarHBondContact OD2-NH2 3.08Å
450	S	84.6	Confident	83.2	Confident	59 Å²	59	74.8 Å²	74.8	41%	0.413	42%	0.424	S	S	.	.	S	Bend	trans	-67.5	-29.8	178.1	55.6	0	0	0	0	113.1	L534 S535	S450-L534 WeakPolarHBondContact OG-CA 3.48Å; S450-S535 PolarHBondContact N-O 3Å; S450-S535 PolarHBondContact OG-N 3.16Å; S450-S535 PolarHBondContact OG-O 2.7Å
451	D	79.1	Confident	82.4	Confident	47 Å²	47	74.1 Å²	74.1	25%	0.251	41%	0.405	S	S	.	.			trans	-139.2	108.9	-176.7	-167.8	-30.8	0	0	0	109.1	D449 E453 L454 L534	D449-D451 VanDerWaalsContact C-N 3.27Å; D449-D451 PolarHBondContact O-N 3Å; D451-E453 PolarHBondContact O-N 2.94Å; D451-E453 PolarHBondContact OD1-N 3.31Å; D451-L454 HydrophobicContact CB-CB 4.44Å; D451-L454 PolarHBondContact O-N 3.22Å; D451-L534 HydrophobicContact CB-CD2 4.05Å
452	P	75	Confident	81.7	Confident	109 Å²	109	70.5 Å²	70.5	71%	0.708	38%	0.38	S	S	*	.	S	Bend	trans	-65.2	-20	-179.7	-21.7	33.5	0	0	0	114.7	V455	P452-V455 WeakPolarHBondContact O-CG2 3.28Å
453	E	77	Confident	80.9	Confident	181 Å²	181	68.9 Å²	68.9	85%	0.846	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-26.6	-178.1	-64	-170	165.3	0	0	112.2	D451 V455	D451-E453 PolarHBondContact O-N 2.94Å; D451-E453 PolarHBondContact OD1-N 3.31Å; E453-V455 PolarHBondContact O-N 3.32Å
454	L	77.6	Confident	80.5	Confident	55 Å²	55	64.4 Å²	64.4	29%	0.288	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	20	-177.2	-65.2	176.2	0	0	0	114.2	D451 R456 T457 I458 L534	D451-L454 HydrophobicContact CB-CB 4.44Å; D451-L454 PolarHBondContact O-N 3.22Å; L454-R456 VanDerWaalsContact C-N 3.29Å; L454-R456 PolarHBondContact O-N 3.23Å; L454-T457 WeakPolarHBondContact O-CB 3.49Å; L454-T457 PolarHBondContact O-N 3.08Å; L454-I458 WeakPolarHBondContact O-CG1 3.31Å; L454-I458 PolarHBondContact O-N 2.96Å; L454-L534 HydrophobicContact CB-CD1 4.26Å; L454-L534 HydrophobicContact CB-CD2 4.4Å; L454-L534 HydrophobicContact CD1-CD1 4.28Å; L454-L534 HydrophobicContact CD1-CD2 3.84Å
455	V	78.3	Confident	80.3	Confident	20 Å²	20	64.4 Å²	64.4	12%	0.121	35%	0.347	C	S	.	.	H	α-helix	trans	-54.5	-40.8	-176.4	171.4	0	0	0	0	112.7	P452 E453 T457 I458 D459	P452-V455 WeakPolarHBondContact O-CG2 3.28Å; E453-V455 PolarHBondContact O-N 3.32Å; V455-T457 VanDerWaalsContact C-N 3.3Å; V455-T457 PolarHBondContact O-N 3.15Å; V455-I458 PolarHBondContact O-N 3.2Å; V455-D459 WeakPolarHBondContact O-CB 3.27Å; V455-D459 PolarHBondContact O-N 3.11Å
456	R	76.3	Confident	80.1	Confident	225 Å²	225	68.5 Å²	68.5	85%	0.849	36%	0.362	S	S	*	.	H	α-helix	trans	-61	-39.7	179.4	-66.7	-175.6	-178.6	178.9	1.3	112.3	L454 A460	L454-R456 VanDerWaalsContact C-N 3.29Å; L454-R456 PolarHBondContact O-N 3.23Å; R456-A460 PolarHBondContact O-N 3.08Å
457	T	72.9	Confident	80.1	Confident	48 Å²	48	67.1 Å²	67.1	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-69.9	-40.8	177.1	-53.4	0	0	0	0	110.5	L454 V455 A460 H461 L534	L454-T457 WeakPolarHBondContact O-CB 3.49Å; L454-T457 PolarHBondContact O-N 3.08Å; V455-T457 VanDerWaalsContact C-N 3.3Å; V455-T457 PolarHBondContact O-N 3.15Å; T457-A460 PolarHBondContact O-N 3.42Å; T457-H461 PolarHBondContact O-CD2 3.32Å; T457-H461 PolarHBondContact O-N 3.1Å; T457-L534 HydrophobicContact CG2-CD1 4.43Å
458	I	77.2	Confident	80.1	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-63.9	-43.9	176.2	-60.4	173.2	0	0	0	110.5	D449 L454 V455 A460 H461 S462 F526 L534 R536	D449-I458 HydrophobicContact CB-CD1 3.94Å; L454-I458 WeakPolarHBondContact O-CG1 3.31Å; L454-I458 PolarHBondContact O-N 2.96Å; V455-I458 PolarHBondContact O-N 3.2Å; I458-A460 VanDerWaalsContact C-N 3.32Å; I458-A460 PolarHBondContact O-N 2.9Å; I458-H461 PolarHBondContact O-N 3.48Å; I458-S462 WeakPolarHBondContact O-CB 3.47Å; I458-S462 PolarHBondContact O-N 3.02Å; I458-F526 HydrophobicContact CG2-CD2 4.46Å; I458-F526 HydrophobicContact CG2-CE2 4.17Å; I458-L534 HydrophobicContact CD1-CB 4.27Å; I458-L534 HydrophobicContact CD1-CD1 4.46Å; I458-L534 HydrophobicContact CG1-CB 4.08Å; I458-L534 HydrophobicContact CG1-CD1 3.84Å; I458-L534 HydrophobicContact CG1-CG 4.46Å; I458-R536 HydrophobicContact CG2-CB 3.88Å
459	D	78.9	Confident	80.2	Confident	68 Å²	68	65.9 Å²	65.9	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-60.2	-39.2	177.9	-79.4	-24	0	0	0	112.6	V455 R536	V455-D459 WeakPolarHBondContact O-CB 3.27Å; V455-D459 PolarHBondContact O-N 3.11Å; D459-R536 IonicContact OD1-CZ 3.99Å; D459-R536 IonicContact OD1-NH1 2.86Å; D459-R536 PolarHBondContact OD1-NH1 3Å; D459-R536 IonicContact OD1-NH2 2.92Å; D459-R536 PolarHBondContact OD1-NH2 3.42Å
460	A	70	Confident	80.4	Confident	80 Å²	80	64.2 Å²	64.2	66%	0.661	34%	0.339	S	S	*	.	H	α-helix	trans	-67.9	-34.3	179.2	0	0	0	0	0	113	R456 T457 I458	R456-A460 PolarHBondContact O-N 3.08Å; T457-A460 PolarHBondContact O-N 3.42Å; I458-A460 VanDerWaalsContact C-N 3.32Å; I458-A460 PolarHBondContact O-N 2.9Å
461	H	68.6	Low	80.8	Confident	46 Å²	46	62.7 Å²	62.7	21%	0.213	32%	0.324	C	S	.	.	H	α-helix	trans	-93.6	-23.9	-178.3	-71.6	-64.7	0	0	0	113.7	T457 I458 F526	T457-H461 PolarHBondContact O-CD2 3.32Å; T457-H461 PolarHBondContact O-N 3.1Å; I458-H461 PolarHBondContact O-N 3.48Å; H461-F526 HydrophobicContact CB-CD1 4.06Å; H461-F526 HydrophobicContact CB-CE1 4.46Å; H461-F526 HydrophobicContact CB-CG 4.35Å
462	S	73.4	Confident	81.5	Confident	14 Å²	14	63.7 Å²	63.7	10%	0.098	33%	0.332	C	S	.	.			trans	-78.1	135.4	-176.5	178.5	0	0	0	0	112	I458 V464	I458-S462 WeakPolarHBondContact O-CB 3.47Å; I458-S462 PolarHBondContact O-N 3.02Å; S462-V464 WeakPolarHBondContact CB-O 3.48Å; S462-V464 PolarHBondContact O-N 3Å; S462-V464 VanDerWaalsContact OG-CG2 3.28Å; S462-V464 WeakPolarHBondContact OG-CG2 3.4Å; S462-V464 PolarHBondContact OG-N 3.43Å; S462-V464 VanDerWaalsContact OG-N 3.16Å; S462-V464 PolarHBondContact OG-O 3.44Å
463	P	72.8	Confident	82.2	Confident	24 Å²	24	59.9 Å²	59.9	16%	0.156	31%	0.312	C	S	.	.	S	Bend	trans	-70.7	-19	172.2	30.2	-34	0	0	0	112.4
464	V	83.7	Confident	83	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.018	27%	0.272	C	S	.	.	S	Bend	trans	-112.5	139.5	-177	-65.2	0	0	0	0	111.8	S462 T479 W524 R536 Q538	S462-V464 WeakPolarHBondContact CB-O 3.48Å; S462-V464 PolarHBondContact O-N 3Å; S462-V464 VanDerWaalsContact OG-CG2 3.28Å; S462-V464 WeakPolarHBondContact OG-CG2 3.4Å; S462-V464 PolarHBondContact OG-N 3.43Å; S462-V464 VanDerWaalsContact OG-N 3.16Å; S462-V464 PolarHBondContact OG-O 3.44Å; V464-T479 HydrophobicContact CG1-CG2 4.11Å; V464-T479 WeakPolarHBondContact CG1-OG1 3.44Å; V464-W524 HydrophobicContact CG1-CH2 3.95Å; V464-W524 HydrophobicContact CG1-CZ2 3.99Å; V464-W524 HydrophobicContact CG2-CD2 4.31Å; V464-W524 HydrophobicContact CG2-CE3 3.89Å; V464-W524 HydrophobicContact CG2-CH2 3.88Å; V464-W524 HydrophobicContact CG2-CZ2 4.26Å; V464-W524 HydrophobicContact CG2-CZ3 3.66Å; V464-R536 PolarHBondContact O-NH1 3.48Å; V464-Q538 HydrophobicContact CB-CG 4.35Å; V464-Q538 HydrophobicContact CG2-CB 4.01Å; V464-Q538 HydrophobicContact CG2-CG 4.13Å
465	S	86.6	Confident	83.6	Confident	63 Å²	63	48.8 Å²	48.8	44%	0.441	26%	0.259	S	S	.	.			trans	-68.7	153.8	177.8	-56.8	0	0	0	0	111.9
466	R	88.4	Confident	84.3	Confident	112 Å²	112	47.9 Å²	47.9	42%	0.423	25%	0.253	S	S	.	.	S	Bend	trans	-58.2	-48.3	172.9	175.6	179.5	167	-179.5	-1	112	E446 A447 Q538	E446-R466 IonicContact OE1-CZ 3.88Å; E446-R466 IonicContact OE1-NE 2.66Å; E446-R466 PolarHBondContact OE1-NE 3.13Å; E446-R466 IonicContact OE1-NH2 3.92Å; E446-R466 PolarHBondContact OE1-NH2 2.84Å; A447-R466 HydrophobicContact CB-CG 4.39Å; A447-R466 VanDerWaalsContact CB-O 3.28Å; A447-R466 WeakPolarHBondContact CB-O 3.47Å; A447-R466 PolarHBondContact N-O 3.19Å; R466-Q538 PolarHBondContact O-NE2 3.48Å
467	L	90.1	Very high	84.9	Confident	88 Å²	88	37.6 Å²	37.6	46%	0.461	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.5	178.5	-170.6	67.9	0	0	0	109.4	A444 E446	A444-L467 HydrophobicContact CB-CD1 4.01Å; E446-L467 HydrophobicContact CB-CD1 4.33Å
468	I	91.4	Very high	85.5	Confident	11 Å²	11	35.3 Å²	35.3	6%	0.056	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119	173.7	-57.2	178.2	0	0	0	108	A444 F445 L470 Q538 L539 L541	A444-I468 WeakPolarHBondContact CA-O 3.49Å; F445-I468 PolarHBondContact N-O 3.37Å; F445-I468 PolarHBondContact O-N 3.04Å; I468-L470 HydrophobicContact CG2-CD1 4.28Å; I468-L470 HydrophobicContact CG2-CD2 4.04Å; I468-L470 HydrophobicContact CG2-CG 3.9Å; I468-Q538 HydrophobicContact CD1-CG 3.52Å; I468-Q538 HydrophobicContact CG1-CG 4.21Å; I468-L539 HydrophobicContact CD1-CB 4.35Å; I468-L541 WeakPolarHBondContact CD1-O 3.26Å
469	Q	92.7	Very high	85.7	Confident	95 Å²	95	36.1 Å²	36.1	44%	0.444	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.3	173.3	-67.3	-179.9	-17.1	0	0	109.5	L435 R443 A444	L435-Q469 HydrophobicContact CD2-CB 3.91Å; L435-Q469 WeakPolarHBondContact CD2-O 3.37Å; R443-Q469 WeakPolarHBondContact O-CA 3.46Å; A444-Q469 HydrophobicContact CB-CG 4.26Å
470	L	93.7	Very high	85.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	148.2	179.5	-61.9	175.6	0	0	0	110.4	R443 F445 I468 A474 V476 V496 F499 P507 L539 L541 L543	R443-L470 PolarHBondContact N-O 2.89Å; R443-L470 PolarHBondContact O-N 3.26Å; F445-L470 HydrophobicContact CD2-CD1 4.29Å; F445-L470 HydrophobicContact CE2-CB 4.36Å; F445-L470 HydrophobicContact CE2-CD1 4.1Å; F445-L470 HydrophobicContact CE2-CG 4.5Å; I468-L470 HydrophobicContact CG2-CD1 4.28Å; I468-L470 HydrophobicContact CG2-CD2 4.04Å; I468-L470 HydrophobicContact CG2-CG 3.9Å; L470-A474 HydrophobicContact CD2-CB 4.47Å; L470-V476 HydrophobicContact CD2-CG1 3.58Å; L470-V496 HydrophobicContact CD1-CG2 4.5Å; L470-F499 HydrophobicContact CB-CE1 4.06Å; L470-F499 HydrophobicContact CB-CZ 3.86Å; L470-P507 HydrophobicContact CD1-CB 4.18Å; L470-P507 HydrophobicContact CD1-CG 4.08Å; L470-L539 HydrophobicContact CD1-CD1 4.35Å; L470-L541 HydrophobicContact CD1-CD1 3.98Å; L470-L543 HydrophobicContact CD2-CD2 3.93Å
471	K	93.9	Very high	86	Confident	26 Å²	26	35.1 Å²	35.1	11%	0.113	19%	0.187	C	C	.	.			trans	-125.6	162.8	169.4	-73.2	-177.1	179	176.3	0	109.5	L435 Q436 L438 G473 A474 V496	L435-K471 HydrophobicContact CD1-CB 4.1Å; L435-K471 HydrophobicContact CD1-CD 4.38Å; L435-K471 HydrophobicContact CD1-CG 4.12Å; L435-K471 VanDerWaalsContact O-CD 3.31Å; L435-K471 WeakPolarHBondContact O-CD 3.28Å; L435-K471 WeakPolarHBondContact O-CE 3.48Å; L435-K471 PolarHBondContact O-NZ 3.25Å; Q436-K471 PolarHBondContact O-NZ 3.13Å; L438-K471 HydrophobicContact CB-CB 4.44Å; L438-K471 HydrophobicContact CB-CD 3.96Å; L438-K471 HydrophobicContact CD1-CB 4.38Å; L438-K471 PolarHBondContact O-NZ 3.38Å; K471-G473 PolarHBondContact O-N 3.49Å; K471-A474 WeakPolarHBondContact O-CB 3.46Å; K471-A474 PolarHBondContact O-N 2.9Å; K471-V496 WeakPolarHBondContact O-CB 3.47Å
472	V	92.5	Very high	86.3	Confident	69 Å²	69	35.8 Å²	35.8	42%	0.418	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	135.8	165.9	177	0	0	0	0	108.3	A474 E497 F499	V472-A474 VanDerWaalsContact C-N 3.3Å; V472-E497 WeakPolarHBondContact CG1-O 3.34Å; V472-F499 HydrophobicContact CG2-CD2 3.93Å; V472-F499 HydrophobicContact CG2-CE2 3.83Å
473	G	90.6	Very high	86.4	Confident	28 Å²	28	37.3 Å²	37.3	29%	0.289	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	-2.8	-171.6	0	0	0	0	0	114.5	K471 Q475 V496	K471-G473 PolarHBondContact O-N 3.49Å; G473-Q475 PolarHBondContact O-N 3.03Å; G473-V496 PolarHBondContact N-O 3.42Å
474	A	92.8	Very high	86.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.			trans	-67.6	131.3	178.8	0	0	0	0	0	111.4	L435 L438 L470 K471 V472 V495 V496 W545	L435-A474 HydrophobicContact CD1-CB 3.97Å; L438-A474 HydrophobicContact CD1-CB 4.09Å; L470-A474 HydrophobicContact CD2-CB 4.47Å; K471-A474 WeakPolarHBondContact O-CB 3.46Å; K471-A474 PolarHBondContact O-N 2.9Å; V472-A474 VanDerWaalsContact C-N 3.3Å; A474-V495 WeakPolarHBondContact O-CA 3.47Å; A474-V496 HydrophobicContact CB-CG2 4.21Å; A474-V496 PolarHBondContact O-N 3.08Å; A474-W545 HydrophobicContact CB-CH2 3.88Å; A474-W545 HydrophobicContact CB-CZ2 4.48Å
475	Q	91.3	Very high	85.7	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	123.7	176.4	-170.1	172.1	-70	0	0	110.1	L416 G473 G494 A544 W545	L416-Q475 PolarHBondContact O-NE2 2.83Å; L416-Q475 PolarHBondContact O-OE1 2.81Å; G473-Q475 PolarHBondContact O-N 3.03Å; Q475-G494 WeakPolarHBondContact CA-O 3.5Å; Q475-A544 HydrophobicContact CG-CB 4.35Å; Q475-A544 PolarHBondContact NE2-O 3.48Å; Q475-A544 PolarHBondContact O-N 2.98Å; Q475-W545 HydrophobicContact CB-CD2 4.08Å; Q475-W545 HydrophobicContact CB-CG 4.3Å; Q475-W545 HydrophobicContact CB-CZ2 3.98Å; Q475-W545 VanDerWaalsContact N-CZ2 3.26Å
476	V	91.8	Very high	85.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	157.6	-174.2	-62.5	0	0	0	0	111.8	L470 R493 G494 V496 V509 L541 K542 A544	L470-V476 HydrophobicContact CD2-CG1 3.58Å; V476-R493 WeakPolarHBondContact O-CA 3.41Å; V476-G494 PolarHBondContact N-O 3.36Å; V476-G494 PolarHBondContact O-N 3.49Å; V476-V496 HydrophobicContact CG1-CG2 3.99Å; V476-V496 HydrophobicContact CG2-CG2 4.3Å; V476-V509 HydrophobicContact CG2-CG1 3.67Å; V476-V509 HydrophobicContact CG2-CG2 4.04Å; V476-L541 HydrophobicContact CB-CD1 4.45Å; V476-L541 HydrophobicContact CB-CD2 3.98Å; V476-L541 HydrophobicContact CG1-CD1 4.46Å; V476-L541 HydrophobicContact CG2-CD1 4.23Å; V476-L541 HydrophobicContact CG2-CD2 3.74Å; V476-K542 CarbonylContact C-O 3.07Å; V476-K542 VanDerWaalsContact CA-O 3.23Å; V476-K542 WeakPolarHBondContact CA-O 3.46Å; V476-A544 VanDerWaalsContact C-CB 3.44Å
477	M	88.8	Confident	84.2	Confident	10 Å²	10	42.8 Å²	42.8	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.7	175.6	177.6	179.7	-71.4	0	0	109.1	A492 R493 L541 K542 A544 I547 M555 L557	M477-A492 CarbonylContact C-O 3.54Å; M477-A492 WeakPolarHBondContact CA-O 3.2Å; M477-R493 HydrophobicContact CE-CG 4.18Å; M477-L541 WeakPolarHBondContact O-CA 3.39Å; M477-K542 PolarHBondContact N-O 3.47Å; M477-K542 PolarHBondContact O-N 3.36Å; M477-A544 HydrophobicContact CB-CB 3.49Å; M477-A544 VanDerWaalsContact CB-CB 3.49Å; M477-A544 HydrophobicContact CE-CB 4.47Å; M477-I547 HydrophobicContact CE-CD1 4.43Å; M477-M555 HydrophobicContact SD-CE 3.46Å; M477-M555 WeakPolarHBondContact SD-CE 3.31Å; M477-L557 HydrophobicContact CE-CD2 3.62Å
478	L	86.1	Confident	83.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.8	176.3	-165.4	69.1	0	0	0	109.7	K480 L482 L488 N490 G491 A492 F511 L519 P540 L541	L478-K480 WeakPolarHBondContact CD2-O 3.35Å; L478-K480 WeakPolarHBondContact CG-O 3.42Å; L478-L482 HydrophobicContact CD1-CD1 3.75Å; L478-L482 HydrophobicContact CD1-CG 4.23Å; L478-L482 HydrophobicContact CD2-CD1 4.15Å; L478-L482 HydrophobicContact CD2-CG 4.09Å; L478-L488 HydrophobicContact CD2-CB 4.18Å; L478-N490 PolarHBondContact O-OD1 2.68Å; L478-G491 PolarHBondContact O-N 3.4Å; L478-A492 HydrophobicContact CB-CB 4.22Å; L478-A492 PolarHBondContact N-O 2.98Å; L478-F511 HydrophobicContact CB-CE1 4.06Å; L478-F511 HydrophobicContact CB-CZ 4.5Å; L478-F511 HydrophobicContact CD1-CZ 4.31Å; L478-L519 HydrophobicContact CD1-CD1 4Å; L478-P540 WeakPolarHBondContact CA-O 3.23Å; L478-P540 HydrophobicContact CD1-CB 4.17Å; L478-P540 HydrophobicContact CD1-CG 4.03Å; L478-L541 HydrophobicContact CD1-CD2 4.4Å
479	T	82.8	Confident	82.8	Confident	17 Å²	17	40.4 Å²	40.4	10%	0.104	23%	0.234	C	C	.	.			trans	-100.8	-2.2	-176.6	57.8	0	0	0	0	113.5	V464 N490 P540 K542	V464-T479 HydrophobicContact CG1-CG2 4.11Å; V464-T479 WeakPolarHBondContact CG1-OG1 3.44Å; T479-N490 WeakPolarHBondContact CA-OD1 3.41Å; T479-N490 PolarHBondContact O-OD1 3.38Å; T479-P540 PolarHBondContact N-O 2.97Å; T479-P540 WeakPolarHBondContact OG1-CA 3.17Å; T479-P540 PolarHBondContact OG1-O 3.29Å; T479-K542 HydrophobicContact CG2-CB 4Å
480	K	77.8	Confident	82	Confident	60 Å²	60	37.3 Å²	37.3	26%	0.261	22%	0.221	S	C	.	.	S	Bend	trans	-142.8	143.4	-175.6	-168.4	177.1	-179.3	-177.8	0	110	L478 L482 E522 R523 W524 P540	L478-K480 WeakPolarHBondContact CD2-O 3.35Å; L478-K480 WeakPolarHBondContact CG-O 3.42Å; K480-L482 PolarHBondContact O-N 3.32Å; K480-E522 HydrophobicContact CD-CB 4.17Å; K480-E522 HydrophobicContact CD-CG 4.2Å; K480-E522 IonicContact NZ-OE2 3.54Å; K480-E522 PolarHBondContact NZ-OE2 3.23Å; K480-R523 PolarHBondContact NZ-O 3.17Å; K480-W524 HydrophobicContact CB-CZ2 4.39Å; K480-W524 HydrophobicContact CD-CZ2 4.28Å; K480-P540 HydrophobicContact CB-CB 4.14Å
481	N	75.4	Confident	81	Confident	68 Å²	68	37.6 Å²	37.6	36%	0.364	22%	0.224	S	C	.	.			trans	-71.9	117.3	171.6	-58.6	-50.9	0	0	0	108.9	V489 N490	N481-V489 WeakPolarHBondContact OD1-CA 3.46Å; N481-V489 WeakPolarHBondContact OD1-CB 3.09Å; N481-N490 PolarHBondContact OD1-N 3.35Å
482	L	76.8	Confident	80.3	Confident	59 Å²	59	36.9 Å²	36.9	31%	0.309	22%	0.223	S	C	.	.	S	Bend	trans	-97.5	-52.1	175.1	-63.9	179.2	0	0	0	110.2	L478 K480 L488 L519 E522 P540	L478-L482 HydrophobicContact CD1-CD1 3.75Å; L478-L482 HydrophobicContact CD1-CG 4.23Å; L478-L482 HydrophobicContact CD2-CD1 4.15Å; L478-L482 HydrophobicContact CD2-CG 4.09Å; K480-L482 PolarHBondContact O-N 3.32Å; L482-L488 HydrophobicContact CB-CB 4.27Å; L482-L488 PolarHBondContact N-O 2.72Å; L482-L519 HydrophobicContact CD1-CD2 3.69Å; L482-E522 HydrophobicContact CD2-CG 4.06Å; L482-P540 HydrophobicContact CD1-CG 4.44Å
483	D	75.1	Confident	80	Confident	47 Å²	47	33.8 Å²	33.8	25%	0.251	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-147.5	105.5	-179	-168.7	-27.9	0	0	0	111	A485 R486 G487 L488	D483-A485 VanDerWaalsContact C-N 3.31Å; D483-A485 PolarHBondContact O-N 3.2Å; D483-A485 WeakPolarHBondContact OD1-CB 3.49Å; D483-A485 PolarHBondContact OD1-N 3.35Å; D483-R486 HydrophobicContact CB-CB 4.27Å; D483-R486 PolarHBondContact OD1-N 3.43Å; D483-R486 IonicContact OD2-CZ 3.33Å; D483-R486 IonicContact OD2-NE 2.86Å; D483-R486 PolarHBondContact OD2-NE 3.05Å; D483-R486 IonicContact OD2-NH2 2.88Å; D483-R486 PolarHBondContact OD2-NH2 3.35Å; D483-G487 PolarHBondContact O-N 3.3Å; D483-L488 HydrophobicContact CB-CB 4.26Å; D483-L488 HydrophobicContact CB-CD1 4.39Å; D483-L488 PolarHBondContact N-O 3.07Å; D483-L488 VanDerWaalsContact N-O 3.11Å; D483-L488 CarbonylContact O-C 3.55Å; D483-L488 WeakPolarHBondContact O-CA 3.32Å; D483-L488 PolarHBondContact O-N 3.23Å
484	V	72.3	Confident	79.9	Confident	77 Å²	77	32.4 Å²	32.4	47%	0.467	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-30.7	-178.5	-175	0	0	0	0	111.8	G487 V489	V484-G487 PolarHBondContact O-N 3.34Å; V484-V489 HydrophobicContact CB-CG1 4.39Å; V484-V489 HydrophobicContact CG1-CG1 4.24Å; V484-V489 HydrophobicContact CG2-CG1 4.3Å
485	A	68.5	Low	79.9	Confident	100 Å²	100	33 Å²	33	83%	0.826	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-37.2	-177.7	0	0	0	0	0	111.5	D483 G487	D483-A485 VanDerWaalsContact C-N 3.31Å; D483-A485 PolarHBondContact O-N 3.2Å; D483-A485 WeakPolarHBondContact OD1-CB 3.49Å; D483-A485 PolarHBondContact OD1-N 3.35Å; A485-G487 VanDerWaalsContact C-N 3.27Å; A485-G487 PolarHBondContact O-N 2.79Å
486	R	73.6	Confident	80	Confident	111 Å²	111	32.9 Å²	32.9	42%	0.419	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	2.3	174.2	-67.4	-171.9	-72	151.7	8.1	113.8	D483 L488 C513 V515 E517	D483-R486 HydrophobicContact CB-CB 4.27Å; D483-R486 PolarHBondContact OD1-N 3.43Å; D483-R486 IonicContact OD2-CZ 3.33Å; D483-R486 IonicContact OD2-NE 2.86Å; D483-R486 PolarHBondContact OD2-NE 3.05Å; D483-R486 IonicContact OD2-NH2 2.88Å; D483-R486 PolarHBondContact OD2-NH2 3.35Å; R486-L488 VanDerWaalsContact C-N 3.31Å; R486-L488 HydrophobicContact CB-CG 4.42Å; R486-L488 PolarHBondContact O-N 2.9Å; R486-C513 PolarHBondContact O-SG 3.46Å; R486-V515 HydrophobicContact CB-CG2 4.43Å; R486-E517 IonicContact CZ-OE1 3.4Å; R486-E517 IonicContact NH1-OE1 3.04Å; R486-E517 PolarHBondContact NH1-OE1 3.5Å; R486-E517 IonicContact NH2-OE1 3.04Å; R486-E517 PolarHBondContact NH2-OE1 3.49Å
487	G	69.5	Low	79.9	Confident	28 Å²	28	36.4 Å²	36.4	29%	0.289	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	10.4	-179.1	0	0	0	0	0	115	D483 V484 A485 V489	D483-G487 PolarHBondContact O-N 3.3Å; V484-G487 PolarHBondContact O-N 3.34Å; A485-G487 VanDerWaalsContact C-N 3.27Å; A485-G487 PolarHBondContact O-N 2.79Å; G487-V489 VanDerWaalsContact C-N 3.27Å; G487-V489 PolarHBondContact O-N 2.96Å
488	L	78.4	Confident	80.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-82.6	73	176.4	-59.7	179.1	0	0	0	110.6	L478 L482 D483 R486 F511 V515 E517	L478-L488 HydrophobicContact CD2-CB 4.18Å; L482-L488 HydrophobicContact CB-CB 4.27Å; L482-L488 PolarHBondContact N-O 2.72Å; D483-L488 HydrophobicContact CB-CB 4.26Å; D483-L488 HydrophobicContact CB-CD1 4.39Å; D483-L488 PolarHBondContact N-O 3.07Å; D483-L488 VanDerWaalsContact N-O 3.11Å; D483-L488 CarbonylContact O-C 3.55Å; D483-L488 WeakPolarHBondContact O-CA 3.32Å; D483-L488 PolarHBondContact O-N 3.23Å; R486-L488 VanDerWaalsContact C-N 3.31Å; R486-L488 HydrophobicContact CB-CG 4.42Å; R486-L488 PolarHBondContact O-N 2.9Å; L488-F511 HydrophobicContact CD2-CB 4.3Å; L488-F511 HydrophobicContact CD2-CD1 4.26Å; L488-F511 HydrophobicContact CD2-CD2 3.39Å; L488-F511 HydrophobicContact CD2-CE1 4.46Å; L488-F511 HydrophobicContact CD2-CE2 3.63Å; L488-F511 HydrophobicContact CD2-CG 3.72Å; L488-F511 HydrophobicContact CD2-CZ 4.15Å; L488-V515 HydrophobicContact CD1-CG1 4.39Å; L488-V515 HydrophobicContact CD2-CB 4.49Å; L488-V515 HydrophobicContact CD2-CG1 4.44Å; L488-E517 WeakPolarHBondContact CD1-OE2 3.31Å
489	V	73.7	Confident	80.3	Confident	49 Å²	49	39.4 Å²	39.4	30%	0.297	23%	0.228	S	C	.	.			trans	-108	162.2	-177.4	-61.3	0	0	0	0	111.5	N481 V484 G487 G491 A492	N481-V489 WeakPolarHBondContact OD1-CA 3.46Å; N481-V489 WeakPolarHBondContact OD1-CB 3.09Å; V484-V489 HydrophobicContact CB-CG1 4.39Å; V484-V489 HydrophobicContact CG1-CG1 4.24Å; V484-V489 HydrophobicContact CG2-CG1 4.3Å; G487-V489 VanDerWaalsContact C-N 3.27Å; G487-V489 PolarHBondContact O-N 2.96Å; V489-G491 PolarHBondContact O-N 3.26Å; V489-A492 WeakPolarHBondContact O-CB 3.4Å; V489-A492 PolarHBondContact O-N 2.82Å
490	N	76.9	Confident	80.6	Confident	30 Å²	30	42 Å²	42	16%	0.16	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	128.2	172.5	-169.7	11.6	0	0	0	110.1	H257 L478 T479 N481	H257-N490 PolarHBondContact CD2-ND2 3Å; H257-N490 PolarHBondContact CE1-ND2 3.49Å; H257-N490 PolarHBondContact NE2-ND2 3.44Å; L478-N490 PolarHBondContact O-OD1 2.68Å; T479-N490 WeakPolarHBondContact CA-OD1 3.41Å; T479-N490 PolarHBondContact O-OD1 3.38Å; N481-N490 PolarHBondContact OD1-N 3.35Å
491	G	73.6	Confident	80.5	Confident	6 Å²	6	45 Å²	45	6%	0.062	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	94	-9.7	-171.2	0	0	0	0	0	114.5	L478 V489 R493	L478-G491 PolarHBondContact O-N 3.4Å; V489-G491 PolarHBondContact O-N 3.26Å; G491-R493 WeakPolarHBondContact O-CG 3.45Å; G491-R493 PolarHBondContact O-N 3.25Å
492	A	78.9	Confident	80.3	Confident	12 Å²	12	43.7 Å²	43.7	10%	0.099	27%	0.272	C	S	.	.			trans	-60.4	131.3	175.5	0	0	0	0	0	110.3	M477 L478 V489 F511	M477-A492 CarbonylContact C-O 3.54Å; M477-A492 WeakPolarHBondContact CA-O 3.2Å; L478-A492 HydrophobicContact CB-CB 4.22Å; L478-A492 PolarHBondContact N-O 2.98Å; V489-A492 WeakPolarHBondContact O-CB 3.4Å; V489-A492 PolarHBondContact O-N 2.82Å; A492-F511 HydrophobicContact CB-CD1 3.95Å; A492-F511 HydrophobicContact CB-CE1 4.21Å
493	R	85.9	Confident	79.8	Confident	3 Å²	3	51.7 Å²	51.7	1%	0.011	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.3	-174.1	-46.2	172.8	69.3	-129.6	-12.6	109.6	L416 T418 V476 M477 G491 F511 L512	L416-R493 PolarHBondContact O-NH1 2.74Å; L416-R493 PolarHBondContact O-NH2 2.9Å; T418-R493 VanDerWaalsContact N-NH2 3.11Å; T418-R493 PolarHBondContact OG1-NE 3.36Å; T418-R493 PolarHBondContact OG1-NH2 2.64Å; V476-R493 WeakPolarHBondContact O-CA 3.41Å; M477-R493 HydrophobicContact CE-CG 4.18Å; G491-R493 WeakPolarHBondContact O-CG 3.45Å; G491-R493 PolarHBondContact O-N 3.25Å; R493-F511 CarbonylContact O-C 3.57Å; R493-F511 VanDerWaalsContact O-CA 3.29Å; R493-F511 WeakPolarHBondContact O-CA 3.49Å; R493-F511 WeakPolarHBondContact O-CD1 3.28Å; R493-L512 HydrophobicContact CB-CD1 3.76Å; R493-L512 HydrophobicContact CB-CG 4.41Å; R493-L512 HydrophobicContact CG-CD1 4.19Å; R493-L512 PolarHBondContact O-N 3.44Å
494	G	88.5	Confident	79.5	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	174.2	177.6	0	0	0	0	0	113.4	Q475 V476 R510	Q475-G494 WeakPolarHBondContact CA-O 3.5Å; V476-G494 PolarHBondContact N-O 3.36Å; V476-G494 PolarHBondContact O-N 3.49Å; G494-R510 CarbonylContact C-O 3.58Å; G494-R510 WeakPolarHBondContact CA-O 3.4Å
495	V	91.6	Very high	80	Confident	13 Å²	13	52.6 Å²	52.6	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.7	176	-170.1	0	0	0	0	108.9	I415 A474 E497 V509 R510	I415-V495 HydrophobicContact CD1-CG2 4.09Å; I415-V495 HydrophobicContact CG1-CG2 3.37Å; A474-V495 WeakPolarHBondContact O-CA 3.47Å; V495-E497 PolarHBondContact O-N 3.05Å; V495-V509 WeakPolarHBondContact O-CA 3.3Å; V495-R510 PolarHBondContact N-O 3.28Å; V495-R510 PolarHBondContact O-N 3.46Å
496	V	93.4	Very high	81.1	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	113.4	170.6	-179.4	0	0	0	0	108.6	L470 K471 G473 A474 V476 F499 P507 V509	L470-V496 HydrophobicContact CD1-CG2 4.5Å; K471-V496 WeakPolarHBondContact O-CB 3.47Å; G473-V496 PolarHBondContact N-O 3.42Å; A474-V496 HydrophobicContact CB-CG2 4.21Å; A474-V496 PolarHBondContact O-N 3.08Å; V476-V496 HydrophobicContact CG1-CG2 3.99Å; V476-V496 HydrophobicContact CG2-CG2 4.3Å; V496-F499 HydrophobicContact CG1-CE1 4.12Å; V496-F499 HydrophobicContact CG1-CE2 4.22Å; V496-F499 HydrophobicContact CG1-CZ 3.88Å; V496-P507 HydrophobicContact CG1-CB 4.19Å; V496-V509 HydrophobicContact CG2-CG2 4.19Å
497	E	91.3	Very high	82	Confident	73 Å²	73	44.2 Å²	44.2	34%	0.341	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-40.7	179.3	-62.7	-161.8	118.6	0	0	112.3	V472 V495 R508 R510 T516	V472-E497 WeakPolarHBondContact CG1-O 3.34Å; V495-E497 PolarHBondContact O-N 3.05Å; E497-R508 PolarHBondContact N-O 3Å; E497-R510 HydrophobicContact CG-CB 3.78Å; E497-R510 IonicContact OE1-CZ 3.83Å; E497-R510 IonicContact OE1-NE 3.27Å; E497-R510 PolarHBondContact OE1-NE 3.05Å; E497-R510 IonicContact OE1-NH2 3.37Å; E497-R510 PolarHBondContact OE1-NH2 2.67Å; E497-T516 WeakPolarHBondContact OE2-CG2 3.48Å
498	S	91.6	Very high	83.1	Confident	46 Å²	46	47.7 Å²	47.7	32%	0.322	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	170.7	-176.8	60.9	0	0	0	0	110	R508	S498-R508 WeakPolarHBondContact O-CB 3.44Å; S498-R508 PolarHBondContact O-N 3.44Å
499	F	91.4	Very high	83.8	Confident	28 Å²	28	47.7 Å²	47.7	12%	0.123	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.6	169.4	-61.6	-84	0	0	0	108.6	R443 F445 L470 V472 V496 G505 F506 P507	R443-F499 HydrophobicContact CB-CE1 4.32Å; R443-F499 HydrophobicContact CB-CZ 4.27Å; R443-F499 HydrophobicContact CG-CE2 4.39Å; R443-F499 HydrophobicContact CG-CZ 4.45Å; F445-F499 HydrophobicContact CE2-CD1 4.46Å; F445-F499 AromaticContact CE2-CE1 3.9Å; F445-F499 HydrophobicContact CE2-CE1 3.9Å; F445-F499 HydrophobicContact CZ-CD1 4.06Å; F445-F499 AromaticContact CZ-CE1 3.96Å; F445-F499 HydrophobicContact CZ-CE1 3.96Å; L470-F499 HydrophobicContact CB-CE1 4.06Å; L470-F499 HydrophobicContact CB-CZ 3.86Å; V472-F499 HydrophobicContact CG2-CD2 3.93Å; V472-F499 HydrophobicContact CG2-CE2 3.83Å; V496-F499 HydrophobicContact CG1-CE1 4.12Å; V496-F499 HydrophobicContact CG1-CE2 4.22Å; V496-F499 HydrophobicContact CG1-CZ 3.88Å; F499-G505 WeakPolarHBondContact CD1-O 3.45Å; F499-F506 WeakPolarHBondContact CA-O 3.44Å; F499-P507 HydrophobicContact CD1-CB 4.03Å; F499-P507 HydrophobicContact CE1-CB 3.93Å
500	D	87.9	Confident	84.6	Confident	70 Å²	70	49 Å²	49	37%	0.374	26%	0.255	S	S	.	.			trans	-60.8	153.5	179.4	-162.5	16.2	0	0	0	111.6	G502 G505 F506	D500-G502 VanDerWaalsContact C-N 3.29Å; D500-G502 PolarHBondContact O-N 3.16Å; D500-G505 WeakPolarHBondContact O-CA 3.48Å; D500-F506 PolarHBondContact N-O 3.09Å
501	S	76.1	Confident	85.1	Confident	124 Å²	124	47.8 Å²	47.8	87%	0.867	25%	0.248	S	C	*	.	S	Bend	trans	-82.9	-3.5	-177.5	52.6	0	0	0	0	113.6
502	G	72.4	Confident	85.3	Confident	40 Å²	40	49.9 Å²	49.9	41%	0.412	26%	0.258	S	S	.	.	S	Bend	trans	-67.9	162.7	174.4	0	0	0	0	0	113.6	D500 Q504 G505	D500-G502 VanDerWaalsContact C-N 3.29Å; D500-G502 PolarHBondContact O-N 3.16Å; G502-Q504 PolarHBondContact O-N 3.25Å; G502-G505 PolarHBondContact O-N 3.18Å
503	K	64.7	Low	85.2	Confident	227 Å²	227	52.3 Å²	52.3	99%	0.987	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-29	-177.2	-73.2	-173.6	177	-175.8	0	115.3
504	Q	69.2	Low	84.9	Confident	139 Å²	139	55.1 Å²	55.1	65%	0.65	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-12.1	-179.9	-70.8	-176.5	-21.9	0	0	113.8	G502 F506	G502-Q504 PolarHBondContact O-N 3.25Å; Q504-F506 HydrophobicContact CB-CE1 4.08Å; Q504-F506 HydrophobicContact CB-CE2 4.07Å; Q504-F506 HydrophobicContact CB-CZ 3.85Å; Q504-F506 PolarHBondContact O-N 3.26Å
505	G	83.3	Confident	84.8	Confident	4 Å²	4	56.7 Å²	56.7	4%	0.041	31%	0.313	C	S	.	.			trans	56.1	48.4	169.4	0	0	0	0	0	116.3	F445 F499 D500 G502	F445-G505 WeakPolarHBondContact CZ-O 3.27Å; F499-G505 WeakPolarHBondContact CD1-O 3.45Å; D500-G505 WeakPolarHBondContact O-CA 3.48Å; G502-G505 PolarHBondContact O-N 3.18Å
506	F	91.3	Very high	84.7	Confident	35 Å²	35	58.7 Å²	58.7	15%	0.154	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-63.7	147	-175.6	-66.1	-52.7	0	0	0	113.7	F499 D500 Q504 V518 P521 L539	F499-F506 WeakPolarHBondContact CA-O 3.44Å; D500-F506 PolarHBondContact N-O 3.09Å; Q504-F506 HydrophobicContact CB-CE1 4.08Å; Q504-F506 HydrophobicContact CB-CE2 4.07Å; Q504-F506 HydrophobicContact CB-CZ 3.85Å; Q504-F506 PolarHBondContact O-N 3.26Å; F506-V518 HydrophobicContact CB-CG1 3.89Å; F506-P521 HydrophobicContact CD1-CG 4.44Å; F506-P521 HydrophobicContact CE1-CG 3.56Å; F506-P521 HydrophobicContact CZ-CG 4.01Å; F506-L539 HydrophobicContact CD1-CD2 4.21Å
507	P	92.8	Very high	84.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	132.3	-179	29.5	-33.9	0	0	0	111.7	L470 V496 F499 V509 L519 L539 L541	L470-P507 HydrophobicContact CD1-CB 4.18Å; L470-P507 HydrophobicContact CD1-CG 4.08Å; V496-P507 HydrophobicContact CG1-CB 4.19Å; F499-P507 HydrophobicContact CD1-CB 4.03Å; F499-P507 HydrophobicContact CE1-CB 3.93Å; P507-V509 HydrophobicContact CB-CG2 4.29Å; P507-L519 PolarHBondContact O-N 3.41Å; P507-L539 HydrophobicContact CG-CD1 3.88Å; P507-L539 HydrophobicContact CG-CD2 4.33Å; P507-L541 HydrophobicContact CG-CD1 3.93Å
508	R	93.1	Very high	84.5	Confident	102 Å²	102	59.2 Å²	59.2	39%	0.385	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118.3	164.1	-178.7	177.8	-73.7	-110.3	1	108.3	E497 S498 T516 V518	E497-R508 PolarHBondContact N-O 3Å; S498-R508 WeakPolarHBondContact O-CB 3.44Å; S498-R508 PolarHBondContact O-N 3.44Å; R508-T516 HydrophobicContact CG-CG2 3.5Å; R508-T516 VanDerWaalsContact CG-CG2 3.5Å; R508-V518 HydrophobicContact CB-CG2 4.18Å; R508-V518 HydrophobicContact CG-CG2 4.28Å
509	V	92.1	Very high	84.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.3	-175.2	-177.5	0	0	0	0	109.4	V476 V495 V496 P507 F511 T516 E517 L519 L541	V476-V509 HydrophobicContact CG2-CG1 3.67Å; V476-V509 HydrophobicContact CG2-CG2 4.04Å; V495-V509 WeakPolarHBondContact O-CA 3.3Å; V496-V509 HydrophobicContact CG2-CG2 4.19Å; P507-V509 HydrophobicContact CB-CG2 4.29Å; V509-F511 HydrophobicContact CB-CE2 3.98Å; V509-F511 HydrophobicContact CB-CZ 4.23Å; V509-F511 HydrophobicContact CG1-CD1 4.47Å; V509-F511 HydrophobicContact CG1-CD2 4.21Å; V509-F511 HydrophobicContact CG1-CE1 4.17Å; V509-F511 HydrophobicContact CG1-CE2 3.91Å; V509-F511 HydrophobicContact CG1-CZ 3.89Å; V509-T516 WeakPolarHBondContact O-CA 3.48Å; V509-E517 PolarHBondContact N-O 3.44Å; V509-E517 PolarHBondContact O-N 3Å; V509-L519 HydrophobicContact CG2-CD1 4.17Å; V509-L519 HydrophobicContact CG2-CG 4.43Å; V509-L541 HydrophobicContact CG2-CD1 4.07Å
510	R	90.8	Very high	84.5	Confident	77 Å²	77	62.5 Å²	62.5	29%	0.291	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	120.2	167.4	168.6	172.1	29.7	73.9	8.4	109	G494 V495 E497	G494-R510 CarbonylContact C-O 3.58Å; G494-R510 WeakPolarHBondContact CA-O 3.4Å; V495-R510 PolarHBondContact N-O 3.28Å; V495-R510 PolarHBondContact O-N 3.46Å; E497-R510 HydrophobicContact CG-CB 3.78Å; E497-R510 IonicContact OE1-CZ 3.83Å; E497-R510 IonicContact OE1-NE 3.27Å; E497-R510 PolarHBondContact OE1-NE 3.05Å; E497-R510 IonicContact OE1-NH2 3.37Å; E497-R510 PolarHBondContact OE1-NH2 2.67Å
511	F	87.4	Confident	84.7	Confident	3 Å²	3	61 Å²	61	1%	0.013	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	158.4	179.3	-69.7	-86.5	0	0	0	112.3	L478 L488 A492 R493 V509 C513 G514 V515 L519	L478-F511 HydrophobicContact CB-CE1 4.06Å; L478-F511 HydrophobicContact CB-CZ 4.5Å; L478-F511 HydrophobicContact CD1-CZ 4.31Å; L488-F511 HydrophobicContact CD2-CB 4.3Å; L488-F511 HydrophobicContact CD2-CD1 4.26Å; L488-F511 HydrophobicContact CD2-CD2 3.39Å; L488-F511 HydrophobicContact CD2-CE1 4.46Å; L488-F511 HydrophobicContact CD2-CE2 3.63Å; L488-F511 HydrophobicContact CD2-CG 3.72Å; L488-F511 HydrophobicContact CD2-CZ 4.15Å; A492-F511 HydrophobicContact CB-CD1 3.95Å; A492-F511 HydrophobicContact CB-CE1 4.21Å; R493-F511 CarbonylContact O-C 3.57Å; R493-F511 VanDerWaalsContact O-CA 3.29Å; R493-F511 WeakPolarHBondContact O-CA 3.49Å; R493-F511 WeakPolarHBondContact O-CD1 3.28Å; V509-F511 HydrophobicContact CB-CE2 3.98Å; V509-F511 HydrophobicContact CB-CZ 4.23Å; V509-F511 HydrophobicContact CG1-CD1 4.47Å; V509-F511 HydrophobicContact CG1-CD2 4.21Å; V509-F511 HydrophobicContact CG1-CE1 4.17Å; V509-F511 HydrophobicContact CG1-CE2 3.91Å; V509-F511 HydrophobicContact CG1-CZ 3.89Å; F511-C513 PolarHBondContact O-N 3.11Å; F511-C513 VanDerWaalsContact O-N 3.14Å; F511-G514 PolarHBondContact O-N 3.08Å; F511-V515 PolarHBondContact N-O 3.07Å; F511-L519 HydrophobicContact CE2-CD2 4.41Å; F511-L519 HydrophobicContact CZ-CD1 4.02Å; F511-L519 HydrophobicContact CZ-CD2 4.49Å
512	L	78.6	Confident	85.4	Confident	50 Å²	50	58 Å²	58	26%	0.262	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.2	174.1	-81.4	167.6	0	0	0	113.5	I415 R493 G514	I415-L512 HydrophobicContact CB-CD2 4.11Å; I415-L512 HydrophobicContact CD1-CB 4.49Å; I415-L512 HydrophobicContact CD1-CD2 3.58Å; I415-L512 HydrophobicContact CD1-CG 3.59Å; I415-L512 HydrophobicContact CG1-CD2 4.38Å; I415-L512 HydrophobicContact CG2-CD1 4.37Å; I415-L512 HydrophobicContact CG2-CD2 4.21Å; I415-L512 HydrophobicContact CG2-CG 4.3Å; R493-L512 HydrophobicContact CB-CD1 3.76Å; R493-L512 HydrophobicContact CB-CG 4.41Å; R493-L512 HydrophobicContact CG-CD1 4.19Å; R493-L512 PolarHBondContact O-N 3.44Å; L512-G514 PolarHBondContact O-N 3.04Å; L512-G514 VanDerWaalsContact O-N 3.13Å
513	C	75.8	Confident	86.1	Confident	63 Å²	63	63.7 Å²	63.7	43%	0.426	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	3.7	175.2	59.5	0	0	0	0	113.6	R486 F511 V515	R486-C513 PolarHBondContact O-SG 3.46Å; F511-C513 PolarHBondContact O-N 3.11Å; F511-C513 VanDerWaalsContact O-N 3.14Å; C513-V515 PolarHBondContact O-N 3.13Å
514	G	80.2	Confident	86.9	Confident	62 Å²	62	53.9 Å²	53.9	64%	0.639	27%	0.271	S	S	*	.	S	Bend	trans	81.2	-3.9	-177.7	0	0	0	0	0	114.1	F511 L512	F511-G514 PolarHBondContact O-N 3.08Å; L512-G514 PolarHBondContact O-N 3.04Å; L512-G514 VanDerWaalsContact O-N 3.13Å
515	V	85.6	Confident	87.3	Confident	34 Å²	34	51 Å²	51	21%	0.206	26%	0.263	C	S	.	.			trans	-83.6	128.7	179.9	-179.1	0	0	0	0	110	R486 L488 F511 C513	R486-V515 HydrophobicContact CB-CG2 4.43Å; L488-V515 HydrophobicContact CD1-CG1 4.39Å; L488-V515 HydrophobicContact CD2-CB 4.49Å; L488-V515 HydrophobicContact CD2-CG1 4.44Å; F511-V515 PolarHBondContact N-O 3.07Å; C513-V515 PolarHBondContact O-N 3.13Å
516	T	89.7	Confident	86.7	Confident	54 Å²	54	52 Å²	52	33%	0.331	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.7	169.5	-59.8	0	0	0	0	109.8	E497 R508 V509	E497-T516 WeakPolarHBondContact OE2-CG2 3.48Å; R508-T516 HydrophobicContact CG-CG2 3.5Å; R508-T516 VanDerWaalsContact CG-CG2 3.5Å; V509-T516 WeakPolarHBondContact O-CA 3.48Å
517	E	89.5	Confident	85.3	Confident	46 Å²	46	54.5 Å²	54.5	22%	0.215	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147.1	-179.4	-162.6	174.6	-132.3	0	0	111.5	R486 L488 V509 L519	R486-E517 IonicContact CZ-OE1 3.4Å; R486-E517 IonicContact NH1-OE1 3.04Å; R486-E517 PolarHBondContact NH1-OE1 3.5Å; R486-E517 IonicContact NH2-OE1 3.04Å; R486-E517 PolarHBondContact NH2-OE1 3.49Å; L488-E517 WeakPolarHBondContact CD1-OE2 3.31Å; V509-E517 PolarHBondContact N-O 3.44Å; V509-E517 PolarHBondContact O-N 3Å; E517-L519 HydrophobicContact CB-CD2 4.47Å
518	V	91.8	Very high	83.9	Confident	39 Å²	39	55.1 Å²	55.1	24%	0.236	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	117	171.5	-178.8	0	0	0	0	108.4	F506 R508	F506-V518 HydrophobicContact CB-CG1 3.89Å; R508-V518 HydrophobicContact CB-CG2 4.18Å; R508-V518 HydrophobicContact CG-CG2 4.28Å
519	L	91.8	Very high	82	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-89.9	129.1	-175.7	-60.7	-170.7	0	0	0	111.7	L478 L482 P507 V509 F511 E517 L539 L541	L478-L519 HydrophobicContact CD1-CD1 4Å; L482-L519 HydrophobicContact CD1-CD2 3.69Å; P507-L519 PolarHBondContact O-N 3.41Å; V509-L519 HydrophobicContact CG2-CD1 4.17Å; V509-L519 HydrophobicContact CG2-CG 4.43Å; F511-L519 HydrophobicContact CE2-CD2 4.41Å; F511-L519 HydrophobicContact CZ-CD1 4.02Å; F511-L519 HydrophobicContact CZ-CD2 4.49Å; E517-L519 HydrophobicContact CB-CD2 4.47Å; L519-L539 WeakPolarHBondContact O-CD2 3.41Å; L519-L541 HydrophobicContact CD1-CD1 3.88Å; L519-L541 HydrophobicContact CD1-CD2 3.35Å; L519-L541 HydrophobicContact CD1-CG 3.62Å
520	K	91.7	Very high	80.2	Confident	141 Å²	141	55.7 Å²	55.7	61%	0.613	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-101.2	158.5	177.5	-63	-179.7	-176.9	178.2	0	110.7	E522 P540	K520-E522 PolarHBondContact O-N 2.89Å; K520-P540 VanDerWaalsContact O-CD 3.31Å; K520-P540 WeakPolarHBondContact O-CD 3.44Å
521	P	91.4	Very high	78.6	Confident	38 Å²	38	53.2 Å²	53.2	25%	0.247	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-61.9	129.5	175.2	-23.1	34.1	0	0	0	111.1	F506 Q537 Q538 L539	F506-P521 HydrophobicContact CD1-CG 4.44Å; F506-P521 HydrophobicContact CE1-CG 3.56Å; F506-P521 HydrophobicContact CZ-CG 4.01Å; P521-Q537 HydrophobicContact CB-CG 3.87Å; P521-Q538 CarbonylContact C-O 3.58Å; P521-Q538 WeakPolarHBondContact CA-O 3.42Å; P521-L539 HydrophobicContact CG-CD2 4.22Å
522	E	90.3	Very high	77.6	Confident	63 Å²	63	57.5 Å²	57.5	29%	0.294	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	154.2	175.7	-79.4	-65.6	141.5	0	0	109.9	K480 L482 K520 W524 Q537 Q538 P540	K480-E522 HydrophobicContact CD-CB 4.17Å; K480-E522 HydrophobicContact CD-CG 4.2Å; K480-E522 IonicContact NZ-OE2 3.54Å; K480-E522 PolarHBondContact NZ-OE2 3.23Å; L482-E522 HydrophobicContact CD2-CG 4.06Å; K520-E522 PolarHBondContact O-N 2.89Å; E522-W524 HydrophobicContact CB-CH2 3.8Å; E522-W524 HydrophobicContact CB-CZ2 4.26Å; E522-W524 HydrophobicContact CB-CZ3 4.07Å; E522-W524 WeakPolarHBondContact O-CZ3 3.32Å; E522-Q537 VanDerWaalsContact O-CA 3.28Å; E522-Q537 WeakPolarHBondContact O-CA 3.24Å; E522-Q538 PolarHBondContact N-O 3.39Å; E522-Q538 PolarHBondContact O-N 3.23Å; E522-P540 HydrophobicContact CB-CB 4.35Å; E522-P540 HydrophobicContact CB-CG 4.44Å; E522-P540 HydrophobicContact CG-CB 4.25Å; E522-P540 HydrophobicContact CG-CG 3.98Å
523	R	86.8	Confident	77.4	Confident	159 Å²	159	60.6 Å²	60.6	60%	0.6	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	129	175.7	-169.4	173.2	65.3	175.4	-0.2	110.7	K480 V525 R536	K480-R523 PolarHBondContact NZ-O 3.17Å; R523-V525 HydrophobicContact CG-CG2 4.32Å; R523-R536 CarbonylContact C-O 3.57Å; R523-R536 WeakPolarHBondContact CA-O 3.34Å
524	W	82.4	Confident	77.7	Confident	20 Å²	20	57.7 Å²	57.7	8%	0.076	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140	164.9	-63.6	-101	0	0	0	108.8	V464 K480 E522 F526 S535 R536 Q538 P540	V464-W524 HydrophobicContact CG1-CH2 3.95Å; V464-W524 HydrophobicContact CG1-CZ2 3.99Å; V464-W524 HydrophobicContact CG2-CD2 4.31Å; V464-W524 HydrophobicContact CG2-CE3 3.89Å; V464-W524 HydrophobicContact CG2-CH2 3.88Å; V464-W524 HydrophobicContact CG2-CZ2 4.26Å; V464-W524 HydrophobicContact CG2-CZ3 3.66Å; K480-W524 HydrophobicContact CB-CZ2 4.39Å; K480-W524 HydrophobicContact CD-CZ2 4.28Å; E522-W524 HydrophobicContact CB-CH2 3.8Å; E522-W524 HydrophobicContact CB-CZ2 4.26Å; E522-W524 HydrophobicContact CB-CZ3 4.07Å; E522-W524 WeakPolarHBondContact O-CZ3 3.32Å; W524-F526 HydrophobicContact CB-CE1 3.96Å; W524-F526 HydrophobicContact CB-CE2 3.7Å; W524-F526 HydrophobicContact CB-CZ 3.29Å; W524-F526 HydrophobicContact CG-CZ 4.07Å; W524-S535 CarbonylContact O-C 3.57Å; W524-S535 WeakPolarHBondContact O-CA 3.44Å; W524-S535 VanDerWaalsContact O-CB 3.31Å; W524-S535 WeakPolarHBondContact O-CB 3.2Å; W524-R536 PolarHBondContact N-O 3.13Å; W524-R536 PolarHBondContact O-N 3.47Å; W524-Q538 WeakPolarHBondContact CH2-O 3.34Å; W524-Q538 HydrophobicContact CZ3-CB 4.06Å; W524-Q538 WeakPolarHBondContact CZ3-O 3.31Å; W524-P540 HydrophobicContact CH2-CB 3.88Å; W524-P540 HydrophobicContact CZ2-CB 3.92Å
525	V	77.9	Confident	77.9	Confident	80 Å²	80	56 Å²	56	49%	0.485	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126	177.5	-177.4	0	0	0	0	107.3	R523 H533 L534	R523-V525 HydrophobicContact CG-CG2 4.32Å; V525-H533 HydrophobicContact CG1-CB 4.28Å; V525-L534 CarbonylContact C-O 3.5Å; V525-L534 WeakPolarHBondContact CA-O 3.46Å
526	F	70.8	Confident	78	Confident	23 Å²	23	54.3 Å²	54.3	10%	0.101	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.2	-179.5	-45	-79	0	0	0	108.5	I458 H461 W524 H533 L534 R536	I458-F526 HydrophobicContact CG2-CD2 4.46Å; I458-F526 HydrophobicContact CG2-CE2 4.17Å; H461-F526 HydrophobicContact CB-CD1 4.06Å; H461-F526 HydrophobicContact CB-CE1 4.46Å; H461-F526 HydrophobicContact CB-CG 4.35Å; W524-F526 HydrophobicContact CB-CE1 3.96Å; W524-F526 HydrophobicContact CB-CE2 3.7Å; W524-F526 HydrophobicContact CB-CZ 3.29Å; W524-F526 HydrophobicContact CG-CZ 4.07Å; F526-H533 WeakPolarHBondContact O-CA 3.25Å; F526-L534 PolarHBondContact N-O 2.93Å; F526-L534 PolarHBondContact O-N 3.18Å; F526-R536 HydrophobicContact CE2-CB 4.11Å
527	K	61.8	Low	78.1	Confident	89 Å²	89	55.6 Å²	55.6	39%	0.387	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.3	169.6	-68.8	-175.1	176.6	-174.1	0	107.9	S265 H533	S265-K527 PolarHBondContact OG-O 2.94Å; S265-K527 VanDerWaalsContact OG-O 3.06Å; K527-H533 WeakPolarHBondContact CE-NE2 3.43Å
528	S	61.8	Low	78.3	Confident	13 Å²	13	53.7 Å²	53.7	9%	0.091	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-80.6	161.4	174.5	-164.1	0	0	0	0	110.9	G530 G531 I532	S528-G530 PolarHBondContact O-N 3.37Å; S528-G530 VanDerWaalsContact O-N 3.16Å; S528-G531 PolarHBondContact O-N 2.92Å; S528-G531 VanDerWaalsContact O-N 3.08Å; S528-I532 PolarHBondContact N-O 3.4Å
529	T	54.9	Low	78.3	Confident	74 Å²	74	51.8 Å²	51.8	45%	0.454	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	117.4	165.8	29	0	0	0	0	109.5
530	G	53.8	Low	78.3	Confident	39 Å²	39	51.8 Å²	51.8	40%	0.402	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.9	3.6	-175.4	0	0	0	0	0	115.4	A287 S528 I532	A287-G530 WeakPolarHBondContact CB-O 3.08Å; S528-G530 PolarHBondContact O-N 3.37Å; S528-G530 VanDerWaalsContact O-N 3.16Å; G530-I532 VanDerWaalsContact C-N 3.26Å; G530-I532 PolarHBondContact O-N 3.48Å
531	G	56.3	Low	78.3	Confident	26 Å²	26	45.1 Å²	45.1	27%	0.268	24%	0.239	S	C	.	.	S	Bend	trans	82.2	1.3	171.1	0	0	0	0	0	114.9	A287 S528 H533	A287-G531 VanDerWaalsContact CB-N 3.35Å; S528-G531 PolarHBondContact O-N 2.92Å; S528-G531 VanDerWaalsContact O-N 3.08Å; G531-H533 PolarHBondContact O-N 3.02Å; G531-H533 PolarHBondContact O-ND1 3.5Å
532	I	66.8	Low	78.2	Confident	92 Å²	92	46 Å²	46	47%	0.472	24%	0.239	S	C	.	.			trans	-68.1	129.6	172	-57.2	172.9	0	0	0	108.5	S528 G530 L534	S528-I532 PolarHBondContact N-O 3.4Å; G530-I532 VanDerWaalsContact C-N 3.26Å; G530-I532 PolarHBondContact O-N 3.48Å; I532-L534 HydrophobicContact CG2-CD2 3.99Å; I532-L534 PolarHBondContact O-N 3.41Å
533	H	74.4	Confident	78.3	Confident	115 Å²	115	44.4 Å²	44.4	53%	0.532	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	106.6	173.3	-69.3	74.1	0	0	0	108.2	V525 F526 K527 G531	V525-H533 HydrophobicContact CG1-CB 4.28Å; F526-H533 WeakPolarHBondContact O-CA 3.25Å; K527-H533 WeakPolarHBondContact CE-NE2 3.43Å; G531-H533 PolarHBondContact O-N 3.02Å; G531-H533 PolarHBondContact O-ND1 3.5Å
534	L	81.3	Confident	78.4	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	144.2	171.4	-59.9	176.9	0	0	0	108.7	S450 D451 L454 T457 I458 V525 F526 I532	S450-L534 WeakPolarHBondContact OG-CA 3.48Å; D451-L534 HydrophobicContact CB-CD2 4.05Å; L454-L534 HydrophobicContact CB-CD1 4.26Å; L454-L534 HydrophobicContact CB-CD2 4.4Å; L454-L534 HydrophobicContact CD1-CD1 4.28Å; L454-L534 HydrophobicContact CD1-CD2 3.84Å; T457-L534 HydrophobicContact CG2-CD1 4.43Å; I458-L534 HydrophobicContact CD1-CB 4.27Å; I458-L534 HydrophobicContact CD1-CD1 4.46Å; I458-L534 HydrophobicContact CG1-CB 4.08Å; I458-L534 HydrophobicContact CG1-CD1 3.84Å; I458-L534 HydrophobicContact CG1-CG 4.46Å; V525-L534 CarbonylContact C-O 3.5Å; V525-L534 WeakPolarHBondContact CA-O 3.46Å; F526-L534 PolarHBondContact N-O 2.93Å; F526-L534 PolarHBondContact O-N 3.18Å; I532-L534 HydrophobicContact CG2-CD2 3.99Å; I532-L534 PolarHBondContact O-N 3.41Å
535	S	84.9	Confident	78.8	Confident	25 Å²	25	36.7 Å²	36.7	18%	0.175	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.9	173.5	73	0	0	0	0	112	D449 S450 W524	D449-S535 CarbonylContact C-O 3.57Å; D449-S535 WeakPolarHBondContact CA-O 3.28Å; S450-S535 PolarHBondContact N-O 3Å; S450-S535 PolarHBondContact OG-N 3.16Å; S450-S535 PolarHBondContact OG-O 2.7Å; W524-S535 CarbonylContact O-C 3.57Å; W524-S535 WeakPolarHBondContact O-CA 3.44Å; W524-S535 VanDerWaalsContact O-CB 3.31Å; W524-S535 WeakPolarHBondContact O-CB 3.2Å
536	R	88.7	Confident	79.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.2	169.1	173.7	161.9	-72.1	173.1	0.1	108.9	A447 D449 I458 D459 V464 R523 W524 F526 Q538	A447-R536 HydrophobicContact CB-CG 3.97Å; D449-R536 WeakPolarHBondContact OD1-CB 3.42Å; D449-R536 VanDerWaalsContact OD1-CG 3.26Å; D449-R536 WeakPolarHBondContact OD1-CG 3.4Å; D449-R536 IonicContact OD1-CZ 3.2Å; D449-R536 IonicContact OD1-NE 2.72Å; D449-R536 PolarHBondContact OD1-NE 2.84Å; D449-R536 IonicContact OD1-NH2 2.75Å; D449-R536 IonicContact OD2-CZ 3.41Å; D449-R536 IonicContact OD2-NE 3.23Å; D449-R536 PolarHBondContact OD2-NE 3.42Å; D449-R536 IonicContact OD2-NH2 3.98Å; D449-R536 PolarHBondContact OD2-NH2 3.08Å; I458-R536 HydrophobicContact CG2-CB 3.88Å; D459-R536 IonicContact OD1-CZ 3.99Å; D459-R536 IonicContact OD1-NH1 2.86Å; D459-R536 PolarHBondContact OD1-NH1 3Å; D459-R536 IonicContact OD1-NH2 2.92Å; D459-R536 PolarHBondContact OD1-NH2 3.42Å; V464-R536 PolarHBondContact O-NH1 3.48Å; R523-R536 CarbonylContact C-O 3.57Å; R523-R536 WeakPolarHBondContact CA-O 3.34Å; W524-R536 PolarHBondContact N-O 3.13Å; W524-R536 PolarHBondContact O-N 3.47Å; F526-R536 HydrophobicContact CE2-CB 4.11Å; R536-Q538 HydrophobicContact CG-CB 4.14Å
537	Q	91.3	Very high	80.3	Confident	81 Å²	81	32.3 Å²	32.3	38%	0.379	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	119	168.7	-176.7	177.1	5.3	0	0	109.7	A447 L448 P521 E522	A447-Q537 WeakPolarHBondContact CA-O 3.48Å; L448-Q537 HydrophobicContact CB-CB 4.25Å; L448-Q537 PolarHBondContact N-O 3.44Å; L448-Q537 PolarHBondContact O-N 3.26Å; P521-Q537 HydrophobicContact CB-CG 3.87Å; E522-Q537 VanDerWaalsContact O-CA 3.28Å; E522-Q537 WeakPolarHBondContact O-CA 3.24Å
538	Q	93.2	Very high	81.5	Confident	5 Å²	5	28.6 Å²	28.6	2%	0.023	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	163.3	-174	-178.5	54.7	-73.3	0	0	110.2	F445 A447 V464 R466 I468 P521 E522 W524 R536	F445-Q538 PolarHBondContact O-NE2 2.91Å; A447-Q538 HydrophobicContact CB-CB 3.96Å; A447-Q538 HydrophobicContact CB-CG 4.2Å; A447-Q538 VanDerWaalsContact N-NE2 3.15Å; V464-Q538 HydrophobicContact CB-CG 4.35Å; V464-Q538 HydrophobicContact CG2-CB 4.01Å; V464-Q538 HydrophobicContact CG2-CG 4.13Å; R466-Q538 PolarHBondContact O-NE2 3.48Å; I468-Q538 HydrophobicContact CD1-CG 3.52Å; I468-Q538 HydrophobicContact CG1-CG 4.21Å; P521-Q538 CarbonylContact C-O 3.58Å; P521-Q538 WeakPolarHBondContact CA-O 3.42Å; E522-Q538 PolarHBondContact N-O 3.39Å; E522-Q538 PolarHBondContact O-N 3.23Å; W524-Q538 WeakPolarHBondContact CH2-O 3.34Å; W524-Q538 HydrophobicContact CZ3-CB 4.06Å; W524-Q538 WeakPolarHBondContact CZ3-O 3.31Å; R536-Q538 HydrophobicContact CG-CB 4.14Å
539	L	92.9	Very high	82.7	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.159	C	C	.	.			trans	-58.8	135.3	171.5	-65.8	172	0	0	0	110.7	F445 I468 L470 F506 P507 L519 P521 L541	F445-L539 HydrophobicContact CB-CD1 3.96Å; F445-L539 HydrophobicContact CD1-CD1 3.72Å; F445-L539 HydrophobicContact CD2-CD1 3.66Å; F445-L539 HydrophobicContact CE1-CD1 4.09Å; F445-L539 HydrophobicContact CE2-CD1 4.05Å; F445-L539 HydrophobicContact CG-CD1 3.48Å; F445-L539 VanDerWaalsContact CG-CD1 3.48Å; F445-L539 HydrophobicContact CG-CG 4.5Å; F445-L539 HydrophobicContact CZ-CD1 4.24Å; I468-L539 HydrophobicContact CD1-CB 4.35Å; L470-L539 HydrophobicContact CD1-CD1 4.35Å; F506-L539 HydrophobicContact CD1-CD2 4.21Å; P507-L539 HydrophobicContact CG-CD1 3.88Å; P507-L539 HydrophobicContact CG-CD2 4.33Å; L519-L539 WeakPolarHBondContact O-CD2 3.41Å; P521-L539 HydrophobicContact CG-CD2 4.22Å; L539-L541 PolarHBondContact O-N 3.44Å
540	P	90.4	Very high	84	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	15%	0.15	C	C	.	.	S	Bend	trans	-75.8	38.7	178.9	33.5	-37.1	0	0	0	112.7	L478 T479 K480 L482 K520 E522 W524	L478-P540 WeakPolarHBondContact CA-O 3.23Å; L478-P540 HydrophobicContact CD1-CB 4.17Å; L478-P540 HydrophobicContact CD1-CG 4.03Å; T479-P540 PolarHBondContact N-O 2.97Å; T479-P540 WeakPolarHBondContact OG1-CA 3.17Å; T479-P540 PolarHBondContact OG1-O 3.29Å; K480-P540 HydrophobicContact CB-CB 4.14Å; L482-P540 HydrophobicContact CD1-CG 4.44Å; K520-P540 VanDerWaalsContact O-CD 3.31Å; K520-P540 WeakPolarHBondContact O-CD 3.44Å; E522-P540 HydrophobicContact CB-CB 4.35Å; E522-P540 HydrophobicContact CB-CG 4.44Å; E522-P540 HydrophobicContact CG-CB 4.25Å; E522-P540 HydrophobicContact CG-CG 3.98Å; W524-P540 HydrophobicContact CH2-CB 3.88Å; W524-P540 HydrophobicContact CZ2-CB 3.92Å
541	L	91.4	Very high	85.2	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152.8	-175.1	-70	179.9	0	0	0	111.7	I468 L470 V476 M477 L478 P507 V509 L519 L539	I468-L541 WeakPolarHBondContact CD1-O 3.26Å; L470-L541 HydrophobicContact CD1-CD1 3.98Å; V476-L541 HydrophobicContact CB-CD1 4.45Å; V476-L541 HydrophobicContact CB-CD2 3.98Å; V476-L541 HydrophobicContact CG1-CD1 4.46Å; V476-L541 HydrophobicContact CG2-CD1 4.23Å; V476-L541 HydrophobicContact CG2-CD2 3.74Å; M477-L541 WeakPolarHBondContact O-CA 3.39Å; L478-L541 HydrophobicContact CD1-CD2 4.4Å; P507-L541 HydrophobicContact CG-CD1 3.93Å; V509-L541 HydrophobicContact CG2-CD1 4.07Å; L519-L541 HydrophobicContact CD1-CD1 3.88Å; L519-L541 HydrophobicContact CD1-CD2 3.35Å; L519-L541 HydrophobicContact CD1-CG 3.62Å; L539-L541 PolarHBondContact O-N 3.44Å
542	K	90.6	Very high	86.4	Confident	57 Å²	57	28.2 Å²	28.2	25%	0.248	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	149.9	164	-166.3	-179.9	177.7	-170.3	0	109.6	V476 M477 T479	V476-K542 CarbonylContact C-O 3.07Å; V476-K542 VanDerWaalsContact CA-O 3.23Å; V476-K542 WeakPolarHBondContact CA-O 3.46Å; M477-K542 PolarHBondContact N-O 3.47Å; M477-K542 PolarHBondContact O-N 3.36Å; T479-K542 HydrophobicContact CG2-CB 4Å
543	L	91.9	Very high	87.1	Confident	30 Å²	30	24.1 Å²	24.1	16%	0.157	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	139.5	170	-61.8	177.9	0	0	0	110.5	N431 L435 L470 W545	N431-L543 HydrophobicContact CB-CB 4.1Å; N431-L543 HydrophobicContact CB-CD1 4Å; L435-L543 HydrophobicContact CD1-CD2 4.39Å; L435-L543 HydrophobicContact CD2-CD1 4.12Å; L470-L543 HydrophobicContact CD2-CD2 3.93Å; L543-W545 HydrophobicContact CB-CE3 4.37Å; L543-W545 HydrophobicContact CB-CZ3 4.47Å; L543-W545 HydrophobicContact CD1-CZ3 4.29Å; L543-W545 HydrophobicContact CD2-CE3 4.42Å; L543-W545 HydrophobicContact CD2-CH2 4.43Å; L543-W545 HydrophobicContact CD2-CZ3 3.74Å; L543-W545 HydrophobicContact CG-CZ3 4.38Å
544	A	89.9	Confident	87	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.101	C	C	.	.			trans	-132.8	21.4	-166.5	0	0	0	0	0	114.1	T418 Q475 V476 M477	T418-A544 PolarHBondContact OG1-O 3.46Å; Q475-A544 HydrophobicContact CG-CB 4.35Å; Q475-A544 PolarHBondContact NE2-O 3.48Å; Q475-A544 PolarHBondContact O-N 2.98Å; V476-A544 VanDerWaalsContact C-CB 3.44Å; M477-A544 HydrophobicContact CB-CB 3.49Å; M477-A544 VanDerWaalsContact CB-CB 3.49Å; M477-A544 HydrophobicContact CE-CB 4.47Å
545	W	90.8	Very high	86.8	Confident	17 Å²	17	20.3 Å²	20.3	6%	0.064	10%	0.103	C	C	.	.	S	Bend	trans	-70.6	-41.1	167.8	-67.1	-72.3	0	0	0	110.8	R419 N431 K434 L435 L438 A474 Q475 L543	R419-W545 PolarHBondContact N-O 2.89Å; N431-W545 HydrophobicContact CB-CE3 4.47Å; N431-W545 WeakPolarHBondContact OD1-CB 3.37Å; N431-W545 PolarHBondContact OD1-N 3.27Å; N431-W545 VanDerWaalsContact OD1-N 3.1Å; K434-W545 HydrophobicContact CB-CB 4.44Å; K434-W545 HydrophobicContact CB-CD2 3.54Å; K434-W545 HydrophobicContact CB-CE3 3.74Å; K434-W545 HydrophobicContact CB-CG 3.86Å; K434-W545 HydrophobicContact CB-CH2 4.43Å; K434-W545 HydrophobicContact CB-CZ2 4.28Å; K434-W545 HydrophobicContact CB-CZ3 4.18Å; K434-W545 HydrophobicContact CG-CB 4.31Å; K434-W545 HydrophobicContact CG-CD2 4.25Å; K434-W545 HydrophobicContact CG-CG 4.03Å; L435-W545 HydrophobicContact CB-CH2 4.22Å; L435-W545 HydrophobicContact CB-CZ3 3.91Å; L435-W545 HydrophobicContact CD1-CH2 4.01Å; L435-W545 HydrophobicContact CD1-CZ3 4.21Å; L438-W545 HydrophobicContact CD1-CH2 3.67Å; L438-W545 HydrophobicContact CD1-CZ2 3.7Å; L438-W545 HydrophobicContact CG-CZ2 4.46Å; A474-W545 HydrophobicContact CB-CH2 3.88Å; A474-W545 HydrophobicContact CB-CZ2 4.48Å; Q475-W545 HydrophobicContact CB-CD2 4.08Å; Q475-W545 HydrophobicContact CB-CG 4.3Å; Q475-W545 HydrophobicContact CB-CZ2 3.98Å; Q475-W545 VanDerWaalsContact N-CZ2 3.26Å; L543-W545 HydrophobicContact CB-CE3 4.37Å; L543-W545 HydrophobicContact CB-CZ3 4.47Å; L543-W545 HydrophobicContact CD1-CZ3 4.29Å; L543-W545 HydrophobicContact CD2-CE3 4.42Å; L543-W545 HydrophobicContact CD2-CH2 4.43Å; L543-W545 HydrophobicContact CD2-CZ3 3.74Å; L543-W545 HydrophobicContact CG-CZ3 4.38Å
546	A	90.3	Very high	86.5	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.5	174	0	0	0	0	0	111.7	R419 V427 T430 N431	R419-A546 HydrophobicContact CB-CB 4.44Å; R419-A546 CarbonylContact O-C 3.53Å; R419-A546 WeakPolarHBondContact O-CA 3.34Å; V427-A546 HydrophobicContact CB-CB 4.4Å; V427-A546 HydrophobicContact CG1-CB 4.15Å; V427-A546 VanDerWaalsContact CG1-O 3.3Å; V427-A546 WeakPolarHBondContact CG1-O 3.47Å; V427-A546 HydrophobicContact CG2-CB 4.45Å; T430-A546 HydrophobicContact CG2-CB 3.96Å; N431-A546 PolarHBondContact ND2-O 3.13Å; N431-A546 PolarHBondContact OD1-N 3.27Å
547	I	88.8	Confident	86.2	Confident	10 Å²	10	21.9 Å²	21.9	5%	0.051	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157	167	67.4	175.5	0	0	0	109.6	T418 R419 L420 C421 V427 M477 L557	T418-I547 HydrophobicContact CG2-CB 4.41Å; T418-I547 HydrophobicContact CG2-CD1 4.19Å; T418-I547 HydrophobicContact CG2-CG1 3.8Å; T418-I547 HydrophobicContact CG2-CG2 4.09Å; R419-I547 PolarHBondContact O-N 2.81Å; L420-I547 WeakPolarHBondContact CA-O 3.37Å; L420-I547 HydrophobicContact CD2-CD1 3.59Å; L420-I547 HydrophobicContact CD2-CG1 3.25Å; C421-I547 PolarHBondContact N-O 3.33Å; V427-I547 VanDerWaalsContact CG2-C 3.45Å; M477-I547 HydrophobicContact CE-CD1 4.43Å; I547-L557 HydrophobicContact CD1-CD1 4.13Å
548	S	87.8	Confident	85.6	Confident	12 Å²	12	21.1 Å²	21.1	8%	0.084	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	147.7	176.1	63.3	0	0	0	0	111.2	C421 H550 K551 S552	C421-S548 CarbonylContact O-C 3.54Å; C421-S548 VanDerWaalsContact O-CA 3.26Å; C421-S548 WeakPolarHBondContact O-CA 3.16Å; S548-H550 PolarHBondContact O-N 3.04Å; S548-K551 PolarHBondContact O-N 3.12Å; S548-K551 WeakPolarHBondContact OG-CG 3.43Å; S548-K551 PolarHBondContact OG-N 3.13Å; S548-S552 PolarHBondContact O-N 3.44Å
549	I	87.4	Confident	85.1	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-54.8	-43.1	176.9	-65.5	166.9	0	0	0	110.5	L420 C421 T422 K551 S552 Q553 Q572 V575 A576	L420-I549 HydrophobicContact CB-CG1 3.95Å; C421-I549 PolarHBondContact O-N 3.46Å; T422-I549 HydrophobicContact CG2-CD1 3.83Å; I549-K551 VanDerWaalsContact C-N 3.33Å; I549-K551 PolarHBondContact O-N 2.96Å; I549-S552 WeakPolarHBondContact O-CB 3.24Å; I549-S552 PolarHBondContact O-N 3.04Å; I549-S552 PolarHBondContact O-OG 3.06Å; I549-Q553 PolarHBondContact O-N 3.22Å; I549-Q572 HydrophobicContact CB-CG 4.43Å; I549-Q572 HydrophobicContact CD1-CG 3.79Å; I549-Q572 HydrophobicContact CG2-CG 3.98Å; I549-V575 HydrophobicContact CG2-CB 4.18Å; I549-V575 HydrophobicContact CG2-CG1 3.84Å; I549-A576 HydrophobicContact CD1-CB 3.96Å; I549-A576 HydrophobicContact CG1-CB 3.99Å; I549-A576 HydrophobicContact CG2-CB 4.21Å
550	H	80.8	Confident	84.8	Confident	56 Å²	56	21.5 Å²	21.5	26%	0.259	11%	0.113	S	C	.	.	H	α-helix	trans	-53.6	-44.3	174.5	-67.2	91.2	0	0	0	113.5	L342 S548 S552	L342-H550 HydrophobicContact CD1-CB 4.29Å; S548-H550 PolarHBondContact O-N 3.04Å; H550-S552 VanDerWaalsContact C-N 3.32Å
551	K	79.4	Confident	84.8	Confident	87 Å²	87	22 Å²	22	38%	0.378	12%	0.116	S	C	.	.	H	α-helix	trans	-78	-18.9	180	-72.2	-170	177.7	-169.1	0	113	S548 I549 Q553	S548-K551 PolarHBondContact O-N 3.12Å; S548-K551 WeakPolarHBondContact OG-CG 3.43Å; S548-K551 PolarHBondContact OG-N 3.13Å; I549-K551 VanDerWaalsContact C-N 3.33Å; I549-K551 PolarHBondContact O-N 2.96Å; K551-Q553 VanDerWaalsContact C-N 3.32Å
552	S	81.9	Confident	84.6	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-78.2	-14.4	175.8	81	0	0	0	0	113.5	S548 I549 H550 M555 R579	S548-S552 PolarHBondContact O-N 3.44Å; I549-S552 WeakPolarHBondContact O-CB 3.24Å; I549-S552 PolarHBondContact O-N 3.04Å; I549-S552 PolarHBondContact O-OG 3.06Å; H550-S552 VanDerWaalsContact C-N 3.32Å; S552-M555 VanDerWaalsContact O-CB 3.23Å; S552-M555 WeakPolarHBondContact O-CB 3.16Å; S552-M555 PolarHBondContact O-N 3.48Å; S552-R579 WeakPolarHBondContact O-CD 3.23Å; S552-R579 PolarHBondContact O-NH1 2.83Å
553	Q	80.1	Confident	84.1	Confident	7 Å²	7	21.1 Å²	21.1	3%	0.033	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	142.9	178.2	-167.9	170.5	-10.6	0	0	110.8	E302 L342 I549 K551 M555 V575	E302-Q553 PolarHBondContact OE2-NE2 2.8Å; L342-Q553 VanDerWaalsContact CD1-OE1 3.31Å; I549-Q553 PolarHBondContact O-N 3.22Å; K551-Q553 VanDerWaalsContact C-N 3.32Å; Q553-M555 PolarHBondContact O-N 3.1Å; Q553-M555 VanDerWaalsContact O-N 3.13Å; Q553-V575 HydrophobicContact CB-CG1 4.4Å
554	G	73.2	Confident	83.5	Confident	23 Å²	23	19.7 Å²	19.7	24%	0.237	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	-19	-166.3	0	0	0	0	0	117.2
555	M	77.4	Confident	82.7	Confident	14 Å²	14	22.7 Å²	22.7	7%	0.069	13%	0.134	C	C	.	.			trans	-83.3	159.5	-177.1	-51.4	-177.6	72.5	0	0	113	M477 S552 Q553 R579	M477-M555 HydrophobicContact SD-CE 3.46Å; M477-M555 WeakPolarHBondContact SD-CE 3.31Å; S552-M555 VanDerWaalsContact O-CB 3.23Å; S552-M555 WeakPolarHBondContact O-CB 3.16Å; S552-M555 PolarHBondContact O-N 3.48Å; Q553-M555 PolarHBondContact O-N 3.1Å; Q553-M555 VanDerWaalsContact O-N 3.13Å; M555-R579 PolarHBondContact O-NH1 3.13Å
556	T	78.6	Confident	82.1	Confident	57 Å²	57	28.6 Å²	28.6	35%	0.35	16%	0.157	S	C	.	.			trans	-121.7	129	171	-56.3	0	0	0	0	107.9	R376 R581	R376-T556 HydrophobicContact CG-CG2 3.84Å; R376-T556 PolarHBondContact NE-OG1 3.15Å; R376-T556 VanDerWaalsContact NE-OG1 3.14Å; T556-R581 HydrophobicContact CG2-CB 4.41Å
557	L	81.6	Confident	81.6	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-121.8	132.7	-176.3	-59.9	175.6	0	0	0	109.3	L420 M477 I547 V560 R579 A580 R581	L420-L557 HydrophobicContact CD2-CD1 4.04Å; M477-L557 HydrophobicContact CE-CD2 3.62Å; I547-L557 HydrophobicContact CD1-CD1 4.13Å; L557-V560 HydrophobicContact CB-CB 4.43Å; L557-V560 HydrophobicContact CD1-CB 4.39Å; L557-V560 HydrophobicContact CD1-CG2 4.03Å; L557-R579 HydrophobicContact CD1-CB 4.09Å; L557-R579 HydrophobicContact CG-CB 4.33Å; L557-R579 PolarHBondContact N-O 3.08Å; L557-A580 WeakPolarHBondContact O-CA 3.43Å; L557-R581 PolarHBondContact O-N 3.47Å; L557-R581 VanDerWaalsContact O-N 3.13Å
558	D	78.6	Confident	81.1	Confident	65 Å²	65	34 Å²	34	35%	0.348	18%	0.181	S	C	.	.	S	Bend	trans	-77.7	-36.6	178.9	-58.3	-57.2	0	0	0	111.8	R581	D558-R581 IonicContact OD1-NH1 3.19Å
559	C	82.6	Confident	80.8	Confident	13 Å²	13	36 Å²	36	9%	0.088	19%	0.189	C	C	.	.	S	Bend	trans	-135.6	116.3	-177.1	-61.9	0	0	0	0	110.3	I410 T418 G585	I410-C559 HydrophobicContact CG2-CB 3.56Å; T418-C559 PolarHBondContact N-O 3.27Å; C559-G585 WeakPolarHBondContact CA-O 3.33Å
560	V	88.2	Confident	80.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	136.9	-173.1	69.2	0	0	0	0	111.7	L420 L557 I562 A580 G585 L586 R587	L420-V560 HydrophobicContact CD1-CG2 3.57Å; L420-V560 HydrophobicContact CD2-CG2 4.14Å; L420-V560 HydrophobicContact CG-CG2 3.44Å; L420-V560 VanDerWaalsContact CG-CG2 3.44Å; L557-V560 HydrophobicContact CB-CB 4.43Å; L557-V560 HydrophobicContact CD1-CB 4.39Å; L557-V560 HydrophobicContact CD1-CG2 4.03Å; V560-I562 HydrophobicContact CG1-CD1 4.39Å; V560-I562 HydrophobicContact CG1-CG1 4.45Å; V560-I562 HydrophobicContact CG2-CD1 4.44Å; V560-I562 HydrophobicContact CG2-CG1 3.95Å; V560-A580 HydrophobicContact CG1-CB 3.7Å; V560-G585 PolarHBondContact N-O 2.94Å; V560-L586 HydrophobicContact CG1-CD1 3.7Å; V560-R587 PolarHBondContact O-N 2.83Å
561	E	89.1	Confident	80.9	Confident	12 Å²	12	34.8 Å²	34.8	6%	0.056	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.3	170.1	-177.5	-172.5	137.7	0	0	108.6	A417 T418 R419 L420 R587 M589	A417-E561 HydrophobicContact CB-CB 3.95Å; T418-E561 PolarHBondContact O-N 3.46Å; R419-E561 CarbonylContact C-O 3.47Å; R419-E561 VanDerWaalsContact CA-O 3.26Å; R419-E561 WeakPolarHBondContact CA-O 3.28Å; R419-E561 IonicContact CZ-OE1 3.18Å; R419-E561 IonicContact NE-OE1 2.84Å; R419-E561 PolarHBondContact NE-OE1 3Å; R419-E561 IonicContact NH2-OE1 3.47Å; R419-E561 PolarHBondContact NH2-OE1 2.97Å; L420-E561 PolarHBondContact N-O 3.45Å; E561-R587 CarbonylContact C-O 3.54Å; E561-R587 WeakPolarHBondContact CA-O 2.87Å; E561-R587 HydrophobicContact CG-CB 4.42Å; E561-R587 HydrophobicContact CG-CG 4.23Å; E561-R587 IonicContact OE2-CZ 2.69Å; E561-R587 IonicContact OE2-NE 3.35Å; E561-R587 PolarHBondContact OE2-NE 2.8Å; E561-R587 IonicContact OE2-NH2 3.96Å; E561-R587 PolarHBondContact OE2-NH2 2.75Å; E561-M589 HydrophobicContact CG-CG 4.35Å
562	I	87.3	Confident	81.3	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.9	-175.2	-48.8	178	0	0	0	108	L420 V560 L564 A576 L577 L586 R587 M589	L420-I562 HydrophobicContact CB-CG1 4.37Å; L420-I562 HydrophobicContact CD1-CD1 4.24Å; L420-I562 HydrophobicContact CD1-CG1 4.13Å; L420-I562 HydrophobicContact CG-CG1 4.37Å; V560-I562 HydrophobicContact CG1-CD1 4.39Å; V560-I562 HydrophobicContact CG1-CG1 4.45Å; V560-I562 HydrophobicContact CG2-CD1 4.44Å; V560-I562 HydrophobicContact CG2-CG1 3.95Å; I562-L564 HydrophobicContact CG2-CD2 3.66Å; I562-L564 HydrophobicContact CG2-CG 3.92Å; I562-A576 VanDerWaalsContact CD1-C 3.4Å; I562-A576 HydrophobicContact CD1-CB 3.89Å; I562-A576 WeakPolarHBondContact CD1-O 3.47Å; I562-A576 HydrophobicContact CG2-CB 3.8Å; I562-L577 HydrophobicContact CD1-CD2 4.05Å; I562-L577 HydrophobicContact CD1-CG 4.4Å; I562-L586 HydrophobicContact CD1-CD1 3.52Å; I562-L586 HydrophobicContact CG1-CD1 4.09Å; I562-R587 PolarHBondContact N-O 3.16Å; I562-M589 PolarHBondContact O-N 2.85Å
563	S	81.4	Confident	81.6	Confident	39 Å²	39	30.8 Å²	30.8	27%	0.273	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121	166	176.4	0	0	0	0	108.3
564	L	78.2	Confident	82.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.			trans	-99.1	-0.9	-177.9	-66.9	172.7	0	0	0	113.4	I562 R566 V567 A573 V588 M589 F591 V595	I562-L564 HydrophobicContact CG2-CD2 3.66Å; I562-L564 HydrophobicContact CG2-CG 3.92Å; L564-R566 VanDerWaalsContact C-N 3.25Å; L564-R566 PolarHBondContact O-N 3.2Å; L564-R566 VanDerWaalsContact O-N 3.16Å; L564-V567 HydrophobicContact CB-CG2 4.3Å; L564-V567 HydrophobicContact CD2-CG2 3.65Å; L564-V567 WeakPolarHBondContact O-CG2 3.49Å; L564-V567 PolarHBondContact O-N 3.07Å; L564-A573 HydrophobicContact CD2-CB 4Å; L564-V588 HydrophobicContact CD1-CG1 3.52Å; L564-V588 HydrophobicContact CG-CG1 4.21Å; L564-M589 PolarHBondContact N-O 3.05Å; L564-F591 HydrophobicContact CD1-CD2 3.57Å; L564-F591 HydrophobicContact CD1-CE2 4.15Å; L564-V595 HydrophobicContact CB-CG2 4.24Å
565	A	73.7	Confident	82.9	Confident	64 Å²	64	29.6 Å²	29.6	53%	0.529	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.9	-177.7	0	0	0	0	0	114.7	D590	A565-D590 HydrophobicContact CB-CB 3.95Å
566	R	76.9	Confident	83.5	Confident	141 Å²	141	29 Å²	29	53%	0.532	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	21.9	-175.5	-58.2	-175.4	79.2	-177.2	11.5	113.6	T422 D426 L564 F568	T422-R566 WeakPolarHBondContact CG2-O 3.45Å; T422-R566 PolarHBondContact OG1-O 2.98Å; D426-R566 IonicContact OD1-NH1 3.09Å; D426-R566 PolarHBondContact OD1-NH1 3.44Å; D426-R566 IonicContact OD2-NH1 3.37Å; D426-R566 PolarHBondContact OD2-NH1 3.2Å; D426-R566 VanDerWaalsContact OD2-NH1 3.09Å; L564-R566 VanDerWaalsContact C-N 3.25Å; L564-R566 PolarHBondContact O-N 3.2Å; L564-R566 VanDerWaalsContact O-N 3.16Å; R566-F568 PolarHBondContact O-N 3.12Å
567	V	80.1	Confident	84	Confident	17 Å²	17	26.2 Å²	26.2	10%	0.103	14%	0.14	C	C	.	.			trans	-71.1	127.9	176.8	170.5	0	0	0	0	109.7	T422 L564 Q572 V595	T422-V567 HydrophobicContact CG2-CG2 4.05Å; L564-V567 HydrophobicContact CB-CG2 4.3Å; L564-V567 HydrophobicContact CD2-CG2 3.65Å; L564-V567 WeakPolarHBondContact O-CG2 3.49Å; L564-V567 PolarHBondContact O-N 3.07Å; V567-Q572 HydrophobicContact CG1-CB 4.08Å; V567-Q572 HydrophobicContact CG1-CG 4.43Å; V567-V595 HydrophobicContact CB-CB 4.26Å; V567-V595 HydrophobicContact CG1-CB 4.34Å
568	F	79.3	Confident	84.4	Confident	105 Å²	105	26.2 Å²	26.2	46%	0.461	14%	0.14	S	C	.	.			trans	-121.8	-24.2	-176.8	62.8	-86.9	0	0	0	113.3	R566	R566-F568 PolarHBondContact O-N 3.12Å
569	E	81.9	Confident	84.8	Confident	54 Å²	54	23.2 Å²	23.2	25%	0.252	12%	0.124	S	C	.	.	S	Bend	trans	-100	148.1	-179.5	-73.6	-55.1	148.1	0	0	113.7	Q572	E569-Q572 HydrophobicContact CB-CB 4.12Å; E569-Q572 WeakPolarHBondContact O-CB 3.36Å; E569-Q572 PolarHBondContact O-N 2.99Å
570	S	83.9	Confident	85	Confident	24 Å²	24	22.6 Å²	22.6	17%	0.168	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	144	167.6	71.6	0	0	0	0	110.7	P343 Q572	P343-S570 WeakPolarHBondContact CD-O 3.48Å; S570-Q572 PolarHBondContact O-N 2.79Å
571	G	85.1	Confident	84.9	Confident	7 Å²	7	29 Å²	29	7%	0.072	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	-11.5	-177.7	0	0	0	0	0	116.1	Y574 V575 R597	G571-Y574 WeakPolarHBondContact O-CB 3.39Å; G571-Y574 PolarHBondContact O-N 3.48Å; G571-V575 WeakPolarHBondContact O-CG2 3.2Å; G571-V575 PolarHBondContact O-N 3Å; G571-R597 PolarHBondContact N-O 3.06Å
572	Q	87.3	Confident	84.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.5	-43.5	-179.7	-173.8	176.7	33.8	0	0	112.4	L342 I549 V567 E569 S570 Y574 V575 A576	L342-Q572 HydrophobicContact CD2-CB 3.87Å; L342-Q572 HydrophobicContact CD2-CG 4.09Å; I549-Q572 HydrophobicContact CB-CG 4.43Å; I549-Q572 HydrophobicContact CD1-CG 3.79Å; I549-Q572 HydrophobicContact CG2-CG 3.98Å; V567-Q572 HydrophobicContact CG1-CB 4.08Å; V567-Q572 HydrophobicContact CG1-CG 4.43Å; E569-Q572 HydrophobicContact CB-CB 4.12Å; E569-Q572 WeakPolarHBondContact O-CB 3.36Å; E569-Q572 PolarHBondContact O-N 2.99Å; S570-Q572 PolarHBondContact O-N 2.79Å; Q572-Y574 VanDerWaalsContact C-N 3.35Å; Q572-Y574 PolarHBondContact O-N 3.13Å; Q572-V575 PolarHBondContact O-N 2.88Å; Q572-A576 PolarHBondContact O-N 2.93Å
573	A	88.7	Confident	84.6	Confident	3 Å²	3	32 Å²	32	3%	0.025	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-44.3	173.2	0	0	0	0	0	111.5	L564 V575 A576 L577 V596	L564-A573 HydrophobicContact CD2-CB 4Å; A573-V575 PolarHBondContact O-N 3.28Å; A573-A576 PolarHBondContact O-N 2.96Å; A573-L577 WeakPolarHBondContact O-CB 3.36Å; A573-L577 VanDerWaalsContact O-CG 3.32Å; A573-L577 WeakPolarHBondContact O-CG 3.39Å; A573-L577 PolarHBondContact O-N 3.42Å; A573-V596 HydrophobicContact CB-CG2 4.32Å
574	Y	91.5	Very high	84.7	Confident	6 Å²	6	36.4 Å²	36.4	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-44.1	176.6	171.5	-119.4	0	0	0	112.2	A225 L340 Q341 L386 V389 R390 G571 Q572 A576 S578	A225-Y574 HydrophobicContact CB-CE1 4.36Å; A225-Y574 WeakPolarHBondContact CB-OH 3.41Å; A225-Y574 PolarHBondContact N-OH 3.06Å; L340-Y574 WeakPolarHBondContact O-CD1 3.42Å; Q341-Y574 HydrophobicContact CG-CD1 4Å; Q341-Y574 HydrophobicContact CG-CE1 3.75Å; L386-Y574 VanDerWaalsContact O-CE2 3.31Å; L386-Y574 WeakPolarHBondContact O-CE2 3.16Å; V389-Y574 HydrophobicContact CG1-CD2 4.2Å; R390-Y574 HydrophobicContact CB-CD1 4.39Å; R390-Y574 HydrophobicContact CB-CD2 3.82Å; R390-Y574 HydrophobicContact CB-CE1 4.14Å; R390-Y574 HydrophobicContact CB-CE2 3.55Å; R390-Y574 HydrophobicContact CB-CG 4.24Å; R390-Y574 WeakPolarHBondContact CD-OH 3.49Å; R390-Y574 HydrophobicContact CG-CD1 4.17Å; R390-Y574 HydrophobicContact CG-CD2 4.44Å; R390-Y574 HydrophobicContact CG-CE1 3.69Å; R390-Y574 HydrophobicContact CG-CE2 4.01Å; G571-Y574 WeakPolarHBondContact O-CB 3.39Å; G571-Y574 PolarHBondContact O-N 3.48Å; Q572-Y574 VanDerWaalsContact C-N 3.35Å; Q572-Y574 PolarHBondContact O-N 3.13Å; Y574-A576 PolarHBondContact O-N 2.9Å; Y574-S578 WeakPolarHBondContact O-CB 3.49Å; Y574-S578 PolarHBondContact O-N 2.94Å; Y574-S578 PolarHBondContact O-OG 3Å
575	V	90.1	Very high	85	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-45.4	179.6	170	0	0	0	0	110.8	Q341 L342 I549 Q553 G571 Q572 A573 S578 R579	Q341-V575 HydrophobicContact CB-CG2 3.42Å; Q341-V575 VanDerWaalsContact CB-CG2 3.42Å; Q341-V575 HydrophobicContact CG-CG2 3.64Å; L342-V575 HydrophobicContact CD1-CG1 4.47Å; L342-V575 HydrophobicContact CD2-CG2 4.44Å; L342-V575 HydrophobicContact CG-CB 4.43Å; L342-V575 HydrophobicContact CG-CG1 4.41Å; L342-V575 HydrophobicContact CG-CG2 4.07Å; I549-V575 HydrophobicContact CG2-CB 4.18Å; I549-V575 HydrophobicContact CG2-CG1 3.84Å; Q553-V575 HydrophobicContact CB-CG1 4.4Å; G571-V575 WeakPolarHBondContact O-CG2 3.2Å; G571-V575 PolarHBondContact O-N 3Å; Q572-V575 PolarHBondContact O-N 2.88Å; A573-V575 PolarHBondContact O-N 3.28Å; V575-S578 PolarHBondContact O-OG 2.98Å; V575-R579 WeakPolarHBondContact O-CD 3.46Å; V575-R579 VanDerWaalsContact O-CG 3.29Å; V575-R579 WeakPolarHBondContact O-CG 3.42Å; V575-R579 PolarHBondContact O-N 3.06Å; V575-R579 PolarHBondContact O-NE 3.35Å
576	A	89.1	Confident	85.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-52.9	178.5	0	0	0	0	0	111.6	L420 I549 I562 Q572 A573 Y574 S578 R579	L420-A576 HydrophobicContact CD1-CB 3.96Å; I549-A576 HydrophobicContact CD1-CB 3.96Å; I549-A576 HydrophobicContact CG1-CB 3.99Å; I549-A576 HydrophobicContact CG2-CB 4.21Å; I562-A576 VanDerWaalsContact CD1-C 3.4Å; I562-A576 HydrophobicContact CD1-CB 3.89Å; I562-A576 WeakPolarHBondContact CD1-O 3.47Å; I562-A576 HydrophobicContact CG2-CB 3.8Å; Q572-A576 PolarHBondContact O-N 2.93Å; A573-A576 PolarHBondContact O-N 2.96Å; Y574-A576 PolarHBondContact O-N 2.9Å; A576-S578 VanDerWaalsContact C-N 3.34Å; A576-S578 PolarHBondContact O-N 3.29Å; A576-R579 WeakPolarHBondContact O-CB 3.39Å; A576-R579 WeakPolarHBondContact O-CG 3.49Å; A576-R579 PolarHBondContact O-N 3.41Å
577	L	89.4	Confident	86.2	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.2	-40.2	-178.9	-68.7	166.8	0	0	0	112	L386 V389 L402 I562 A573 R579 A580 L586 V588	L386-L577 HydrophobicContact CD2-CB 3.76Å; V389-L577 HydrophobicContact CG1-CD1 3.88Å; V389-L577 HydrophobicContact CG2-CD1 4.4Å; L402-L577 HydrophobicContact CD1-CD1 4.49Å; L402-L577 HydrophobicContact CD2-CD2 3.97Å; I562-L577 HydrophobicContact CD1-CD2 4.05Å; I562-L577 HydrophobicContact CD1-CG 4.4Å; A573-L577 WeakPolarHBondContact O-CB 3.36Å; A573-L577 VanDerWaalsContact O-CG 3.32Å; A573-L577 WeakPolarHBondContact O-CG 3.39Å; A573-L577 PolarHBondContact O-N 3.42Å; L577-R579 PolarHBondContact O-N 2.93Å; L577-R579 VanDerWaalsContact O-N 3.13Å; L577-A580 PolarHBondContact O-N 2.71Å; L577-L586 HydrophobicContact CD2-CD1 4.16Å; L577-L586 HydrophobicContact CD2-CD2 3.82Å; L577-V588 HydrophobicContact CD2-CG2 3.61Å
578	S	89.8	Confident	86.6	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.007	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-3.4	-178.6	67.3	0	0	0	0	115.1	A225 R376 Q377 Y574 V575 A576	A225-S578 VanDerWaalsContact CB-CB 3.48Å; A225-S578 WeakPolarHBondContact CB-OG 3.42Å; R376-S578 PolarHBondContact NH1-O 3.27Å; Q377-S578 PolarHBondContact NE2-O 3.46Å; Y574-S578 WeakPolarHBondContact O-CB 3.49Å; Y574-S578 PolarHBondContact O-N 2.94Å; Y574-S578 PolarHBondContact O-OG 3Å; V575-S578 PolarHBondContact O-OG 2.98Å; A576-S578 VanDerWaalsContact C-N 3.34Å; A576-S578 PolarHBondContact O-N 3.29Å
579	R	87.7	Confident	86.8	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.008	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-31.9	173.4	-60.3	-49.1	80.2	175.9	9.6	112.2	L420 S552 M555 L557 V575 A576 L577	L420-R579 HydrophobicContact CD1-CB 4.44Å; L420-R579 HydrophobicContact CD1-CG 4.05Å; S552-R579 WeakPolarHBondContact O-CD 3.23Å; S552-R579 PolarHBondContact O-NH1 2.83Å; M555-R579 PolarHBondContact O-NH1 3.13Å; L557-R579 HydrophobicContact CD1-CB 4.09Å; L557-R579 HydrophobicContact CG-CB 4.33Å; L557-R579 PolarHBondContact N-O 3.08Å; V575-R579 WeakPolarHBondContact O-CD 3.46Å; V575-R579 VanDerWaalsContact O-CG 3.29Å; V575-R579 WeakPolarHBondContact O-CG 3.42Å; V575-R579 PolarHBondContact O-N 3.06Å; V575-R579 PolarHBondContact O-NE 3.35Å; A576-R579 WeakPolarHBondContact O-CB 3.39Å; A576-R579 WeakPolarHBondContact O-CG 3.49Å; A576-R579 PolarHBondContact O-N 3.41Å; L577-R579 PolarHBondContact O-N 2.93Å; L577-R579 VanDerWaalsContact O-N 3.13Å
580	A	87.2	Confident	86.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-65.2	139.6	179.9	0	0	0	0	0	110.9	Q377 F382 L557 V560 L577 L586	Q377-A580 PolarHBondContact NE2-O 3.09Å; F382-A580 HydrophobicContact CE1-CB 4.3Å; F382-A580 HydrophobicContact CZ-CB 4.06Å; L557-A580 WeakPolarHBondContact O-CA 3.43Å; V560-A580 HydrophobicContact CG1-CB 3.7Å; L577-A580 PolarHBondContact O-N 2.71Å; A580-L586 HydrophobicContact CB-CB 4.02Å; A580-L586 HydrophobicContact CB-CD1 4.29Å
581	R	84.9	Confident	86.8	Confident	133 Å²	133	28.9 Å²	28.9	50%	0.502	14%	0.141	S	C	.	.	S	Bend	trans	-82.7	-33.8	175.3	-169.8	177.2	177.4	-176.8	-6.3	112.7	T556 L557 D558	T556-R581 HydrophobicContact CG2-CB 4.41Å; L557-R581 PolarHBondContact O-N 3.47Å; L557-R581 VanDerWaalsContact O-N 3.13Å; D558-R581 IonicContact OD1-NH1 3.19Å
582	S	84.9	Confident	86.7	Confident	43 Å²	43	31.8 Å²	31.8	30%	0.301	16%	0.155	S	C	.	.	S	Bend	trans	-136.4	158	178.5	61.1	0	0	0	0	110.7	E584 G585	S582-E584 VanDerWaalsContact C-N 3.33Å; S582-G585 PolarHBondContact O-N 3.13Å; S582-G585 PolarHBondContact OG-N 3.08Å
583	L	85.4	Confident	86.5	Confident	34 Å²	34	34.2 Å²	34.2	18%	0.178	17%	0.17	C	C	.	.	S	Bend	trans	-68.2	-33.5	175.4	-176.7	62.4	0	0	0	112.1	F382 T401 H408 G585 L586	F382-L583 HydrophobicContact CB-CB 4.35Å; F382-L583 HydrophobicContact CD2-CB 4.12Å; F382-L583 HydrophobicContact CD2-CD1 3.93Å; F382-L583 HydrophobicContact CE2-CD1 4.09Å; F382-L583 HydrophobicContact CG-CB 4.13Å; T401-L583 HydrophobicContact CG2-CD1 4.33Å; T401-L583 HydrophobicContact CG2-CD2 3.71Å; H408-L583 PolarHBondContact CE1-O 3.08Å; H408-L583 PolarHBondContact ND1-O 3.38Å; L583-G585 VanDerWaalsContact C-N 3.26Å; L583-G585 PolarHBondContact O-N 3.48Å; L583-L586 HydrophobicContact CD1-CD2 4.27Å; L583-L586 PolarHBondContact O-N 2.94Å
584	E	84.3	Confident	86.3	Confident	130 Å²	130	40.9 Å²	40.9	61%	0.607	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.2	175.1	-63.4	177.5	-171.9	0	0	112.7	R412 S582 L586	R412-E584 IonicContact NH2-OE2 3.28Å; S582-E584 VanDerWaalsContact C-N 3.33Å; E584-L586 VanDerWaalsContact C-N 3.26Å; E584-L586 PolarHBondContact O-N 2.91Å
585	G	83.9	Confident	85.9	Confident	5 Å²	5	41.4 Å²	41.4	5%	0.052	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	9.1	178.7	0	0	0	0	0	114	C559 V560 S582 L583	C559-G585 WeakPolarHBondContact CA-O 3.33Å; V560-G585 PolarHBondContact N-O 2.94Å; S582-G585 PolarHBondContact O-N 3.13Å; S582-G585 PolarHBondContact OG-N 3.08Å; L583-G585 VanDerWaalsContact C-N 3.26Å; L583-G585 PolarHBondContact O-N 3.48Å
586	L	87.7	Confident	85.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.4	-178.3	174.3	64.1	0	0	0	111	F382 L402 S405 H408 I410 V560 I562 L577 A580 L583 E584 V588	F382-L586 HydrophobicContact CE2-CD2 3.9Å; F382-L586 HydrophobicContact CZ-CD2 4.08Å; L402-L586 HydrophobicContact CD2-CD2 4.41Å; S405-L586 WeakPolarHBondContact CB-O 3.44Å; H408-L586 PolarHBondContact ND1-O 3.01Å; I410-L586 WeakPolarHBondContact CD1-O 3.45Å; V560-L586 HydrophobicContact CG1-CD1 3.7Å; I562-L586 HydrophobicContact CD1-CD1 3.52Å; I562-L586 HydrophobicContact CG1-CD1 4.09Å; L577-L586 HydrophobicContact CD2-CD1 4.16Å; L577-L586 HydrophobicContact CD2-CD2 3.82Å; A580-L586 HydrophobicContact CB-CB 4.02Å; A580-L586 HydrophobicContact CB-CD1 4.29Å; L583-L586 HydrophobicContact CD1-CD2 4.27Å; L583-L586 PolarHBondContact O-N 2.94Å; E584-L586 VanDerWaalsContact C-N 3.26Å; E584-L586 PolarHBondContact O-N 2.91Å; L586-V588 HydrophobicContact CD1-CG2 3.91Å; L586-V588 HydrophobicContact CD2-CG2 4.11Å; L586-V588 HydrophobicContact CG-CG2 3.88Å
587	R	88.8	Confident	85.7	Confident	46 Å²	46	48.8 Å²	48.8	17%	0.174	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.9	170.7	172.7	163.8	71.8	-171.2	3.5	108.4	I410 E411 V560 E561 I562 M589	I410-R587 HydrophobicContact CD1-CB 3.16Å; I410-R587 HydrophobicContact CG1-CB 4.21Å; E411-R587 IonicContact OE1-NH2 2.65Å; V560-R587 PolarHBondContact O-N 2.83Å; E561-R587 CarbonylContact C-O 3.54Å; E561-R587 WeakPolarHBondContact CA-O 2.87Å; E561-R587 HydrophobicContact CG-CB 4.42Å; E561-R587 HydrophobicContact CG-CG 4.23Å; E561-R587 IonicContact OE2-CZ 2.69Å; E561-R587 IonicContact OE2-NE 3.35Å; E561-R587 PolarHBondContact OE2-NE 2.8Å; E561-R587 IonicContact OE2-NH2 3.96Å; E561-R587 PolarHBondContact OE2-NH2 2.75Å; I562-R587 PolarHBondContact N-O 3.16Å; R587-M589 HydrophobicContact CG-CG 4.37Å; R587-M589 HydrophobicContact CG-SD 3.87Å
588	V	87.6	Confident	85.7	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.9	177.1	-174.4	0	0	0	0	108.8	L402 S405 A406 L564 L577 L586 F591	L402-V588 HydrophobicContact CD2-CG2 4.18Å; S405-V588 PolarHBondContact OG-N 2.85Å; A406-V588 WeakPolarHBondContact CA-O 3.13Å; A406-V588 VanDerWaalsContact CB-O 3.31Å; A406-V588 WeakPolarHBondContact CB-O 3.28Å; L564-V588 HydrophobicContact CD1-CG1 3.52Å; L564-V588 HydrophobicContact CG-CG1 4.21Å; L577-V588 HydrophobicContact CD2-CG2 3.61Å; L586-V588 HydrophobicContact CD1-CG2 3.91Å; L586-V588 HydrophobicContact CD2-CG2 4.11Å; L586-V588 HydrophobicContact CG-CG2 3.88Å; V588-F591 HydrophobicContact CG1-CB 3.95Å; V588-F591 HydrophobicContact CG1-CD2 4.34Å; V588-F591 HydrophobicContact CG1-CG 4.49Å
589	M	84.3	Confident	85.8	Confident	65 Å²	65	51.6 Å²	51.6	32%	0.32	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143.5	175.8	-56.4	-59.7	-65.2	0	0	109.4	A406 E561 I562 L564 R587 F591	A406-M589 HydrophobicContact CB-SD 4.46Å; E561-M589 HydrophobicContact CG-CG 4.35Å; I562-M589 PolarHBondContact O-N 2.85Å; L564-M589 PolarHBondContact N-O 3.05Å; R587-M589 HydrophobicContact CG-CG 4.37Å; R587-M589 HydrophobicContact CG-SD 3.87Å; M589-F591 PolarHBondContact O-N 3.43Å
590	D	80.7	Confident	86	Confident	110 Å²	110	55.6 Å²	55.6	59%	0.588	28%	0.277	S	S	*	.	S	Bend	trans	53.1	49.6	173.5	-45.8	-47.5	0	0	0	112.6	A565 D592	A565-D590 HydrophobicContact CB-CB 3.95Å; D590-D592 PolarHBondContact O-N 2.94Å
591	F	83.6	Confident	86.2	Confident	19 Å²	19	59.3 Å²	59.3	8%	0.083	30%	0.297	C	S	.	.			trans	-74.6	122.6	179.7	-178.9	-112.7	0	0	0	111.2	V394 T399 L402 L403 L564 V588 M589 P593 V596	V394-F591 HydrophobicContact CG1-CE1 4.25Å; V394-F591 HydrophobicContact CG1-CZ 4Å; T399-F591 HydrophobicContact CG2-CD1 4.14Å; T399-F591 HydrophobicContact CG2-CE1 3.92Å; L402-F591 HydrophobicContact CB-CD1 4.23Å; L402-F591 HydrophobicContact CB-CE1 4.39Å; L402-F591 HydrophobicContact CB-CG 4.4Å; L402-F591 HydrophobicContact CD1-CD2 4.29Å; L402-F591 HydrophobicContact CD1-CE1 4Å; L402-F591 HydrophobicContact CD1-CE2 3.73Å; L402-F591 HydrophobicContact CD1-CZ 3.57Å; L403-F591 HydrophobicContact CD2-CB 4.04Å; L403-F591 HydrophobicContact CD2-CD1 4.47Å; L403-F591 HydrophobicContact CG-CD1 4.4Å; L564-F591 HydrophobicContact CD1-CD2 3.57Å; L564-F591 HydrophobicContact CD1-CE2 4.15Å; V588-F591 HydrophobicContact CG1-CB 3.95Å; V588-F591 HydrophobicContact CG1-CD2 4.34Å; V588-F591 HydrophobicContact CG1-CG 4.49Å; M589-F591 PolarHBondContact O-N 3.43Å; F591-P593 HydrophobicContact CE1-CG 4.02Å; F591-V596 HydrophobicContact CE2-CG2 3.73Å; F591-V596 HydrophobicContact CZ-CG2 4.01Å
592	D	83.3	Confident	86.6	Confident	69 Å²	69	53 Å²	53	37%	0.369	27%	0.273	S	S	.	.			trans	-116.9	123.4	167.4	177.3	-0.6	0	0	0	109.1	D590 H594 V595	D590-D592 PolarHBondContact O-N 2.94Å; D592-H594 PolarHBondContact O-N 2.69Å; D592-H594 VanDerWaalsContact O-N 3.1Å; D592-H594 WeakPolarHBondContact OD1-CB 3.49Å; D592-H594 IonicContact OD1-CE1 3.99Å; D592-H594 IonicContact OD1-CG 3.52Å; D592-H594 PolarHBondContact OD1-N 2.86Å; D592-H594 IonicContact OD1-ND1 2.83Å; D592-H594 PolarHBondContact OD1-ND1 3.44Å; D592-H594 IonicContact OD2-ND1 3.93Å; D592-V595 HydrophobicContact CB-CG1 4.14Å; D592-V595 WeakPolarHBondContact O-CG2 3.38Å; D592-V595 PolarHBondContact O-N 3.23Å; D592-V595 VanDerWaalsContact O-N 3.09Å
593	P	83.9	Confident	87	Confident	51 Å²	51	54 Å²	54	33%	0.331	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-51.6	-31.3	175.2	-27.6	35.3	0	0	0	114.3	V394 T399 F591 V595 V596	V394-P593 HydrophobicContact CG1-CB 4.42Å; T399-P593 HydrophobicContact CG2-CG 3.94Å; F591-P593 HydrophobicContact CE1-CG 4.02Å; P593-V595 PolarHBondContact O-N 2.85Å; P593-V596 PolarHBondContact O-N 2.78Å
594	H	83.9	Confident	87.4	Confident	142 Å²	142	57.5 Å²	57.5	66%	0.657	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-69.2	-15.7	-178.2	-61.4	85.7	0	0	0	113.9	D592 V596 R597	D592-H594 PolarHBondContact O-N 2.69Å; D592-H594 VanDerWaalsContact O-N 3.1Å; D592-H594 WeakPolarHBondContact OD1-CB 3.49Å; D592-H594 IonicContact OD1-CE1 3.99Å; D592-H594 IonicContact OD1-CG 3.52Å; D592-H594 PolarHBondContact OD1-N 2.86Å; D592-H594 IonicContact OD1-ND1 2.83Å; D592-H594 PolarHBondContact OD1-ND1 3.44Å; D592-H594 IonicContact OD2-ND1 3.93Å; H594-V596 VanDerWaalsContact C-N 3.3Å; H594-R597 PolarHBondContact O-NE 3.04Å; H594-R597 PolarHBondContact O-NH2 2.79Å
595	V	83.8	Confident	87.8	Confident	17 Å²	17	52.9 Å²	52.9	10%	0.103	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-79.1	-16.7	176.4	-56.5	0	0	0	0	112.4	L564 V567 D592 P593 R597	L564-V595 HydrophobicContact CB-CG2 4.24Å; V567-V595 HydrophobicContact CB-CB 4.26Å; V567-V595 HydrophobicContact CG1-CB 4.34Å; D592-V595 HydrophobicContact CB-CG1 4.14Å; D592-V595 WeakPolarHBondContact O-CG2 3.38Å; D592-V595 PolarHBondContact O-N 3.23Å; D592-V595 VanDerWaalsContact O-N 3.09Å; P593-V595 PolarHBondContact O-N 2.85Å; V595-R597 PolarHBondContact O-N 2.9Å
596	V	86.8	Confident	88.2	Confident	10 Å²	10	52.9 Å²	52.9	6%	0.061	27%	0.27	C	S	.	.			trans	-85.8	93.1	179.7	-177.6	0	0	0	0	109.3	V389 V394 A573 F591 P593 H594	V389-V596 HydrophobicContact CB-CG1 4.3Å; V389-V596 HydrophobicContact CG1-CG1 3.79Å; V394-V596 HydrophobicContact CG2-CB 3.54Å; V394-V596 HydrophobicContact CG2-CG1 3.57Å; V394-V596 HydrophobicContact CG2-CG2 3.86Å; A573-V596 HydrophobicContact CB-CG2 4.32Å; F591-V596 HydrophobicContact CE2-CG2 3.73Å; F591-V596 HydrophobicContact CZ-CG2 4.01Å; P593-V596 PolarHBondContact O-N 2.78Å; H594-V596 VanDerWaalsContact C-N 3.3Å
597	R	88.4	Confident	88.4	Confident	146 Å²	146	60.2 Å²	60.2	55%	0.551	30%	0.302	S	S	*	.			trans	-122.1	141.6	-179.1	-54.1	179.3	-153.5	157.7	7.8	110.9	G571 H594 V595	G571-R597 PolarHBondContact N-O 3.06Å; H594-R597 PolarHBondContact O-NE 3.04Å; H594-R597 PolarHBondContact O-NH2 2.79Å; V595-R597 PolarHBondContact O-N 2.9Å
598	A	89.7	Confident	88.4	Confident	20 Å²	20	62.6 Å²	62.6	17%	0.165	31%	0.313	C	S	.	.			trans	-116.3	140.9	168.6	0	0	0	0	0	109.1	L340 L603	L340-A598 HydrophobicContact CD2-CB 4.03Å; A598-L603 HydrophobicContact CB-CD1 4.1Å; A598-L603 HydrophobicContact CB-CD2 4.22Å; A598-L603 HydrophobicContact CB-CG 4.2Å
599	D	90.9	Very high	88.5	Confident	40 Å²	40	63 Å²	63	21%	0.214	32%	0.316	C	S	.	.			trans	-69.1	127	178.8	-171.8	-69.9	0	0	0	111	F354 D601 V602 L603	F354-D599 HydrophobicContact CE2-CB 4.12Å; F354-D599 HydrophobicContact CZ-CB 4.01Å; D599-D601 VanDerWaalsContact C-N 3.33Å; D599-D601 PolarHBondContact O-N 2.89Å; D599-D601 WeakPolarHBondContact OD1-CB 3.46Å; D599-D601 PolarHBondContact OD1-N 2.9Å; D599-V602 HydrophobicContact CB-CB 4.21Å; D599-V602 HydrophobicContact CB-CG2 3.76Å; D599-V602 WeakPolarHBondContact O-CB 3.42Å; D599-V602 PolarHBondContact O-N 3.44Å; D599-V602 PolarHBondContact OD1-N 2.88Å; D599-L603 WeakPolarHBondContact O-CG 3.3Å; D599-L603 PolarHBondContact O-N 2.88Å
600	P	91.3	Very high	88.6	Confident	86 Å²	86	65.4 Å²	65.4	56%	0.558	32%	0.321	S	S	*	.	H	α-helix	trans	-59.4	-36.9	-178.7	-25.1	34.6	0	0	0	114.4	V602 L603 L604	P600-V602 VanDerWaalsContact C-N 3.28Å; P600-V602 PolarHBondContact O-N 3.19Å; P600-L603 PolarHBondContact O-N 2.86Å; P600-L604 WeakPolarHBondContact O-CG 3.49Å; P600-L604 PolarHBondContact O-N 2.96Å
601	D	92.2	Very high	88.8	Confident	78 Å²	78	66.9 Å²	66.9	42%	0.417	32%	0.322	S	S	.	.	H	α-helix	trans	-66.2	-37.7	-179.5	-71	-22.3	0	0	0	110.5	F356 Q357 D599 L604 F605	F356-D601 HydrophobicContact CZ-CB 4.42Å; Q357-D601 PolarHBondContact NE2-OD2 3.03Å; D599-D601 VanDerWaalsContact C-N 3.33Å; D599-D601 PolarHBondContact O-N 2.89Å; D599-D601 WeakPolarHBondContact OD1-CB 3.46Å; D599-D601 PolarHBondContact OD1-N 2.9Å; D601-L604 PolarHBondContact O-N 3.24Å; D601-F605 WeakPolarHBondContact O-CB 3.35Å; D601-F605 PolarHBondContact O-N 3.2Å
602	V	93.2	Very high	88.7	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-43.8	175.4	-177.1	0	0	0	0	110.8	F339 L340 F354 F356 D599 P600 L604 F605 Y606	F339-V602 HydrophobicContact CB-CG1 3.52Å; F339-V602 HydrophobicContact CB-CG2 4.24Å; L340-V602 HydrophobicContact CD2-CB 4.02Å; L340-V602 HydrophobicContact CD2-CG1 3.47Å; L340-V602 VanDerWaalsContact CD2-CG1 3.47Å; L340-V602 HydrophobicContact CG-CG1 3.64Å; F354-V602 HydrophobicContact CD1-CG2 4.19Å; F354-V602 HydrophobicContact CD2-CG2 3.95Å; F354-V602 HydrophobicContact CE1-CG2 3.79Å; F354-V602 HydrophobicContact CE2-CG2 3.56Å; F354-V602 HydrophobicContact CG-CG2 4.26Å; F354-V602 HydrophobicContact CZ-CG2 3.46Å; F354-V602 VanDerWaalsContact CZ-CG2 3.46Å; F356-V602 HydrophobicContact CE1-CG2 3.95Å; F356-V602 HydrophobicContact CZ-CG2 4.09Å; D599-V602 HydrophobicContact CB-CB 4.21Å; D599-V602 HydrophobicContact CB-CG2 3.76Å; D599-V602 WeakPolarHBondContact O-CB 3.42Å; D599-V602 PolarHBondContact O-N 3.44Å; D599-V602 PolarHBondContact OD1-N 2.88Å; P600-V602 VanDerWaalsContact C-N 3.28Å; P600-V602 PolarHBondContact O-N 3.19Å; V602-L604 VanDerWaalsContact C-N 3.32Å; V602-L604 PolarHBondContact O-N 2.85Å; V602-F605 WeakPolarHBondContact O-CB 3.45Å; V602-F605 PolarHBondContact O-N 2.84Å; V602-Y606 HydrophobicContact CG1-CD2 3.69Å; V602-Y606 HydrophobicContact CG1-CE2 3.58Å; V602-Y606 VanDerWaalsContact O-CD2 3.29Å; V602-Y606 WeakPolarHBondContact O-CD2 3.49Å; V602-Y606 PolarHBondContact O-N 2.88Å
603	L	93.2	Very high	88.4	Confident	63 Å²	63	70.7 Å²	70.7	33%	0.33	33%	0.334	S	S	.	.	H	α-helix	trans	-60	-43	176.1	-69.3	174.6	0	0	0	111.7	L340 V391 A598 D599 P600 Y606 K607	L340-L603 HydrophobicContact CD1-CD2 4.5Å; L340-L603 HydrophobicContact CD2-CD2 3.95Å; L340-L603 HydrophobicContact CD2-CG 4.39Å; V391-L603 HydrophobicContact CB-CD2 4.07Å; V391-L603 HydrophobicContact CG1-CD2 4.22Å; A598-L603 HydrophobicContact CB-CD1 4.1Å; A598-L603 HydrophobicContact CB-CD2 4.22Å; A598-L603 HydrophobicContact CB-CG 4.2Å; D599-L603 WeakPolarHBondContact O-CG 3.3Å; D599-L603 PolarHBondContact O-N 2.88Å; P600-L603 PolarHBondContact O-N 2.86Å; L603-Y606 PolarHBondContact O-N 2.88Å; L603-K607 WeakPolarHBondContact O-CB 3.36Å; L603-K607 PolarHBondContact O-N 3.45Å
604	L	93.7	Very high	88.1	Confident	108 Å²	108	73.7 Å²	73.7	57%	0.565	35%	0.346	S	S	*	.	H	α-helix	trans	-63	-42.4	175.1	-72.2	172.9	0	0	0	111.8	P600 D601 V602 K607 K608	P600-L604 WeakPolarHBondContact O-CG 3.49Å; P600-L604 PolarHBondContact O-N 2.96Å; D601-L604 PolarHBondContact O-N 3.24Å; V602-L604 VanDerWaalsContact C-N 3.32Å; V602-L604 PolarHBondContact O-N 2.85Å; L604-K607 PolarHBondContact O-N 2.84Å; L604-K608 WeakPolarHBondContact O-CB 3.36Å; L604-K608 PolarHBondContact O-N 2.81Å
605	F	93.2	Very high	87.5	Confident	34 Å²	34	72 Å²	72	15%	0.149	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-50.1	175.5	172.7	-101.8	0	0	0	111.9	F220 F339 F356 D601 V602 K607 K608 L609	F220-F605 HydrophobicContact CE1-CE1 4.02Å; F220-F605 HydrophobicContact CE1-CZ 4.03Å; F339-F605 HydrophobicContact CD2-CD1 4.34Å; F339-F605 AromaticContact CD2-CE1 3.96Å; F339-F605 HydrophobicContact CD2-CE1 3.96Å; F339-F605 HydrophobicContact CE2-CE1 4.16Å; F356-F605 HydrophobicContact CB-CD2 4.02Å; F356-F605 HydrophobicContact CB-CE1 4.49Å; F356-F605 HydrophobicContact CB-CE2 3.73Å; F356-F605 HydrophobicContact CB-CZ 3.99Å; F356-F605 HydrophobicContact CD1-CD1 4.33Å; F356-F605 HydrophobicContact CD1-CG 4.31Å; F356-F605 HydrophobicContact CD2-CB 4.04Å; F356-F605 AromaticContact CD2-CD2 3.59Å; F356-F605 HydrophobicContact CD2-CD2 3.59Å; F356-F605 HydrophobicContact CD2-CE2 4.21Å; F356-F605 AromaticContact CD2-CG 3.82Å; F356-F605 HydrophobicContact CD2-CG 3.82Å; F356-F605 HydrophobicContact CE2-CB 3.78Å; F356-F605 HydrophobicContact CE2-CD2 4.23Å; F356-F605 HydrophobicContact CE2-CG 4.08Å; F356-F605 HydrophobicContact CG-CD1 4.31Å; F356-F605 AromaticContact CG-CD2 3.82Å; F356-F605 HydrophobicContact CG-CD2 3.82Å; F356-F605 HydrophobicContact CG-CE2 4.05Å; F356-F605 AromaticContact CG-CG 3.96Å; F356-F605 HydrophobicContact CG-CG 3.96Å; F356-F605 HydrophobicContact CG-CZ 4.39Å; F356-F605 HydrophobicContact CZ-CB 4.07Å; F356-F605 HydrophobicContact CZ-CG 4.44Å; D601-F605 WeakPolarHBondContact O-CB 3.35Å; D601-F605 PolarHBondContact O-N 3.2Å; V602-F605 WeakPolarHBondContact O-CB 3.45Å; V602-F605 PolarHBondContact O-N 2.84Å; F605-K607 PolarHBondContact O-N 2.9Å; F605-K608 PolarHBondContact O-N 2.76Å; F605-L609 HydrophobicContact CE1-CD1 4.14Å; F605-L609 HydrophobicContact CZ-CD1 4.07Å; F605-L609 WeakPolarHBondContact O-CB 3.44Å; F605-L609 PolarHBondContact O-N 2.89Å
606	Y	92.9	Very high	86.7	Confident	5 Å²	5	77.5 Å²	77.5	2%	0.02	37%	0.368	C	S	.	.	H	α-helix	trans	-66.2	-35.9	177.6	-81.1	-75.9	0	0	0	112.8	T222 D338 F339 L340 V602 L603 K608 L609 R610	T222-Y606 HydrophobicContact CG2-CE1 3.61Å; T222-Y606 PolarHBondContact OG1-OH 3.3Å; D338-Y606 WeakPolarHBondContact CA-OH 3.32Å; D338-Y606 PolarHBondContact OD1-OH 2.87Å; F339-Y606 HydrophobicContact CB-CE2 4.03Å; F339-Y606 PolarHBondContact N-OH 3.22Å; L340-Y606 HydrophobicContact CD1-CD2 3.96Å; L340-Y606 HydrophobicContact CD1-CE2 4.09Å; L340-Y606 HydrophobicContact CG-CD2 4.05Å; L340-Y606 HydrophobicContact CG-CE2 3.88Å; V602-Y606 HydrophobicContact CG1-CD2 3.69Å; V602-Y606 HydrophobicContact CG1-CE2 3.58Å; V602-Y606 VanDerWaalsContact O-CD2 3.29Å; V602-Y606 WeakPolarHBondContact O-CD2 3.49Å; V602-Y606 PolarHBondContact O-N 2.88Å; L603-Y606 PolarHBondContact O-N 2.88Å; Y606-K608 VanDerWaalsContact C-N 3.35Å; Y606-L609 PolarHBondContact O-N 2.83Å; Y606-R610 WeakPolarHBondContact O-CG 3.39Å; Y606-R610 PolarHBondContact O-N 3.44Å
607	K	91.2	Very high	85.7	Confident	154 Å²	154	81.3 Å²	81.3	67%	0.67	39%	0.385	S	S	*	.	H	α-helix	trans	-61.5	-43.9	174.5	-173.6	178.8	-178.9	-179.6	0	111.2	L603 L604 F605 R610 K611	L603-K607 WeakPolarHBondContact O-CB 3.36Å; L603-K607 PolarHBondContact O-N 3.45Å; L604-K607 PolarHBondContact O-N 2.84Å; F605-K607 PolarHBondContact O-N 2.9Å; K607-R610 PolarHBondContact O-N 2.8Å; K607-K611 PolarHBondContact O-N 3.09Å; K607-K611 VanDerWaalsContact O-N 3.08Å
608	K	89.8	Confident	84.4	Confident	96 Å²	96	76.5 Å²	76.5	42%	0.417	38%	0.376	S	S	.	.	H	α-helix	trans	-63.5	-45.6	176.4	-178.7	172.7	172	172.8	0	111.7	L604 F605 Y606 R610 K611 E612	L604-K608 WeakPolarHBondContact O-CB 3.36Å; L604-K608 PolarHBondContact O-N 2.81Å; F605-K608 PolarHBondContact O-N 2.76Å; Y606-K608 VanDerWaalsContact C-N 3.35Å; K608-R610 VanDerWaalsContact C-N 3.31Å; K608-R610 PolarHBondContact O-N 2.87Å; K608-K611 PolarHBondContact O-N 2.75Å; K608-K611 VanDerWaalsContact O-N 3.12Å; K608-E612 WeakPolarHBondContact CE-OE1 3.19Å; K608-E612 HydrophobicContact CG-CG 4.46Å; K608-E612 IonicContact NZ-OE1 3.65Å; K608-E612 WeakPolarHBondContact O-CG 3.44Å; K608-E612 PolarHBondContact O-N 3.03Å
609	L	88.2	Confident	82.9	Confident	11 Å²	11	78.7 Å²	78.7	6%	0.058	39%	0.39	C	S	.	.	H	α-helix	trans	-58.9	-40.8	178.8	-172	147.3	0	0	0	112.2	F220 N368 E370 F605 Y606 R613	F220-L609 HydrophobicContact CE1-CD1 4.28Å; N368-L609 HydrophobicContact CB-CD1 3.69Å; N368-L609 HydrophobicContact CB-CG 4.08Å; E370-L609 HydrophobicContact CB-CD2 4.19Å; F605-L609 HydrophobicContact CE1-CD1 4.14Å; F605-L609 HydrophobicContact CZ-CD1 4.07Å; F605-L609 WeakPolarHBondContact O-CB 3.44Å; F605-L609 PolarHBondContact O-N 2.89Å; Y606-L609 PolarHBondContact O-N 2.83Å; L609-R613 PolarHBondContact O-N 3.48Å; L609-R613 VanDerWaalsContact O-N 3.12Å
610	R	87	Confident	81.3	Confident	114 Å²	114	80.4 Å²	80.4	43%	0.43	40%	0.402	S	S	.	.	H	α-helix	trans	-67.6	-40.6	174.5	-70.9	176.6	-174.7	166.5	3.6	112.8	E370 Y606 K607 K608 R613 L614	E370-R610 IonicContact OE1-CZ 3.76Å; E370-R610 IonicContact OE1-NE 3.96Å; E370-R610 IonicContact OE1-NH2 3.73Å; E370-R610 PolarHBondContact OE1-NH2 2.78Å; E370-R610 IonicContact OE2-CZ 3.66Å; E370-R610 IonicContact OE2-NE 3.44Å; E370-R610 PolarHBondContact OE2-NE 3.26Å; E370-R610 VanDerWaalsContact OE2-NE 3.11Å; E370-R610 IonicContact OE2-NH2 3.11Å; Y606-R610 WeakPolarHBondContact O-CG 3.39Å; Y606-R610 PolarHBondContact O-N 3.44Å; K607-R610 PolarHBondContact O-N 2.8Å; K608-R610 VanDerWaalsContact C-N 3.31Å; K608-R610 PolarHBondContact O-N 2.87Å; R610-R613 PolarHBondContact O-N 2.87Å; R610-L614 WeakPolarHBondContact O-CG 3.47Å; R610-L614 PolarHBondContact O-N 3.16Å; R610-L614 VanDerWaalsContact O-N 3.07Å
611	K	85.6	Confident	79.4	Confident	142 Å²	142	80.8 Å²	80.8	62%	0.617	40%	0.4	S	S	*	.	H	α-helix	trans	-62.8	-44.9	176.5	-171.3	-179.8	-179.9	-178.4	0	111.5	K607 K608 R613 L614 L615	K607-K611 PolarHBondContact O-N 3.09Å; K607-K611 VanDerWaalsContact O-N 3.08Å; K608-K611 PolarHBondContact O-N 2.75Å; K608-K611 VanDerWaalsContact O-N 3.12Å; K611-R613 VanDerWaalsContact C-N 3.34Å; K611-R613 PolarHBondContact O-N 3.42Å; K611-L614 PolarHBondContact O-N 3.44Å; K611-L615 HydrophobicContact CG-CD1 4.2Å; K611-L615 WeakPolarHBondContact O-CG 3.31Å; K611-L615 PolarHBondContact O-N 3.11Å
612	E	80.8	Confident	77.3	Confident	75 Å²	75	82.1 Å²	82.1	35%	0.35	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-40.9	177.1	-73.4	175.3	179.8	0	0	112	K608 L615 M616	K608-E612 WeakPolarHBondContact CE-OE1 3.19Å; K608-E612 HydrophobicContact CG-CG 4.46Å; K608-E612 IonicContact NZ-OE1 3.65Å; K608-E612 WeakPolarHBondContact O-CG 3.44Å; K608-E612 PolarHBondContact O-N 3.03Å; E612-L615 PolarHBondContact O-N 3.29Å; E612-M616 PolarHBondContact O-N 2.82Å
613	R	77.4	Confident	74.9	Confident	93 Å²	93	88.9 Å²	88.9	35%	0.351	44%	0.437	S	S	.	.	H	α-helix	trans	-59.5	-47.8	174.2	178.8	-179	173	171.4	1.4	112	E205 L609 R610 K611 L615 M616 Q617	E205-R613 IonicContact OE1-NH2 2.65Å; L609-R613 PolarHBondContact O-N 3.48Å; L609-R613 VanDerWaalsContact O-N 3.12Å; R610-R613 PolarHBondContact O-N 2.87Å; K611-R613 VanDerWaalsContact C-N 3.34Å; K611-R613 PolarHBondContact O-N 3.42Å; R613-L615 VanDerWaalsContact C-N 3.34Å; R613-M616 PolarHBondContact O-N 3.07Å; R613-Q617 WeakPolarHBondContact O-CG 3.15Å; R613-Q617 PolarHBondContact O-N 2.84Å
614	L	76.1	Confident	72.5	Confident	113 Å²	113	92.9 Å²	92.9	59%	0.592	45%	0.448	S	S	*	.	H	α-helix	trans	-62.8	-41.4	179.3	-75.2	162.3	0	0	0	111.8	R610 K611 Q617 A618	R610-L614 WeakPolarHBondContact O-CG 3.47Å; R610-L614 PolarHBondContact O-N 3.16Å; R610-L614 VanDerWaalsContact O-N 3.07Å; K611-L614 PolarHBondContact O-N 3.44Å; L614-Q617 PolarHBondContact O-N 2.88Å; L614-A618 WeakPolarHBondContact O-CB 3.42Å; L614-A618 PolarHBondContact O-N 2.85Å
615	L	73.1	Confident	70.2	Confident	107 Å²	107	93 Å²	93	56%	0.56	45%	0.449	S	S	*	.	H	α-helix	trans	-64.1	-42.3	176.8	-71.5	169.8	0	0	0	111.9	K611 E612 R613 A618 S619	K611-L615 HydrophobicContact CG-CD1 4.2Å; K611-L615 WeakPolarHBondContact O-CG 3.31Å; K611-L615 PolarHBondContact O-N 3.11Å; E612-L615 PolarHBondContact O-N 3.29Å; R613-L615 VanDerWaalsContact C-N 3.34Å; L615-A618 PolarHBondContact O-N 3.13Å; L615-S619 WeakPolarHBondContact O-CB 3.4Å; L615-S619 PolarHBondContact O-N 3.29Å; L615-S619 PolarHBondContact O-OG 3.48Å; L615-S619 VanDerWaalsContact O-OG 3.12Å
616	M	66.9	Low	67.8	Low	133 Å²	133	99.8 Å²	99.8	66%	0.655	48%	0.479	S	S	*	.	H	α-helix	trans	-63.5	-42.7	175.1	-74.9	-148.1	-140.7	0	0	112.1	E612 R613 S619 V620	E612-M616 PolarHBondContact O-N 2.82Å; R613-M616 PolarHBondContact O-N 3.07Å; M616-S619 WeakPolarHBondContact CA-OG 3.33Å; M616-S619 PolarHBondContact O-N 3.19Å; M616-S619 PolarHBondContact O-OG 2.83Å; M616-V620 WeakPolarHBondContact O-CG2 3.2Å; M616-V620 PolarHBondContact O-N 2.88Å; M616-V620 VanDerWaalsContact O-N 3.11Å
617	Q	64.1	Low	65.3	Low	90 Å²	90	106.2 Å²	106.2	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-48.6	176.9	-72.9	177.3	-36.6	0	0	111.3	R613 L614 S619 V620 D621	R613-Q617 WeakPolarHBondContact O-CG 3.15Å; R613-Q617 PolarHBondContact O-N 2.84Å; L614-Q617 PolarHBondContact O-N 2.88Å; Q617-S619 VanDerWaalsContact C-N 3.31Å; Q617-S619 PolarHBondContact O-N 2.91Å; Q617-V620 PolarHBondContact O-N 2.92Å; Q617-V620 VanDerWaalsContact O-N 3.13Å; Q617-D621 VanDerWaalsContact O-CG 3.3Å; Q617-D621 PolarHBondContact O-N 2.87Å
618	A	61.4	Low	63	Low	44 Å²	44	105.5 Å²	105.5	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-35.6	177.5	0	0	0	0	0	113	L614 L615 V620 N622	L614-A618 WeakPolarHBondContact O-CB 3.42Å; L614-A618 PolarHBondContact O-N 2.85Å; L615-A618 PolarHBondContact O-N 3.13Å; A618-V620 VanDerWaalsContact C-N 3.35Å; A618-N622 VanDerWaalsContact O-CB 3.31Å; A618-N622 WeakPolarHBondContact O-CB 3.32Å; A618-N622 VanDerWaalsContact O-CG 3.27Å; A618-N622 PolarHBondContact O-N 2.87Å; A618-N622 PolarHBondContact O-ND2 2.84Å
619	S	59.1	Low	60.4	Low	66 Å²	66	107.8 Å²	107.8	46%	0.462	55%	0.549	S	S	.	.	H	α-helix	trans	-69.2	-31.4	176	61	0	0	0	0	113.4	L615 M616 Q617 F623	L615-S619 WeakPolarHBondContact O-CB 3.4Å; L615-S619 PolarHBondContact O-N 3.29Å; L615-S619 PolarHBondContact O-OG 3.48Å; L615-S619 VanDerWaalsContact O-OG 3.12Å; M616-S619 WeakPolarHBondContact CA-OG 3.33Å; M616-S619 PolarHBondContact O-N 3.19Å; M616-S619 PolarHBondContact O-OG 2.83Å; Q617-S619 VanDerWaalsContact C-N 3.31Å; Q617-S619 PolarHBondContact O-N 2.91Å; S619-F623 PolarHBondContact O-N 2.85Å
620	V	56.5	Low	59	Low	76 Å²	76	112.6 Å²	112.6	46%	0.461	57%	0.574	S	S	.	*	H	α-helix	trans	-73.5	-44.1	174.4	172.7	0	0	0	0	110.1	M616 Q617 A618 N622 F623 Y624	M616-V620 WeakPolarHBondContact O-CG2 3.2Å; M616-V620 PolarHBondContact O-N 2.88Å; M616-V620 VanDerWaalsContact O-N 3.11Å; Q617-V620 PolarHBondContact O-N 2.92Å; Q617-V620 VanDerWaalsContact O-N 3.13Å; A618-V620 VanDerWaalsContact C-N 3.35Å; V620-N622 PolarHBondContact O-N 3.09Å; V620-F623 WeakPolarHBondContact O-CB 3.36Å; V620-F623 PolarHBondContact O-N 2.9Å; V620-F623 VanDerWaalsContact O-N 3.11Å; V620-Y624 HydrophobicContact CG1-CD2 3.95Å; V620-Y624 HydrophobicContact CG1-CE2 3.93Å; V620-Y624 WeakPolarHBondContact O-CD2 2.98Å; V620-Y624 PolarHBondContact O-N 3.23Å; V620-Y624 VanDerWaalsContact O-N 3.13Å
621	D	51.4	Low	57.6	Low	95 Å²	95	112.5 Å²	112.5	51%	0.508	58%	0.581	S	S	.	*	H	α-helix	trans	-65.3	-37.6	179.1	-63.9	-23.3	0	0	0	111.9	Q617 F623 Y624 N625	Q617-D621 VanDerWaalsContact O-CG 3.3Å; Q617-D621 PolarHBondContact O-N 2.87Å; D621-F623 VanDerWaalsContact C-N 3.27Å; D621-F623 PolarHBondContact O-N 2.9Å; D621-Y624 PolarHBondContact O-N 2.85Å; D621-N625 WeakPolarHBondContact O-CB 3.35Å; D621-N625 PolarHBondContact O-N 3.35Å; D621-N625 PolarHBondContact O-ND2 2.82Å
622	N	48.1	Very low	56	Low	105 Å²	105	110.9 Å²	110.9	56%	0.561	58%	0.579	S	S	*	*	H	α-helix	trans	-68.1	-24.1	173.8	-78.1	-19.5	0	0	0	113.7	A618 V620 K626	A618-N622 VanDerWaalsContact O-CB 3.31Å; A618-N622 WeakPolarHBondContact O-CB 3.32Å; A618-N622 VanDerWaalsContact O-CG 3.27Å; A618-N622 PolarHBondContact O-N 2.87Å; A618-N622 PolarHBondContact O-ND2 2.84Å; V620-N622 PolarHBondContact O-N 3.09Å; N622-K626 PolarHBondContact O-N 2.77Å
623	F	43.2	Very low	54.6	Low	143 Å²	143	113 Å²	113	63%	0.627	59%	0.593	S	S	*	*	H	α-helix	trans	-76.3	-43.9	175.1	-137.4	-90.7	0	0	0	110.5	S619 V620 D621 N625 K626 E627	S619-F623 PolarHBondContact O-N 2.85Å; V620-F623 WeakPolarHBondContact O-CB 3.36Å; V620-F623 PolarHBondContact O-N 2.9Å; V620-F623 VanDerWaalsContact O-N 3.11Å; D621-F623 VanDerWaalsContact C-N 3.27Å; D621-F623 PolarHBondContact O-N 2.9Å; F623-N625 VanDerWaalsContact C-N 3.32Å; F623-N625 PolarHBondContact O-N 3.12Å; F623-K626 PolarHBondContact O-N 3.41Å; F623-E627 PolarHBondContact O-N 3.23Å
624	Y	43.7	Very low	53.1	Low	147 Å²	147	114.3 Å²	114.3	58%	0.576	61%	0.608	S	S	*	*	H	α-helix	trans	-66.9	-29.7	175.3	-84.5	-74.5	0	0	0	113.8	V620 D621 K626 N628	V620-Y624 HydrophobicContact CG1-CD2 3.95Å; V620-Y624 HydrophobicContact CG1-CE2 3.93Å; V620-Y624 WeakPolarHBondContact O-CD2 2.98Å; V620-Y624 PolarHBondContact O-N 3.23Å; V620-Y624 VanDerWaalsContact O-N 3.13Å; D621-Y624 PolarHBondContact O-N 2.85Å; Y624-K626 VanDerWaalsContact C-N 3.35Å; Y624-N628 PolarHBondContact O-ND2 2.65Å; Y624-N628 VanDerWaalsContact O-ND2 3.07Å
625	N	44.6	Very low	51.6	Low	110 Å²	110	114.3 Å²	114.3	59%	0.588	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-15.5	175	-74.5	-18.4	0	0	0	113.7	D621 F623	D621-N625 WeakPolarHBondContact O-CB 3.35Å; D621-N625 PolarHBondContact O-N 3.35Å; D621-N625 PolarHBondContact O-ND2 2.82Å; F623-N625 VanDerWaalsContact C-N 3.32Å; F623-N625 PolarHBondContact O-N 3.12Å
626	K	43	Very low	50.1	Low	177 Å²	177	114.9 Å²	114.9	77%	0.77	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-23.8	173.3	-88.3	-173.7	174	-174.6	0	113.7	N622 F623 Y624 N628	N622-K626 PolarHBondContact O-N 2.77Å; F623-K626 PolarHBondContact O-N 3.41Å; Y624-K626 VanDerWaalsContact C-N 3.35Å; K626-N628 VanDerWaalsContact C-N 3.34Å
627	E	40.6	Very low	48.8	Very low	139 Å²	139	113.5 Å²	113.5	65%	0.65	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-10.6	175.3	-75.8	-175.9	160.2	0	0	113.5	F623	F623-E627 PolarHBondContact O-N 3.23Å
628	N	42.3	Very low	47.5	Very low	139 Å²	139	115.4 Å²	115.4	74%	0.743	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	15.2	177.7	-69.7	-52.3	0	0	0	113.7	Y624 K626	Y624-N628 PolarHBondContact O-ND2 2.65Å; Y624-N628 VanDerWaalsContact O-ND2 3.07Å; K626-N628 VanDerWaalsContact C-N 3.34Å
629	A	36.2	Very low	46.2	Very low	144 Å²	144	121.9 Å²	121.9	100%	1.19	65%	0.649	S	S	*	*			trans	-113.1	0	179.4	0	0	0	0	0	111.6

Retrieved 629 of 629 residues in 489 ms (Link to these results)

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