A0A077Z0F5_TRITR Loading...

Regulator of G protein signaling 20

AlphaFold DB , UniProt , Accession A0A077Z0F5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 304 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	S	65.4	Low	66.9	Low	78 Å²	78	62.5 Å²	62.5	55%	0.545	30%	0.299	S	S	.	.				0	176.6	0	61.2	0	0	0	0	109.3	Y3 D4 R5	S1-Y3 PolarHBondContact O-N 3.44Å; S1-Y3 WeakPolarHBondContact OG-CB 3.39Å; S1-Y3 PolarHBondContact OG-N 3.1Å; S1-D4 PolarHBondContact N-OD2 2.68Å; S1-D4 PolarHBondContact O-N 2.98Å; S1-D4 PolarHBondContact OG-N 2.98Å; S1-D4 VanDerWaalsContact OG-N 3.14Å; S1-D4 PolarHBondContact OG-OD2 3.05Å; S1-D4 VanDerWaalsContact OG-OD2 3.14Å; S1-R5 PolarHBondContact O-N 3.13Å
2	L	67.2	Low	65.8	Low	50 Å²	50	69.6 Å²	69.6	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-36.4	171	-177.5	64.6	0	0	0	111.1	D4 R5 C6 E77 Q80 L81	L2-D4 VanDerWaalsContact C-N 3.32Å; L2-D4 PolarHBondContact O-N 3.17Å; L2-R5 WeakPolarHBondContact O-CB 3.23Å; L2-R5 PolarHBondContact O-N 3.22Å; L2-R5 VanDerWaalsContact O-N 3.12Å; L2-C6 PolarHBondContact O-N 2.91Å; L2-C6 PolarHBondContact O-SG 3.44Å; L2-C6 VanDerWaalsContact O-SG 3.37Å; L2-E77 HydrophobicContact CD1-CB 4.23Å; L2-E77 HydrophobicContact CD1-CG 4.47Å; L2-E77 WeakPolarHBondContact CD2-O 3.37Å; L2-Q80 HydrophobicContact CD2-CB 3.53Å; L2-L81 HydrophobicContact CB-CD2 4.1Å; L2-L81 HydrophobicContact CD2-CD2 3.99Å; L2-L81 HydrophobicContact CD2-CG 4.43Å; L2-L81 HydrophobicContact CG-CD2 4.01Å
3	Y	67.3	Low	65	Low	38 Å²	38	66 Å²	66	15%	0.149	31%	0.305	C	S	.	.	H	α-helix	trans	-56.8	-43.4	171.8	175.4	-98	0	0	0	112.6	S1 R5 C6 R7 E86 D89 M90	S1-Y3 PolarHBondContact O-N 3.44Å; S1-Y3 WeakPolarHBondContact OG-CB 3.39Å; S1-Y3 PolarHBondContact OG-N 3.1Å; Y3-R5 VanDerWaalsContact C-N 3.32Å; Y3-R5 PolarHBondContact O-N 2.54Å; Y3-C6 PolarHBondContact O-N 2.99Å; Y3-R7 HydrophobicContact CD1-CG 4.39Å; Y3-R7 HydrophobicContact CE1-CG 4.06Å; Y3-R7 HydrophobicContact CE2-CG 4.41Å; Y3-R7 WeakPolarHBondContact O-CB 3.02Å; Y3-R7 WeakPolarHBondContact O-CG 3.5Å; Y3-R7 PolarHBondContact O-N 2.83Å; Y3-E86 HydrophobicContact CD1-CG 4.44Å; Y3-E86 HydrophobicContact CD2-CB 3.61Å; Y3-E86 HydrophobicContact CD2-CG 3.87Å; Y3-E86 HydrophobicContact CE2-CB 4.2Å; Y3-E86 HydrophobicContact CE2-CG 4.42Å; Y3-E86 HydrophobicContact CG-CB 4.06Å; Y3-E86 HydrophobicContact CG-CG 3.85Å; Y3-D89 HydrophobicContact CE2-CB 3.89Å; Y3-D89 PolarHBondContact OH-OD2 3.49Å; Y3-M90 HydrophobicContact CD2-CE 3.74Å; Y3-M90 HydrophobicContact CE2-CE 3.96Å
4	D	72.9	Confident	64.1	Low	79 Å²	79	67.7 Å²	67.7	42%	0.422	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-39	175.2	-63.2	-41.8	0	0	0	112	S1 L2 R7 E8	S1-D4 PolarHBondContact N-OD2 2.68Å; S1-D4 PolarHBondContact O-N 2.98Å; S1-D4 PolarHBondContact OG-N 2.98Å; S1-D4 VanDerWaalsContact OG-N 3.14Å; S1-D4 PolarHBondContact OG-OD2 3.05Å; S1-D4 VanDerWaalsContact OG-OD2 3.14Å; L2-D4 VanDerWaalsContact C-N 3.32Å; L2-D4 PolarHBondContact O-N 3.17Å; D4-R7 PolarHBondContact O-N 2.96Å; D4-E8 WeakPolarHBondContact O-CB 3.41Å; D4-E8 VanDerWaalsContact O-CG 3.31Å; D4-E8 WeakPolarHBondContact O-CG 3.4Å; D4-E8 PolarHBondContact O-N 3.48Å
5	R	70	Confident	63.2	Low	54 Å²	54	69.3 Å²	69.3	20%	0.204	35%	0.347	C	S	.	.	H	α-helix	trans	-62.9	-46.6	175.4	-74.2	171.7	49.2	158.6	4.2	112.3	S1 L2 Y3 R7 E8 A9 I21 S22 N23 E77	S1-R5 PolarHBondContact O-N 3.13Å; L2-R5 WeakPolarHBondContact O-CB 3.23Å; L2-R5 PolarHBondContact O-N 3.22Å; L2-R5 VanDerWaalsContact O-N 3.12Å; Y3-R5 VanDerWaalsContact C-N 3.32Å; Y3-R5 PolarHBondContact O-N 2.54Å; R5-R7 VanDerWaalsContact C-N 3.29Å; R5-R7 PolarHBondContact O-N 2.75Å; R5-E8 PolarHBondContact O-N 3.35Å; R5-A9 WeakPolarHBondContact O-CB 3.35Å; R5-A9 PolarHBondContact O-N 3.06Å; R5-I21 HydrophobicContact CB-CG2 4.45Å; R5-S22 PolarHBondContact NH1-O 3.35Å; R5-N23 PolarHBondContact NH1-OD1 3.46Å; R5-N23 PolarHBondContact NH2-ND2 2.84Å; R5-N23 PolarHBondContact NH2-OD1 2.94Å; R5-E77 IonicContact CZ-OE1 3.93Å; R5-E77 IonicContact NE-OE1 3Å; R5-E77 IonicContact NH2-OE1 2.86Å; R5-E77 PolarHBondContact NH2-OE1 3.29Å
6	C	65.5	Low	61.8	Low	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-61.3	-41	176.5	-63.1	0	0	0	0	110.9	L2 Y3 A9 F10 L74 E77 M90	L2-C6 PolarHBondContact O-N 2.91Å; L2-C6 PolarHBondContact O-SG 3.44Å; L2-C6 VanDerWaalsContact O-SG 3.37Å; Y3-C6 PolarHBondContact O-N 2.99Å; C6-A9 WeakPolarHBondContact O-CB 3.34Å; C6-A9 PolarHBondContact O-N 3.38Å; C6-F10 WeakPolarHBondContact O-CD2 3.38Å; C6-F10 PolarHBondContact O-N 3.01Å; C6-L74 HydrophobicContact CB-CD1 3.83Å; C6-E77 VanDerWaalsContact SG-CB 3.56Å; C6-E77 PolarHBondContact SG-OE2 3.15Å; C6-M90 HydrophobicContact CB-CE 3.19Å; C6-M90 HydrophobicContact CB-CG 4.39Å; C6-M90 HydrophobicContact CB-SD 3.43Å; C6-M90 WeakPolarHBondContact CB-SD 3.48Å
7	R	70.8	Confident	60.2	Low	116 Å²	116	74.7 Å²	74.7	44%	0.438	38%	0.383	S	S	.	.	H	α-helix	trans	-67	-38.6	175.5	-77.7	-162.7	66.5	-170.8	3.5	113.1	Y3 D4 R5 F10 K11 M90	Y3-R7 HydrophobicContact CD1-CG 4.39Å; Y3-R7 HydrophobicContact CE1-CG 4.06Å; Y3-R7 HydrophobicContact CE2-CG 4.41Å; Y3-R7 WeakPolarHBondContact O-CB 3.02Å; Y3-R7 WeakPolarHBondContact O-CG 3.5Å; Y3-R7 PolarHBondContact O-N 2.83Å; D4-R7 PolarHBondContact O-N 2.96Å; R5-R7 VanDerWaalsContact C-N 3.29Å; R5-R7 PolarHBondContact O-N 2.75Å; R7-F10 WeakPolarHBondContact O-CB 3.47Å; R7-F10 PolarHBondContact O-N 3.5Å; R7-K11 PolarHBondContact O-N 3.37Å; R7-M90 HydrophobicContact CG-CE 4.03Å
8	E	68.3	Low	59.1	Low	106 Å²	106	76 Å²	76	50%	0.495	40%	0.395	S	S	.	.	H	α-helix	trans	-62.7	-48.3	172.8	-79.3	-177.7	162.8	0	0	109.5	D4 R5 F10 K11 W12	D4-E8 WeakPolarHBondContact O-CB 3.41Å; D4-E8 VanDerWaalsContact O-CG 3.31Å; D4-E8 WeakPolarHBondContact O-CG 3.4Å; D4-E8 PolarHBondContact O-N 3.48Å; R5-E8 PolarHBondContact O-N 3.35Å; E8-F10 PolarHBondContact O-N 3.38Å; E8-K11 CarbonylContact O-C 3.43Å; E8-K11 WeakPolarHBondContact O-CA 3.48Å; E8-K11 WeakPolarHBondContact O-CB 3.35Å; E8-K11 PolarHBondContact O-N 3.28Å; E8-W12 PolarHBondContact O-N 2.89Å
9	A	65	Low	58.2	Low	12 Å²	12	79.8 Å²	79.8	10%	0.099	42%	0.415	C	S	.	.	H	α-helix	trans	-51.7	-44	174.2	0	0	0	0	0	111.2	R5 C6 K11 W12 L13 I21	R5-A9 WeakPolarHBondContact O-CB 3.35Å; R5-A9 PolarHBondContact O-N 3.06Å; C6-A9 WeakPolarHBondContact O-CB 3.34Å; C6-A9 PolarHBondContact O-N 3.38Å; A9-K11 PolarHBondContact O-N 2.73Å; A9-W12 PolarHBondContact O-N 3.07Å; A9-L13 WeakPolarHBondContact O-CG 3.31Å; A9-L13 PolarHBondContact O-N 3.2Å; A9-I21 HydrophobicContact CB-CD1 3.64Å; A9-I21 HydrophobicContact CB-CG1 4.06Å
10	F	63.4	Low	57.4	Low	26 Å²	26	78.7 Å²	78.7	11%	0.114	42%	0.423	C	S	.	.	H	α-helix	trans	-60.2	-43.5	172.8	-88.7	-66.6	0	0	0	114.6	C6 R7 E8 L13 L74 M90 E93 I94 R97 F98	C6-F10 WeakPolarHBondContact O-CD2 3.38Å; C6-F10 PolarHBondContact O-N 3.01Å; R7-F10 WeakPolarHBondContact O-CB 3.47Å; R7-F10 PolarHBondContact O-N 3.5Å; E8-F10 PolarHBondContact O-N 3.38Å; F10-L13 PolarHBondContact O-N 3Å; F10-L74 HydrophobicContact CD2-CD2 4.25Å; F10-L74 HydrophobicContact CE1-CD2 3.99Å; F10-L74 HydrophobicContact CE2-CD1 4.15Å; F10-L74 HydrophobicContact CE2-CD2 3.38Å; F10-L74 HydrophobicContact CE2-CG 4.34Å; F10-L74 HydrophobicContact CZ-CD2 3.22Å; F10-M90 HydrophobicContact CD2-SD 4.04Å; F10-M90 HydrophobicContact CE2-SD 3.52Å; F10-M90 VanDerWaalsContact CE2-SD 3.52Å; F10-E93 HydrophobicContact CD2-CB 4.22Å; F10-E93 HydrophobicContact CE1-CB 4.32Å; F10-E93 HydrophobicContact CE2-CB 3.7Å; F10-E93 VanDerWaalsContact CZ-C 3.47Å; F10-E93 HydrophobicContact CZ-CB 3.76Å; F10-I94 HydrophobicContact CE2-CG1 4.27Å; F10-I94 HydrophobicContact CZ-CB 4.47Å; F10-I94 HydrophobicContact CZ-CG1 3.93Å; F10-R97 HydrophobicContact CD1-CB 4.36Å; F10-R97 HydrophobicContact CD1-CG 4.31Å; F10-R97 HydrophobicContact CE1-CB 3.6Å; F10-R97 HydrophobicContact CE1-CG 3.85Å; F10-F98 AromaticContact CE1-CE2 3.99Å; F10-F98 HydrophobicContact CE1-CE2 3.99Å; F10-F98 HydrophobicContact CZ-CE2 4.33Å
11	K	60	Low	56.7	Low	128 Å²	128	77.5 Å²	77.5	56%	0.557	42%	0.416	S	S	*	.	H	α-helix	trans	-65.4	-41.7	176.3	-71.5	178.6	-178.6	176.6	0	111.2	R7 E8 A9 L13 S14	R7-K11 PolarHBondContact O-N 3.37Å; E8-K11 CarbonylContact O-C 3.43Å; E8-K11 WeakPolarHBondContact O-CA 3.48Å; E8-K11 WeakPolarHBondContact O-CB 3.35Å; E8-K11 PolarHBondContact O-N 3.28Å; A9-K11 PolarHBondContact O-N 2.73Å; K11-L13 VanDerWaalsContact C-N 3.29Å; K11-L13 PolarHBondContact O-N 3.31Å; K11-S14 PolarHBondContact O-N 2.94Å; K11-S14 PolarHBondContact O-OG 3.46Å
12	W	53.8	Low	55.7	Low	148 Å²	148	77.5 Å²	77.5	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-60.7	-39	177.7	-73	117.3	0	0	0	112	E8 A9 S14 C15	E8-W12 PolarHBondContact O-N 2.89Å; A9-W12 PolarHBondContact O-N 3.07Å; W12-S14 PolarHBondContact O-N 3.28Å; W12-C15 PolarHBondContact O-N 2.82Å
13	L	55.4	Low	54.6	Low	23 Å²	23	80.2 Å²	80.2	12%	0.12	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.6	175.5	-69	170.1	0	0	0	114.5	A9 F10 K11 F70 R97 F98	A9-L13 WeakPolarHBondContact O-CG 3.31Å; A9-L13 PolarHBondContact O-N 3.2Å; F10-L13 PolarHBondContact O-N 3Å; K11-L13 VanDerWaalsContact C-N 3.29Å; K11-L13 PolarHBondContact O-N 3.31Å; L13-F70 HydrophobicContact CD1-CB 4.19Å; L13-F70 HydrophobicContact CD1-CG 4.39Å; L13-F70 HydrophobicContact CD2-CB 4Å; L13-F70 HydrophobicContact CD2-CD1 3.83Å; L13-F70 HydrophobicContact CD2-CD2 3.03Å; L13-F70 HydrophobicContact CD2-CE1 3.96Å; L13-F70 HydrophobicContact CD2-CE2 3.15Å; L13-F70 HydrophobicContact CD2-CG 3.38Å; L13-F70 HydrophobicContact CD2-CZ 3.64Å; L13-F70 HydrophobicContact CG-CD2 4.4Å; L13-F70 HydrophobicContact CG-CG 4.45Å; L13-R97 PolarHBondContact O-NH2 3.49Å; L13-F98 HydrophobicContact CD1-CZ 4.01Å
14	S	52.3	Low	53.2	Low	90 Å²	90	85.5 Å²	85.5	63%	0.629	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.5	173.7	63.7	0	0	0	0	113.9	K11 W12	K11-S14 PolarHBondContact O-N 2.94Å; K11-S14 PolarHBondContact O-OG 3.46Å; W12-S14 PolarHBondContact O-N 3.28Å
15	C	51.4	Low	51.5	Low	91 Å²	91	87.1 Å²	87.1	62%	0.615	48%	0.475	S	S	*	.	S	Bend	trans	-128.3	13	-167	-66.9	0	0	0	0	115.1	W12 N17	W12-C15 PolarHBondContact O-N 2.82Å; C15-N17 PolarHBondContact O-N 3.06Å
16	T	40.6	Very low	50	Low	89 Å²	89	93.4 Å²	93.4	55%	0.546	51%	0.506	S	S	.	.			trans	-22.8	112.6	-168.4	46.2	0	0	0	0	117.1
17	N	34.9	Very low	48.9	Very low	142 Å²	142	104.2 Å²	104.2	76%	0.759	55%	0.547	S	S	*	.	S	Bend		-172.5	103.6	118.3	-93.7	-7.9	0	0	0	108.2	C15	C15-N17 PolarHBondContact O-N 3.06Å
18	T	40.4	Very low	48.1	Very low	98 Å²	98	101.2 Å²	101.2	60%	0.601	54%	0.542	S	S	*	.			trans	82.1	120.8	148.3	-30.8	0	0	0	0	118.9
19	I	40.6	Very low	47.9	Very low	149 Å²	149	100.7 Å²	100.7	76%	0.764	54%	0.542	S	S	*	.			trans	86.1	100.9	163.2	-48.5	167.3	0	0	0	120
20	G	42.6	Very low	48.4	Very low	56 Å²	56	105.4 Å²	105.4	58%	0.577	56%	0.562	S	S	*	*				105.9	96.5	117.7	0	0	0	0	0	119	S22	G20-S22 PolarHBondContact O-N 3.01Å; G20-S22 VanDerWaalsContact O-N 3.16Å
21	I	43.9	Very low	49.6	Very low	55 Å²	55	104.6 Å²	104.6	28%	0.282	56%	0.559	S	S	.	*			trans	-70.4	107.2	150.5	-54.5	174.5	0	0	0	106.8	R5 A9 N23 E77	R5-I21 HydrophobicContact CB-CG2 4.45Å; A9-I21 HydrophobicContact CB-CD1 3.64Å; A9-I21 HydrophobicContact CB-CG1 4.06Å; I21-N23 PolarHBondContact O-N 2.87Å; I21-E77 WeakPolarHBondContact CG2-OE1 3.4Å
22	S	43.4	Very low	51	Low	77 Å²	77	102.7 Å²	102.7	54%	0.538	56%	0.555	S	S	.	*			trans	-60.5	123.7	-173.5	77.6	0	0	0	0	112.1	R5 G20	R5-S22 PolarHBondContact NH1-O 3.35Å; G20-S22 PolarHBondContact O-N 3.01Å; G20-S22 VanDerWaalsContact O-N 3.16Å
23	N	43.5	Very low	52.9	Low	107 Å²	107	96.6 Å²	96.6	57%	0.572	53%	0.532	S	S	*	.	S	Bend	trans	-140.7	101.3	158.4	-90	-25.6	0	0	0	106.9	R5 I21	R5-N23 PolarHBondContact NH1-OD1 3.46Å; R5-N23 PolarHBondContact NH2-ND2 2.84Å; R5-N23 PolarHBondContact NH2-OD1 2.94Å; I21-N23 PolarHBondContact O-N 2.87Å
24	N	37.7	Very low	54.8	Low	149 Å²	149	101.4 Å²	101.4	80%	0.797	55%	0.554	S	S	*	*			trans	45.3	85.8	171.2	-104	-3.6	0	0	0	116.7	E26	N24-E26 PolarHBondContact O-N 2.85Å
25	T	37.3	Very low	56.8	Low	114 Å²	114	98.9 Å²	98.9	70%	0.699	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	13.9	-160	11	0	0	0	0	118.6
26	E	38.9	Very low	58.9	Low	185 Å²	185	94.6 Å²	94.6	86%	0.864	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-8.5	-177	-73.1	-178.4	173.6	0	0	116.5	N24	N24-E26 PolarHBondContact O-N 2.85Å
27	R	42	Very low	61.6	Low	227 Å²	227	92.2 Å²	92.2	86%	0.857	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-4.4	178.3	-70	-172.1	179.2	-170	-2.7	115.7
28	V	54.3	Low	64.5	Low	54 Å²	54	86.1 Å²	86.1	33%	0.327	45%	0.454	S	S	.	.	S	Bend	trans	-109.3	26.8	-167.2	-159.6	0	0	0	0	112.4	P50 V51	V28-P50 HydrophobicContact CG1-CB 3.81Å; V28-P50 HydrophobicContact CG1-CG 3.92Å; V28-V51 WeakPolarHBondContact O-CG2 3.19Å
29	N	63.6	Low	67.2	Low	94 Å²	94	81.4 Å²	81.4	50%	0.503	43%	0.425	S	S	.	.	S	Bend	trans	-106.2	-11.2	-178.7	-71.2	-24	0	0	0	113.9	R54	N29-R54 PolarHBondContact OD1-NH1 3.31Å; N29-R54 PolarHBondContact OD1-NH2 2.98Å
30	H	76.5	Confident	69.9	Low	111 Å²	111	77.5 Å²	77.5	51%	0.514	40%	0.403	S	S	.	.			trans	-107.4	140.1	179.5	-170.3	-86.9	0	0	0	110.6	E299	H30-E299 IonicContact CD2-OE1 3.09Å; H30-E299 PolarHBondContact CD2-OE1 2.99Å; H30-E299 IonicContact CE1-OE1 3.35Å; H30-E299 IonicContact CG-OE1 2.79Å; H30-E299 IonicContact NE2-OE1 3.76Å; H30-E299 PolarHBondContact NE2-OE1 3.19Å; H30-E299 VanDerWaalsContact NE2-OE1 3.16Å
31	V	89	Confident	72.4	Confident	9 Å²	9	83 Å²	83	6%	0.055	41%	0.414	C	S	.	.			trans	-135.5	137.3	170.1	65.5	0	0	0	0	106.6	E35 A36 W39 V51 F157 N161	V31-E35 HydrophobicContact CG2-CB 3.57Å; V31-E35 HydrophobicContact CG2-CG 3.24Å; V31-A36 HydrophobicContact CG1-CB 4.13Å; V31-W39 HydrophobicContact CB-CH2 4.38Å; V31-W39 HydrophobicContact CB-CZ2 4.42Å; V31-W39 HydrophobicContact CG1-CH2 3.86Å; V31-W39 HydrophobicContact CG1-CZ2 4.33Å; V31-W39 HydrophobicContact CG2-CH2 4.19Å; V31-W39 HydrophobicContact CG2-CZ2 3.8Å; V31-V51 HydrophobicContact CB-CB 4.49Å; V31-V51 HydrophobicContact CB-CG1 4.44Å; V31-V51 HydrophobicContact CG1-CG1 4.01Å; V31-F157 HydrophobicContact CG1-CE1 3.7Å; V31-F157 HydrophobicContact CG1-CZ 3.48Å; V31-F157 VanDerWaalsContact CG1-CZ 3.48Å; V31-N161 PolarHBondContact O-OD1 2.8Å
32	D	89	Confident	74.9	Confident	89 Å²	89	82.5 Å²	82.5	48%	0.476	42%	0.415	S	S	.	.			trans	-72	160.6	174.2	66.1	63.4	0	0	0	111.3	E34 E35 A36	D32-E34 VanDerWaalsContact C-N 3.29Å; D32-E34 PolarHBondContact O-N 2.95Å; D32-E34 WeakPolarHBondContact OD1-CA 3.23Å; D32-E34 WeakPolarHBondContact OD1-CB 3.4Å; D32-E34 PolarHBondContact OD1-N 3.44Å; D32-E35 PolarHBondContact O-N 2.99Å; D32-E35 PolarHBondContact OD1-N 2.76Å; D32-A36 PolarHBondContact O-N 2.64Å
33	Y	94	Very high	77.5	Confident	20 Å²	20	78.9 Å²	78.9	8%	0.078	39%	0.39	C	S	.	.	H	α-helix	trans	-57.4	-36.5	179.7	160.5	-99.1	0	0	0	113.7	A36 K37 L158 N161 L162 H180 E182	Y33-A36 PolarHBondContact O-N 2.72Å; Y33-K37 HydrophobicContact CE1-CD 4.14Å; Y33-K37 HydrophobicContact CE2-CB 4.39Å; Y33-K37 HydrophobicContact CE2-CD 4.2Å; Y33-K37 WeakPolarHBondContact O-CB 3.45Å; Y33-K37 PolarHBondContact O-N 3.34Å; Y33-K37 VanDerWaalsContact OH-CD 3.29Å; Y33-K37 WeakPolarHBondContact OH-CD 3.44Å; Y33-K37 PolarHBondContact OH-NZ 2.99Å; Y33-L158 HydrophobicContact CD2-CD2 4.34Å; Y33-L158 HydrophobicContact CE2-CD2 4.47Å; Y33-N161 VanDerWaalsContact CB-O 3.27Å; Y33-N161 WeakPolarHBondContact CB-O 3.29Å; Y33-L162 HydrophobicContact CD1-CD2 3.88Å; Y33-L162 HydrophobicContact CD2-CD2 3.52Å; Y33-L162 HydrophobicContact CD2-CG 4.01Å; Y33-L162 HydrophobicContact CE1-CD2 4.02Å; Y33-L162 HydrophobicContact CE2-CD2 3.71Å; Y33-L162 HydrophobicContact CE2-CG 4.38Å; Y33-L162 HydrophobicContact CG-CD2 3.6Å; Y33-L162 HydrophobicContact CG-CG 4.36Å; Y33-H180 AromaticContact CE1-NE2 3.77Å; Y33-H180 AromaticContact CZ-CE1 3.48Å; Y33-H180 VanDerWaalsContact CZ-CE1 3.48Å; Y33-H180 AromaticContact CZ-NE2 3.6Å; Y33-H180 PolarHBondContact OH-CE1 3Å; Y33-H180 PolarHBondContact OH-NE2 2.77Å; Y33-H180 VanDerWaalsContact OH-NE2 3.14Å; Y33-E182 HydrophobicContact CE2-CG 4.03Å; Y33-E182 PolarHBondContact OH-OE1 3.46Å; Y33-E182 PolarHBondContact OH-OE2 3.42Å
34	E	94.5	Very high	80	Confident	124 Å²	124	76.8 Å²	76.8	58%	0.579	38%	0.384	S	S	*	.	H	α-helix	trans	-70.4	-41.3	-178.3	-70.6	-62	150	0	0	111.5	D32 K37 S38	D32-E34 VanDerWaalsContact C-N 3.29Å; D32-E34 PolarHBondContact O-N 2.95Å; D32-E34 WeakPolarHBondContact OD1-CA 3.23Å; D32-E34 WeakPolarHBondContact OD1-CB 3.4Å; D32-E34 PolarHBondContact OD1-N 3.44Å; E34-K37 PolarHBondContact O-N 3.05Å; E34-S38 WeakPolarHBondContact O-CB 3.44Å; E34-S38 PolarHBondContact O-N 2.84Å
35	E	94.6	Very high	82.8	Confident	37 Å²	37	75.3 Å²	75.3	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-63.8	-45.7	172.1	172.6	59.5	-160.4	0	0	110.6	V31 D32 K37 S38 W39 R45 N49	V31-E35 HydrophobicContact CG2-CB 3.57Å; V31-E35 HydrophobicContact CG2-CG 3.24Å; D32-E35 PolarHBondContact O-N 2.99Å; D32-E35 PolarHBondContact OD1-N 2.76Å; E35-K37 PolarHBondContact O-N 3.11Å; E35-S38 WeakPolarHBondContact O-CB 3.24Å; E35-S38 PolarHBondContact O-N 3.25Å; E35-S38 PolarHBondContact O-OG 2.94Å; E35-W39 HydrophobicContact CG-CZ2 4.48Å; E35-W39 VanDerWaalsContact O-CD1 3.22Å; E35-W39 PolarHBondContact O-NE1 3.16Å; E35-W39 PolarHBondContact OE1-NE1 3.5Å; E35-R45 IonicContact OE1-NE 3.9Å; E35-R45 IonicContact OE2-CZ 3.59Å; E35-R45 VanDerWaalsContact OE2-CZ 3.26Å; E35-R45 IonicContact OE2-NE 2.75Å; E35-R45 PolarHBondContact OE2-NE 3.23Å; E35-R45 IonicContact OE2-NH2 2.75Å; E35-R45 PolarHBondContact OE2-NH2 2.98Å; E35-N49 PolarHBondContact OE1-ND2 2.86Å; E35-N49 VanDerWaalsContact OE1-ND2 3.12Å
36	A	95.9	Very high	85.6	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.5	-44.7	175.7	0	0	0	0	0	112.1	V31 D32 Y33 S38 W39 F154 F157 L158	V31-A36 HydrophobicContact CG1-CB 4.13Å; D32-A36 PolarHBondContact O-N 2.64Å; Y33-A36 PolarHBondContact O-N 2.72Å; A36-S38 VanDerWaalsContact C-N 3.3Å; A36-S38 PolarHBondContact O-N 3.37Å; A36-W39 HydrophobicContact CB-CZ3 4.39Å; A36-W39 VanDerWaalsContact O-CB 3.23Å; A36-W39 WeakPolarHBondContact O-CB 3.38Å; A36-W39 PolarHBondContact O-N 3.29Å; A36-W39 VanDerWaalsContact O-N 3.15Å; A36-F154 WeakPolarHBondContact O-CZ 3.43Å; A36-F157 HydrophobicContact CB-CD1 4.25Å; A36-F157 HydrophobicContact CB-CE1 3.78Å; A36-L158 HydrophobicContact CB-CD2 3.68Å
37	K	96.1	Very high	88.3	Confident	39 Å²	39	61.1 Å²	61.1	17%	0.17	29%	0.293	C	S	.	.	H	α-helix	trans	-62.7	-38.1	178.4	-174.6	168.8	-167.6	156.4	0	111.9	Y33 E34 E35 W39 Q40 L158 D181 E182	Y33-K37 HydrophobicContact CE1-CD 4.14Å; Y33-K37 HydrophobicContact CE2-CB 4.39Å; Y33-K37 HydrophobicContact CE2-CD 4.2Å; Y33-K37 WeakPolarHBondContact O-CB 3.45Å; Y33-K37 PolarHBondContact O-N 3.34Å; Y33-K37 VanDerWaalsContact OH-CD 3.29Å; Y33-K37 WeakPolarHBondContact OH-CD 3.44Å; Y33-K37 PolarHBondContact OH-NZ 2.99Å; E34-K37 PolarHBondContact O-N 3.05Å; E35-K37 PolarHBondContact O-N 3.11Å; K37-W39 PolarHBondContact O-N 3.16Å; K37-W39 VanDerWaalsContact O-N 3.08Å; K37-Q40 WeakPolarHBondContact O-CB 3.27Å; K37-Q40 PolarHBondContact O-N 3.37Å; K37-L158 HydrophobicContact CB-CD2 4.23Å; K37-D181 IonicContact NZ-OD2 3.71Å; K37-D181 PolarHBondContact NZ-OD2 3.4Å; K37-E182 IonicContact NZ-OE1 2.75Å; K37-E182 IonicContact NZ-OE2 3.29Å; K37-E182 PolarHBondContact NZ-OE2 3.3Å
38	S	96.5	Very high	90.7	Very high	14 Å²	14	54.2 Å²	54.2	10%	0.098	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-23.1	178.1	81.7	0	0	0	0	113.2	E34 E35 A36 Q40 Q41 R45	E34-S38 WeakPolarHBondContact O-CB 3.44Å; E34-S38 PolarHBondContact O-N 2.84Å; E35-S38 WeakPolarHBondContact O-CB 3.24Å; E35-S38 PolarHBondContact O-N 3.25Å; E35-S38 PolarHBondContact O-OG 2.94Å; A36-S38 VanDerWaalsContact C-N 3.3Å; A36-S38 PolarHBondContact O-N 3.37Å; S38-Q40 PolarHBondContact O-N 3.32Å; S38-Q41 PolarHBondContact O-N 2.97Å; S38-Q41 VanDerWaalsContact O-N 3.13Å; S38-R45 WeakPolarHBondContact OG-CD 3.47Å; S38-R45 VanDerWaalsContact OG-CZ 3.27Å; S38-R45 PolarHBondContact OG-NE 3.45Å
39	W	97.4	Very high	92.6	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.1	176.1	-60.6	-10.3	0	0	0	113.3	V31 E35 A36 K37 Q41 S42 M46 N49 V51 Y145 F154 F157	V31-W39 HydrophobicContact CB-CH2 4.38Å; V31-W39 HydrophobicContact CB-CZ2 4.42Å; V31-W39 HydrophobicContact CG1-CH2 3.86Å; V31-W39 HydrophobicContact CG1-CZ2 4.33Å; V31-W39 HydrophobicContact CG2-CH2 4.19Å; V31-W39 HydrophobicContact CG2-CZ2 3.8Å; E35-W39 HydrophobicContact CG-CZ2 4.48Å; E35-W39 VanDerWaalsContact O-CD1 3.22Å; E35-W39 PolarHBondContact O-NE1 3.16Å; E35-W39 PolarHBondContact OE1-NE1 3.5Å; A36-W39 HydrophobicContact CB-CZ3 4.39Å; A36-W39 VanDerWaalsContact O-CB 3.23Å; A36-W39 WeakPolarHBondContact O-CB 3.38Å; A36-W39 PolarHBondContact O-N 3.29Å; A36-W39 VanDerWaalsContact O-N 3.15Å; K37-W39 PolarHBondContact O-N 3.16Å; K37-W39 VanDerWaalsContact O-N 3.08Å; W39-Q41 PolarHBondContact O-N 3.48Å; W39-S42 PolarHBondContact O-N 2.78Å; W39-M46 HydrophobicContact CB-CB 3.78Å; W39-M46 HydrophobicContact CB-CG 3.95Å; W39-M46 HydrophobicContact CB-SD 4.45Å; W39-M46 HydrophobicContact CD2-CB 4.24Å; W39-M46 HydrophobicContact CD2-CG 3.89Å; W39-M46 HydrophobicContact CE3-CG 3.93Å; W39-M46 HydrophobicContact CG-CB 3.76Å; W39-M46 HydrophobicContact CG-CG 3.89Å; W39-N49 HydrophobicContact CZ2-CB 3.9Å; W39-N49 VanDerWaalsContact CZ2-CG 3.45Å; W39-V51 HydrophobicContact CH2-CB 4.12Å; W39-V51 HydrophobicContact CH2-CG1 4.09Å; W39-Y145 WeakPolarHBondContact O-CE2 3.48Å; W39-Y145 PolarHBondContact O-OH 3.49Å; W39-F154 HydrophobicContact CB-CZ 4.39Å; W39-F154 AromaticContact CE3-CE2 3.88Å; W39-F154 HydrophobicContact CE3-CE2 3.88Å; W39-F154 HydrophobicContact CZ3-CE2 4.5Å; W39-F157 AromaticContact CH2-CE1 3.9Å; W39-F157 HydrophobicContact CH2-CE1 3.9Å; W39-F157 HydrophobicContact CH2-CZ 4.15Å; W39-F157 HydrophobicContact CZ3-CD1 4.25Å; W39-F157 AromaticContact CZ3-CE1 3.54Å; W39-F157 HydrophobicContact CZ3-CE1 3.54Å; W39-F157 HydrophobicContact CZ3-CZ 4.11Å
40	Q	96.7	Very high	93.9	Very high	66 Å²	66	51.1 Å²	51.1	31%	0.308	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-24.1	173.3	-66.6	179.6	-33.7	0	0	112.8	K37 S38 Y145 I149 F154	K37-Q40 WeakPolarHBondContact O-CB 3.27Å; K37-Q40 PolarHBondContact O-N 3.37Å; S38-Q40 PolarHBondContact O-N 3.32Å; Q40-Y145 PolarHBondContact O-OH 3.29Å; Q40-I149 HydrophobicContact CG-CB 4.43Å; Q40-F154 HydrophobicContact CG-CD1 4.46Å; Q40-F154 HydrophobicContact CG-CE1 3.42Å; Q40-F154 VanDerWaalsContact CG-CE1 3.42Å; Q40-F154 HydrophobicContact CG-CZ 3.98Å
41	Q	95	Very high	94.6	Very high	171 Å²	171	46.2 Å²	46.2	80%	0.799	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-16.9	-174	-57.9	177.8	6.5	0	0	112.7	S38 W39	S38-Q41 PolarHBondContact O-N 2.97Å; S38-Q41 VanDerWaalsContact O-N 3.13Å; W39-Q41 PolarHBondContact O-N 3.48Å
42	S	97	Very high	94.9	Very high	45 Å²	45	45.8 Å²	45.8	32%	0.315	24%	0.239	S	C	.	.			trans	-153.8	110.5	-172.7	179.2	0	0	0	0	112	W39 S44 R45 M46 Y145	W39-S42 PolarHBondContact O-N 2.78Å; S42-S44 PolarHBondContact O-N 2.95Å; S42-R45 PolarHBondContact O-N 3.22Å; S42-R45 VanDerWaalsContact O-N 3.1Å; S42-R45 PolarHBondContact OG-N 3.12Å; S42-M46 PolarHBondContact O-N 2.9Å; S42-Y145 PolarHBondContact N-OH 3.23Å
43	F	97.9	Very high	95.2	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-57.9	-39.4	172.1	-177.8	-130	0	0	0	111.8	R45 M46 L47 F56 Y137 M140 E141 Y145	F43-R45 VanDerWaalsContact C-N 3.3Å; F43-R45 PolarHBondContact O-N 3.24Å; F43-M46 HydrophobicContact CD2-CE 3.56Å; F43-M46 HydrophobicContact CE2-CE 3.54Å; F43-M46 PolarHBondContact O-N 3.45Å; F43-L47 HydrophobicContact CE1-CD2 4.12Å; F43-L47 HydrophobicContact CZ-CD1 4.31Å; F43-L47 HydrophobicContact CZ-CD2 4.06Å; F43-L47 VanDerWaalsContact O-CB 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.35Å; F43-L47 PolarHBondContact O-N 2.93Å; F43-F56 AromaticContact CE2-CD1 3.84Å; F43-F56 HydrophobicContact CE2-CD1 3.84Å; F43-F56 AromaticContact CE2-CE1 3.43Å; F43-F56 HydrophobicContact CE2-CE1 3.43Å; F43-F56 VanDerWaalsContact CE2-CE1 3.43Å; F43-F56 AromaticContact CE2-CZ 3.85Å; F43-F56 HydrophobicContact CE2-CZ 3.85Å; F43-F56 HydrophobicContact CZ-CD1 4.34Å; F43-F56 AromaticContact CZ-CE1 3.68Å; F43-F56 HydrophobicContact CZ-CE1 3.68Å; F43-F56 HydrophobicContact CZ-CZ 4.25Å; F43-Y137 HydrophobicContact CD1-CD1 4.4Å; F43-Y137 HydrophobicContact CD1-CD2 4.07Å; F43-Y137 AromaticContact CD1-CE1 3.88Å; F43-Y137 HydrophobicContact CD1-CE1 3.88Å; F43-Y137 AromaticContact CD1-CE2 3.54Å; F43-Y137 HydrophobicContact CD1-CE2 3.54Å; F43-Y137 HydrophobicContact CD1-CG 4.46Å; F43-Y137 AromaticContact CD1-CZ 3.41Å; F43-Y137 VanDerWaalsContact CD1-CZ 3.41Å; F43-Y137 HydrophobicContact CE1-CD1 4.48Å; F43-Y137 AromaticContact CE1-CD2 3.76Å; F43-Y137 HydrophobicContact CE1-CD2 3.76Å; F43-Y137 HydrophobicContact CE1-CE1 4.38Å; F43-Y137 AromaticContact CE1-CE2 3.69Å; F43-Y137 HydrophobicContact CE1-CE2 3.69Å; F43-Y137 HydrophobicContact CE1-CG 4.16Å; F43-Y137 AromaticContact CE1-CZ 3.99Å; F43-M140 HydrophobicContact CE1-CB 3.94Å; F43-M140 HydrophobicContact CE1-CE 4.39Å; F43-M140 HydrophobicContact CZ-CB 3.63Å; F43-M140 HydrophobicContact CZ-CE 4.06Å; F43-M140 HydrophobicContact CZ-SD 4.42Å; F43-E141 HydrophobicContact CB-CB 4.4Å; F43-E141 HydrophobicContact CB-CG 3.85Å; F43-E141 HydrophobicContact CD1-CB 3.49Å; F43-E141 VanDerWaalsContact CD1-CB 3.49Å; F43-E141 HydrophobicContact CD1-CG 3.86Å; F43-E141 HydrophobicContact CE1-CB 4.04Å; F43-E141 HydrophobicContact CG-CB 4.11Å; F43-E141 HydrophobicContact CG-CG 4.13Å; F43-Y145 HydrophobicContact CB-CD1 3.89Å; F43-Y145 HydrophobicContact CB-CD2 4.12Å; F43-Y145 HydrophobicContact CB-CE1 3.91Å; F43-Y145 HydrophobicContact CB-CE2 4.09Å; F43-Y145 HydrophobicContact CB-CG 3.99Å; F43-Y145 HydrophobicContact CD2-CD1 4.28Å; F43-Y145 AromaticContact CD2-CD2 3.42Å; F43-Y145 HydrophobicContact CD2-CD2 3.42Å; F43-Y145 VanDerWaalsContact CD2-CD2 3.42Å; F43-Y145 HydrophobicContact CD2-CE2 4.05Å; F43-Y145 AromaticContact CD2-CG 3.52Å; F43-Y145 HydrophobicContact CD2-CG 3.52Å; F43-Y145 HydrophobicContact CE2-CD2 4.24Å; F43-Y145 HydrophobicContact CE2-CG 4.3Å; F43-Y145 HydrophobicContact CG-CD1 4.29Å; F43-Y145 HydrophobicContact CG-CD2 4.15Å; F43-Y145 AromaticContact CG-CG 3.97Å; F43-Y145 HydrophobicContact CG-CG 3.97Å; F43-Y145 PolarHBondContact N-OH 3.36Å
44	S	97.1	Very high	95.2	Very high	64 Å²	64	47.2 Å²	47.2	45%	0.448	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-38.3	176.5	179.8	0	0	0	0	112.6	S42 L47 S48 Y137	S42-S44 PolarHBondContact O-N 2.95Å; S44-L47 PolarHBondContact O-N 3.43Å; S44-S48 WeakPolarHBondContact O-CB 3.5Å; S44-S48 PolarHBondContact O-N 3.47Å; S44-S48 PolarHBondContact O-OG 2.88Å; S44-Y137 WeakPolarHBondContact CB-OH 3.47Å; S44-Y137 PolarHBondContact N-OH 3.36Å
45	R	95.7	Very high	95.2	Very high	117 Å²	117	43.1 Å²	43.1	44%	0.442	22%	0.219	S	C	.	.	H	α-helix	trans	-67.6	-45.8	177.6	-168.9	168.1	-176.4	161.1	-5.9	111.2	E35 S38 S42 F43 L47 S48 N49	E35-R45 IonicContact OE1-NE 3.9Å; E35-R45 IonicContact OE2-CZ 3.59Å; E35-R45 VanDerWaalsContact OE2-CZ 3.26Å; E35-R45 IonicContact OE2-NE 2.75Å; E35-R45 PolarHBondContact OE2-NE 3.23Å; E35-R45 IonicContact OE2-NH2 2.75Å; E35-R45 PolarHBondContact OE2-NH2 2.98Å; S38-R45 WeakPolarHBondContact OG-CD 3.47Å; S38-R45 VanDerWaalsContact OG-CZ 3.27Å; S38-R45 PolarHBondContact OG-NE 3.45Å; S42-R45 PolarHBondContact O-N 3.22Å; S42-R45 VanDerWaalsContact O-N 3.1Å; S42-R45 PolarHBondContact OG-N 3.12Å; F43-R45 VanDerWaalsContact C-N 3.3Å; F43-R45 PolarHBondContact O-N 3.24Å; R45-L47 VanDerWaalsContact C-N 3.33Å; R45-L47 PolarHBondContact O-N 3.43Å; R45-S48 PolarHBondContact O-N 3.48Å; R45-S48 PolarHBondContact O-OG 3.02Å; R45-N49 PolarHBondContact O-N 2.98Å; R45-N49 VanDerWaalsContact O-N 3.15Å
46	M	96.5	Very high	95.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-44.7	175.5	-168	-178.2	73.2	0	0	112.1	W39 S42 F43 N49 G52 R53 F56 Y145 F148	W39-M46 HydrophobicContact CB-CB 3.78Å; W39-M46 HydrophobicContact CB-CG 3.95Å; W39-M46 HydrophobicContact CB-SD 4.45Å; W39-M46 HydrophobicContact CD2-CB 4.24Å; W39-M46 HydrophobicContact CD2-CG 3.89Å; W39-M46 HydrophobicContact CE3-CG 3.93Å; W39-M46 HydrophobicContact CG-CB 3.76Å; W39-M46 HydrophobicContact CG-CG 3.89Å; S42-M46 PolarHBondContact O-N 2.9Å; F43-M46 HydrophobicContact CD2-CE 3.56Å; F43-M46 HydrophobicContact CE2-CE 3.54Å; F43-M46 PolarHBondContact O-N 3.45Å; M46-N49 PolarHBondContact O-N 3.29Å; M46-N49 VanDerWaalsContact O-O 3.08Å; M46-G52 CarbonylContact O-C 3.08Å; M46-R53 PolarHBondContact O-N 3.27Å; M46-R53 VanDerWaalsContact O-N 3.15Å; M46-F56 HydrophobicContact CE-CB 3.5Å; M46-F56 VanDerWaalsContact CE-CB 3.5Å; M46-F56 HydrophobicContact CE-CD1 3.71Å; M46-F56 HydrophobicContact CE-CD2 3.6Å; M46-F56 HydrophobicContact CE-CE1 4.34Å; M46-F56 HydrophobicContact CE-CE2 4.24Å; M46-F56 HydrophobicContact CE-CG 3.31Å; M46-F56 HydrophobicContact SD-CB 4.21Å; M46-F56 HydrophobicContact SD-CG 4.49Å; M46-Y145 HydrophobicContact CE-CD2 3.65Å; M46-Y145 HydrophobicContact CE-CE2 4.15Å; M46-Y145 HydrophobicContact SD-CD2 4.04Å; M46-Y145 HydrophobicContact SD-CE2 4.06Å; M46-F148 HydrophobicContact CE-CD1 4.18Å; M46-F148 HydrophobicContact CE-CE1 4.39Å; M46-F148 HydrophobicContact SD-CD1 3.59Å; M46-F148 VanDerWaalsContact SD-CD1 3.59Å; M46-F148 HydrophobicContact SD-CE1 3.41Å; M46-F148 WeakPolarHBondContact SD-CE1 3.46Å
47	L	95.1	Very high	95.2	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-73.9	-30.8	-175	-162.5	66.3	0	0	0	112.6	F43 S44 R45 R53 I69 W72 Y137	F43-L47 HydrophobicContact CE1-CD2 4.12Å; F43-L47 HydrophobicContact CZ-CD1 4.31Å; F43-L47 HydrophobicContact CZ-CD2 4.06Å; F43-L47 VanDerWaalsContact O-CB 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.35Å; F43-L47 PolarHBondContact O-N 2.93Å; S44-L47 PolarHBondContact O-N 3.43Å; R45-L47 VanDerWaalsContact C-N 3.33Å; R45-L47 PolarHBondContact O-N 3.43Å; L47-R53 HydrophobicContact CD1-CG 3.99Å; L47-R53 WeakPolarHBondContact O-CD 3.46Å; L47-R53 PolarHBondContact O-NH1 3.48Å; L47-I69 HydrophobicContact CD1-CD1 4.29Å; L47-I69 HydrophobicContact CD1-CG1 4.38Å; L47-W72 HydrophobicContact CD1-CD2 4.5Å; L47-W72 HydrophobicContact CD1-CE3 4.08Å; L47-W72 HydrophobicContact CD1-CZ3 4.13Å; L47-W72 HydrophobicContact CD2-CD2 3.63Å; L47-W72 HydrophobicContact CD2-CE3 3.91Å; L47-W72 HydrophobicContact CD2-CG 4.3Å; L47-W72 HydrophobicContact CD2-CH2 3.75Å; L47-W72 HydrophobicContact CD2-CZ2 3.42Å; L47-W72 VanDerWaalsContact CD2-CZ2 3.42Å; L47-W72 HydrophobicContact CD2-CZ3 3.98Å; L47-W72 HydrophobicContact CG-CD2 4.21Å; L47-W72 HydrophobicContact CG-CE3 3.96Å; L47-W72 HydrophobicContact CG-CH2 3.66Å; L47-W72 HydrophobicContact CG-CZ2 3.9Å; L47-W72 HydrophobicContact CG-CZ3 3.69Å; L47-Y137 HydrophobicContact CD2-CD2 3.78Å; L47-Y137 HydrophobicContact CD2-CE2 3.82Å
48	S	92.6	Very high	95.1	Very high	82 Å²	82	45.8 Å²	45.8	57%	0.573	23%	0.23	S	C	*	.	H	α-helix	trans	-74.8	-29	174.7	60.6	0	0	0	0	112.6	S44 R45	S44-S48 WeakPolarHBondContact O-CB 3.5Å; S44-S48 PolarHBondContact O-N 3.47Å; S44-S48 PolarHBondContact O-OG 2.88Å; R45-S48 PolarHBondContact O-N 3.48Å; R45-S48 PolarHBondContact O-OG 3.02Å
49	N	92.9	Very high	95	Very high	27 Å²	27	46 Å²	46	14%	0.144	23%	0.229	C	C	.	.	S	Bend	trans	-75.6	123.8	174	-169	-58	0	0	0	111.4	E35 W39 R45 M46 V51 G52 R53	E35-N49 PolarHBondContact OE1-ND2 2.86Å; E35-N49 VanDerWaalsContact OE1-ND2 3.12Å; W39-N49 HydrophobicContact CZ2-CB 3.9Å; W39-N49 VanDerWaalsContact CZ2-CG 3.45Å; R45-N49 PolarHBondContact O-N 2.98Å; R45-N49 VanDerWaalsContact O-N 3.15Å; M46-N49 PolarHBondContact O-N 3.29Å; M46-N49 VanDerWaalsContact O-O 3.08Å; N49-V51 VanDerWaalsContact C-N 3.29Å; N49-V51 PolarHBondContact O-N 3.16Å; N49-V51 WeakPolarHBondContact OD1-CB 3.28Å; N49-V51 PolarHBondContact OD1-N 3.43Å; N49-G52 PolarHBondContact O-N 2.88Å; N49-G52 PolarHBondContact OD1-N 3.37Å; N49-R53 WeakPolarHBondContact O-CB 3.42Å; N49-R53 PolarHBondContact O-N 2.92Å
50	P	91.5	Very high	94.9	Very high	55 Å²	55	46 Å²	46	36%	0.357	23%	0.229	S	C	.	.	H	α-helix	trans	-60.9	-32.2	-179.8	-24.2	34.3	0	0	0	114.8	V28 R54	V28-P50 HydrophobicContact CG1-CB 3.81Å; V28-P50 HydrophobicContact CG1-CG 3.92Å; P50-R54 WeakPolarHBondContact O-CB 3.38Å; P50-R54 PolarHBondContact O-N 3.41Å; P50-R54 VanDerWaalsContact O-N 3.16Å
51	V	92.5	Very high	94.7	Very high	8 Å²	8	46 Å²	46	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-72.8	-47.8	176.7	-177.4	0	0	0	0	109.7	V28 V31 W39 N49 R53 R54 Q55 F157	V28-V51 WeakPolarHBondContact O-CG2 3.19Å; V31-V51 HydrophobicContact CB-CB 4.49Å; V31-V51 HydrophobicContact CB-CG1 4.44Å; V31-V51 HydrophobicContact CG1-CG1 4.01Å; W39-V51 HydrophobicContact CH2-CB 4.12Å; W39-V51 HydrophobicContact CH2-CG1 4.09Å; N49-V51 VanDerWaalsContact C-N 3.29Å; N49-V51 PolarHBondContact O-N 3.16Å; N49-V51 WeakPolarHBondContact OD1-CB 3.28Å; N49-V51 PolarHBondContact OD1-N 3.43Å; V51-R53 VanDerWaalsContact C-N 3.34Å; V51-R53 PolarHBondContact O-N 3.32Å; V51-R54 WeakPolarHBondContact O-CB 3.49Å; V51-R54 PolarHBondContact O-N 3.07Å; V51-Q55 PolarHBondContact O-N 2.88Å; V51-F157 HydrophobicContact CG1-CE2 4.18Å; V51-F157 HydrophobicContact CG1-CZ 3.71Å
52	G	95.1	Very high	94.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-43.1	177.9	0	0	0	0	0	112.7	M46 N49 R54 Q55 F56	M46-G52 CarbonylContact O-C 3.08Å; N49-G52 PolarHBondContact O-N 2.88Å; N49-G52 PolarHBondContact OD1-N 3.37Å; G52-R54 VanDerWaalsContact C-N 3.31Å; G52-R54 PolarHBondContact O-N 2.59Å; G52-Q55 PolarHBondContact O-N 3.36Å; G52-F56 WeakPolarHBondContact O-CB 3.39Å; G52-F56 PolarHBondContact O-N 2.97Å
53	R	94.8	Very high	94.4	Very high	50 Å²	50	42 Å²	42	19%	0.189	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-36.7	173.8	-171	165.5	67.5	-107.5	-3.2	112.7	M46 L47 N49 V51 R57 I69 E73	M46-R53 PolarHBondContact O-N 3.27Å; M46-R53 VanDerWaalsContact O-N 3.15Å; L47-R53 HydrophobicContact CD1-CG 3.99Å; L47-R53 WeakPolarHBondContact O-CD 3.46Å; L47-R53 PolarHBondContact O-NH1 3.48Å; N49-R53 WeakPolarHBondContact O-CB 3.42Å; N49-R53 PolarHBondContact O-N 2.92Å; V51-R53 VanDerWaalsContact C-N 3.34Å; V51-R53 PolarHBondContact O-N 3.32Å; R53-R57 WeakPolarHBondContact O-CB 3.29Å; R53-R57 PolarHBondContact O-N 3.47Å; R53-I69 HydrophobicContact CG-CD1 3.97Å; R53-E73 WeakPolarHBondContact CD-OE1 3.43Å; R53-E73 WeakPolarHBondContact CG-OE1 3.42Å; R53-E73 IonicContact CZ-OE1 3.74Å; R53-E73 IonicContact NE-OE1 2.62Å; R53-E73 PolarHBondContact NE-OE1 2.95Å
54	R	93.5	Very high	94	Very high	90 Å²	90	49.5 Å²	49.5	34%	0.34	25%	0.248	S	C	.	.	H	α-helix	trans	-66.5	-48.4	175.5	-171.6	-170.1	-52.1	174.1	6.9	111.8	N29 P50 V51 G52 F56 R57 E58	N29-R54 PolarHBondContact OD1-NH1 3.31Å; N29-R54 PolarHBondContact OD1-NH2 2.98Å; P50-R54 WeakPolarHBondContact O-CB 3.38Å; P50-R54 PolarHBondContact O-N 3.41Å; P50-R54 VanDerWaalsContact O-N 3.16Å; V51-R54 WeakPolarHBondContact O-CB 3.49Å; V51-R54 PolarHBondContact O-N 3.07Å; G52-R54 VanDerWaalsContact C-N 3.31Å; G52-R54 PolarHBondContact O-N 2.59Å; R54-F56 VanDerWaalsContact C-N 3.3Å; R54-F56 PolarHBondContact O-N 3Å; R54-R57 WeakPolarHBondContact O-CB 3.39Å; R54-R57 PolarHBondContact O-N 3.46Å; R54-R57 VanDerWaalsContact O-N 3.15Å; R54-E58 WeakPolarHBondContact CG-OE1 3.47Å; R54-E58 WeakPolarHBondContact O-CG 3.42Å; R54-E58 PolarHBondContact O-N 3.14Å
55	Q	94.3	Very high	93.8	Very high	37 Å²	37	47.2 Å²	47.2	17%	0.173	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-41.7	177.9	-68.9	-61	-68.3	0	0	111.8	V51 G52 E58 Y59 F148 F157	V51-Q55 PolarHBondContact O-N 2.88Å; G52-Q55 PolarHBondContact O-N 3.36Å; Q55-E58 PolarHBondContact NE2-OE2 3.25Å; Q55-E58 PolarHBondContact O-N 2.84Å; Q55-Y59 PolarHBondContact O-N 3.4Å; Q55-Y59 VanDerWaalsContact O-N 3.09Å; Q55-F148 HydrophobicContact CB-CZ 3.89Å; Q55-F157 VanDerWaalsContact CD-CD2 3.46Å; Q55-F157 HydrophobicContact CG-CD2 3.7Å; Q55-F157 HydrophobicContact CG-CE2 3.56Å; Q55-F157 HydrophobicContact CG-CG 4.26Å; Q55-F157 HydrophobicContact CG-CZ 4Å
56	F	96.5	Very high	93.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.9	-34.5	176	-172.4	-124.5	0	0	0	113	F43 M46 G52 R54 Y59 L60 I69 M140 F148	F43-F56 AromaticContact CE2-CD1 3.84Å; F43-F56 HydrophobicContact CE2-CD1 3.84Å; F43-F56 AromaticContact CE2-CE1 3.43Å; F43-F56 HydrophobicContact CE2-CE1 3.43Å; F43-F56 VanDerWaalsContact CE2-CE1 3.43Å; F43-F56 AromaticContact CE2-CZ 3.85Å; F43-F56 HydrophobicContact CE2-CZ 3.85Å; F43-F56 HydrophobicContact CZ-CD1 4.34Å; F43-F56 AromaticContact CZ-CE1 3.68Å; F43-F56 HydrophobicContact CZ-CE1 3.68Å; F43-F56 HydrophobicContact CZ-CZ 4.25Å; M46-F56 HydrophobicContact CE-CB 3.5Å; M46-F56 VanDerWaalsContact CE-CB 3.5Å; M46-F56 HydrophobicContact CE-CD1 3.71Å; M46-F56 HydrophobicContact CE-CD2 3.6Å; M46-F56 HydrophobicContact CE-CE1 4.34Å; M46-F56 HydrophobicContact CE-CE2 4.24Å; M46-F56 HydrophobicContact CE-CG 3.31Å; M46-F56 HydrophobicContact SD-CB 4.21Å; M46-F56 HydrophobicContact SD-CG 4.49Å; G52-F56 WeakPolarHBondContact O-CB 3.39Å; G52-F56 PolarHBondContact O-N 2.97Å; R54-F56 VanDerWaalsContact C-N 3.3Å; R54-F56 PolarHBondContact O-N 3Å; F56-Y59 HydrophobicContact CD2-CD1 4.47Å; F56-Y59 HydrophobicContact CE2-CD1 4.39Å; F56-Y59 PolarHBondContact O-N 2.78Å; F56-L60 HydrophobicContact CD1-CD1 3.95Å; F56-L60 HydrophobicContact CE1-CD1 3.55Å; F56-L60 HydrophobicContact CE1-CG 4.19Å; F56-L60 HydrophobicContact CE2-CD1 4.47Å; F56-L60 HydrophobicContact CE2-CD2 4.38Å; F56-L60 HydrophobicContact CE2-CG 4.23Å; F56-L60 HydrophobicContact CZ-CD1 3.85Å; F56-L60 HydrophobicContact CZ-CD2 4.11Å; F56-L60 HydrophobicContact CZ-CG 4.04Å; F56-L60 WeakPolarHBondContact O-CG 3.24Å; F56-L60 PolarHBondContact O-N 3.22Å; F56-I69 HydrophobicContact CB-CD1 4.44Å; F56-I69 HydrophobicContact CD1-CD1 3.66Å; F56-I69 HydrophobicContact CE1-CD1 4.42Å; F56-I69 HydrophobicContact CG-CD1 4.44Å; F56-M140 HydrophobicContact CE1-CB 4.2Å; F56-M140 HydrophobicContact CE1-CG 4.45Å; F56-M140 HydrophobicContact CE1-SD 3.93Å; F56-M140 HydrophobicContact CZ-CB 4.21Å; F56-F148 HydrophobicContact CB-CD1 4.49Å; F56-F148 HydrophobicContact CB-CE1 4.35Å; F56-F148 HydrophobicContact CD2-CB 3.89Å; F56-F148 AromaticContact CD2-CD1 3.69Å; F56-F148 HydrophobicContact CD2-CD1 3.69Å; F56-F148 HydrophobicContact CD2-CD2 4.48Å; F56-F148 HydrophobicContact CD2-CE1 4.35Å; F56-F148 AromaticContact CD2-CG 3.75Å; F56-F148 HydrophobicContact CD2-CG 3.75Å; F56-F148 HydrophobicContact CE2-CB 3.94Å; F56-F148 HydrophobicContact CE2-CD1 4.45Å; F56-F148 HydrophobicContact CE2-CG 4.32Å
57	R	94.9	Very high	93.5	Very high	44 Å²	44	45.5 Å²	45.5	17%	0.166	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-51.2	172.3	-171.4	-169.6	-62.7	106.3	-3.3	111.5	R53 R54 Y59 L60 E61 I69 F70 E73	R53-R57 WeakPolarHBondContact O-CB 3.29Å; R53-R57 PolarHBondContact O-N 3.47Å; R54-R57 WeakPolarHBondContact O-CB 3.39Å; R54-R57 PolarHBondContact O-N 3.46Å; R54-R57 VanDerWaalsContact O-N 3.15Å; R57-Y59 PolarHBondContact O-N 3.1Å; R57-L60 PolarHBondContact O-N 3.49Å; R57-E61 HydrophobicContact CG-CG 4.46Å; R57-E61 WeakPolarHBondContact O-CG 3.34Å; R57-E61 PolarHBondContact O-N 2.9Å; R57-I69 HydrophobicContact CB-CD1 3.99Å; R57-I69 HydrophobicContact CB-CG2 4.29Å; R57-I69 HydrophobicContact CG-CG2 3.95Å; R57-F70 VanDerWaalsContact CD-CE1 3.47Å; R57-F70 HydrophobicContact CG-CE1 4.1Å; R57-F70 HydrophobicContact CG-CZ 4.15Å; R57-E73 IonicContact CZ-OE1 2.91Å; R57-E73 IonicContact CZ-OE2 2.7Å; R57-E73 IonicContact NE-OE2 3.59Å; R57-E73 PolarHBondContact NE-OE2 3.22Å; R57-E73 IonicContact NH2-OE1 3.38Å; R57-E73 PolarHBondContact NH2-OE1 3.03Å; R57-E73 IonicContact NH2-OE2 4Å; R57-E73 PolarHBondContact NH2-OE2 3.44Å
58	E	93.4	Very high	93.5	Very high	89 Å²	89	45.8 Å²	45.8	42%	0.416	23%	0.231	S	C	.	.	H	α-helix	trans	-57.3	-37.9	179.4	-71.3	165.8	-169.8	0	0	111.1	R54 Q55 S62	R54-E58 WeakPolarHBondContact CG-OE1 3.47Å; R54-E58 WeakPolarHBondContact O-CG 3.42Å; R54-E58 PolarHBondContact O-N 3.14Å; Q55-E58 PolarHBondContact NE2-OE2 3.25Å; Q55-E58 PolarHBondContact O-N 2.84Å; E58-S62 PolarHBondContact O-N 2.8Å
59	Y	95.6	Very high	93.6	Very high	19 Å²	19	41.9 Å²	41.9	8%	0.075	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-43.2	172.8	-179.8	-96.3	0	0	0	113.5	Q55 F56 R57 E61 S62 E63 R147 F148	Q55-Y59 PolarHBondContact O-N 3.4Å; Q55-Y59 VanDerWaalsContact O-N 3.09Å; F56-Y59 HydrophobicContact CD2-CD1 4.47Å; F56-Y59 HydrophobicContact CE2-CD1 4.39Å; F56-Y59 PolarHBondContact O-N 2.78Å; R57-Y59 PolarHBondContact O-N 3.1Å; Y59-E61 VanDerWaalsContact C-N 3.32Å; Y59-E61 PolarHBondContact O-N 3.09Å; Y59-S62 PolarHBondContact O-N 2.97Å; Y59-S62 PolarHBondContact O-OG 3.47Å; Y59-E63 HydrophobicContact CE1-CG 3.95Å; Y59-E63 WeakPolarHBondContact CE1-OE1 3.31Å; Y59-E63 WeakPolarHBondContact CE1-OE2 2.94Å; Y59-E63 VanDerWaalsContact CZ-OE1 3.23Å; Y59-E63 PolarHBondContact O-N 3.35Å; Y59-E63 VanDerWaalsContact O-N 3.17Å; Y59-E63 PolarHBondContact OH-OE1 2.78Å; Y59-R147 HydrophobicContact CE1-CB 4.46Å; Y59-R147 WeakPolarHBondContact OH-CB 3.47Å; Y59-F148 VanDerWaalsContact CB-CD2 3.46Å; Y59-F148 HydrophobicContact CD1-CB 3.67Å; Y59-F148 AromaticContact CD1-CD2 3.9Å; Y59-F148 HydrophobicContact CD1-CD2 3.9Å; Y59-F148 HydrophobicContact CD1-CG 4.13Å; Y59-F148 HydrophobicContact CD2-CB 4.44Å; Y59-F148 AromaticContact CD2-CD2 3.57Å; Y59-F148 HydrophobicContact CD2-CD2 3.57Å; Y59-F148 HydrophobicContact CD2-CE2 4.35Å; Y59-F148 HydrophobicContact CD2-CG 4.47Å; Y59-F148 HydrophobicContact CE1-CB 3.77Å; Y59-F148 HydrophobicContact CE2-CB 4.48Å; Y59-F148 HydrophobicContact CE2-CD2 4.26Å; Y59-F148 HydrophobicContact CG-CB 4.03Å; Y59-F148 AromaticContact CG-CD2 3.34Å; Y59-F148 HydrophobicContact CG-CD2 3.34Å; Y59-F148 HydrophobicContact CG-CE2 4.14Å; Y59-F148 HydrophobicContact CG-CG 4.04Å
60	L	95.2	Very high	93.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.5	-34.1	177.9	-73.4	174.7	0	0	0	112.6	F56 R57 S62 E63 H64 A65 E66 I69 M140 S144	F56-L60 HydrophobicContact CD1-CD1 3.95Å; F56-L60 HydrophobicContact CE1-CD1 3.55Å; F56-L60 HydrophobicContact CE1-CG 4.19Å; F56-L60 HydrophobicContact CE2-CD1 4.47Å; F56-L60 HydrophobicContact CE2-CD2 4.38Å; F56-L60 HydrophobicContact CE2-CG 4.23Å; F56-L60 HydrophobicContact CZ-CD1 3.85Å; F56-L60 HydrophobicContact CZ-CD2 4.11Å; F56-L60 HydrophobicContact CZ-CG 4.04Å; F56-L60 WeakPolarHBondContact O-CG 3.24Å; F56-L60 PolarHBondContact O-N 3.22Å; R57-L60 PolarHBondContact O-N 3.49Å; L60-S62 VanDerWaalsContact C-N 3.28Å; L60-S62 PolarHBondContact O-N 3.36Å; L60-E63 CarbonylContact O-C 3.5Å; L60-E63 PolarHBondContact O-N 2.67Å; L60-H64 PolarHBondContact O-N 3.13Å; L60-A65 HydrophobicContact CD2-CB 3.93Å; L60-A65 PolarHBondContact O-N 3.13Å; L60-E66 HydrophobicContact CB-CB 4.36Å; L60-E66 PolarHBondContact O-N 3.06Å; L60-I69 HydrophobicContact CD1-CB 3.55Å; L60-I69 HydrophobicContact CD1-CD1 4.33Å; L60-I69 HydrophobicContact CD1-CG2 3.61Å; L60-M140 HydrophobicContact CD1-SD 4.1Å; L60-S144 WeakPolarHBondContact CD2-OG 3.33Å
61	E	92.5	Very high	93.7	Very high	64 Å²	64	39.6 Å²	39.6	30%	0.299	19%	0.187	S	C	.	.	H	α-helix	trans	-61.9	-36.7	173.4	-72.3	173.5	-178.7	0	0	111.3	R57 Y59 E63 H64 E66	R57-E61 HydrophobicContact CG-CG 4.46Å; R57-E61 WeakPolarHBondContact O-CG 3.34Å; R57-E61 PolarHBondContact O-N 2.9Å; Y59-E61 VanDerWaalsContact C-N 3.32Å; Y59-E61 PolarHBondContact O-N 3.09Å; E61-E63 VanDerWaalsContact C-N 3.33Å; E61-H64 PolarHBondContact O-N 3.17Å; E61-E66 HydrophobicContact CB-CB 4.42Å; E61-E66 HydrophobicContact CG-CB 3.66Å; E61-E66 HydrophobicContact CG-CG 4.05Å
62	S	92.4	Very high	93.9	Very high	73 Å²	73	40.7 Å²	40.7	51%	0.51	19%	0.19	S	C	.	.	H	α-helix	trans	-73.3	-25	175.4	80.4	0	0	0	0	113.3	E58 Y59 L60	E58-S62 PolarHBondContact O-N 2.8Å; Y59-S62 PolarHBondContact O-N 2.97Å; Y59-S62 PolarHBondContact O-OG 3.47Å; L60-S62 VanDerWaalsContact C-N 3.28Å; L60-S62 PolarHBondContact O-N 3.36Å
63	E	92.2	Very high	93.8	Very high	59 Å²	59	41.4 Å²	41.4	28%	0.276	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	0.1	173.4	-69.8	-161.5	152	0	0	113.9	Y59 L60 E61 A65 R147	Y59-E63 HydrophobicContact CE1-CG 3.95Å; Y59-E63 WeakPolarHBondContact CE1-OE1 3.31Å; Y59-E63 WeakPolarHBondContact CE1-OE2 2.94Å; Y59-E63 VanDerWaalsContact CZ-OE1 3.23Å; Y59-E63 PolarHBondContact O-N 3.35Å; Y59-E63 VanDerWaalsContact O-N 3.17Å; Y59-E63 PolarHBondContact OH-OE1 2.78Å; L60-E63 CarbonylContact O-C 3.5Å; L60-E63 PolarHBondContact O-N 2.67Å; E61-E63 VanDerWaalsContact C-N 3.33Å; E63-A65 VanDerWaalsContact C-N 3.26Å; E63-A65 HydrophobicContact CB-CB 4.37Å; E63-A65 PolarHBondContact O-N 3.19Å; E63-R147 IonicContact OE1-CZ 3.74Å; E63-R147 IonicContact OE1-NE 3.43Å; E63-R147 PolarHBondContact OE1-NE 3.46Å; E63-R147 IonicContact OE1-NH2 3.77Å; E63-R147 IonicContact OE2-CZ 2.59Å; E63-R147 IonicContact OE2-NE 3.72Å; E63-R147 PolarHBondContact OE2-NE 3.43Å; E63-R147 IonicContact OE2-NH2 2.67Å; E63-R147 PolarHBondContact OE2-NH2 3.43Å
64	H	89.4	Confident	93.7	Very high	159 Å²	159	39.4 Å²	39.4	74%	0.736	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	42	-171.8	-56.5	-61.2	0	0	0	113.1	L60 E61 E66	L60-H64 PolarHBondContact O-N 3.13Å; E61-H64 PolarHBondContact O-N 3.17Å; H64-E66 VanDerWaalsContact C-OE2 3.26Å; H64-E66 VanDerWaalsContact CA-OE2 3.27Å; H64-E66 WeakPolarHBondContact CA-OE2 3.38Å
65	A	92.7	Very high	93.7	Very high	16 Å²	16	35.1 Å²	35.1	13%	0.132	17%	0.171	C	C	.	.			trans	-129.7	17.1	-178.2	0	0	0	0	0	112.3	L60 E63 E67 N68	L60-A65 HydrophobicContact CD2-CB 3.93Å; L60-A65 PolarHBondContact O-N 3.13Å; E63-A65 VanDerWaalsContact C-N 3.26Å; E63-A65 HydrophobicContact CB-CB 4.37Å; E63-A65 PolarHBondContact O-N 3.19Å; A65-E67 VanDerWaalsContact CA-OE2 3.26Å; A65-E67 WeakPolarHBondContact CA-OE2 3.38Å; A65-E67 PolarHBondContact O-N 3.45Å; A65-N68 PolarHBondContact O-N 3.26Å; A65-N68 PolarHBondContact O-ND2 2.76Å
66	E	92.6	Very high	93.6	Very high	44 Å²	44	37 Å²	37	21%	0.206	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-21.9	-175.2	68.3	-80.3	-172.3	0	0	113.7	L60 E61 H64 N68 I69 F70	L60-E66 HydrophobicContact CB-CB 4.36Å; L60-E66 PolarHBondContact O-N 3.06Å; E61-E66 HydrophobicContact CB-CB 4.42Å; E61-E66 HydrophobicContact CG-CB 3.66Å; E61-E66 HydrophobicContact CG-CG 4.05Å; H64-E66 VanDerWaalsContact C-OE2 3.26Å; H64-E66 VanDerWaalsContact CA-OE2 3.27Å; H64-E66 WeakPolarHBondContact CA-OE2 3.38Å; E66-N68 PolarHBondContact O-N 3.39Å; E66-N68 VanDerWaalsContact O-N 3.11Å; E66-I69 VanDerWaalsContact O-CG2 3.28Å; E66-I69 WeakPolarHBondContact O-CG2 3.41Å; E66-I69 PolarHBondContact O-N 3.42Å; E66-F70 HydrophobicContact CB-CD2 3.87Å; E66-F70 HydrophobicContact CB-CE2 3.64Å; E66-F70 HydrophobicContact CG-CD2 3.8Å; E66-F70 HydrophobicContact CG-CE2 3.46Å; E66-F70 VanDerWaalsContact CG-CE2 3.46Å; E66-F70 WeakPolarHBondContact O-CB 3.28Å; E66-F70 WeakPolarHBondContact O-CD2 3.47Å; E66-F70 WeakPolarHBondContact O-CG 3.34Å; E66-F70 PolarHBondContact O-N 2.89Å
67	E	93.4	Very high	93.3	Very high	37 Å²	37	38.1 Å²	38.1	17%	0.173	19%	0.185	C	C	.	.	H	α-helix	trans	-56.2	-31.2	176.1	73.7	-68.8	162.3	0	0	112.5	A65 F71 F98 I107	A65-E67 VanDerWaalsContact CA-OE2 3.26Å; A65-E67 WeakPolarHBondContact CA-OE2 3.38Å; A65-E67 PolarHBondContact O-N 3.45Å; E67-F71 VanDerWaalsContact O-CB 3.24Å; E67-F71 WeakPolarHBondContact O-CB 3.48Å; E67-F71 PolarHBondContact O-N 3.16Å; E67-F98 HydrophobicContact CB-CD1 4.4Å; E67-F98 HydrophobicContact CB-CE1 4.15Å; E67-F98 WeakPolarHBondContact O-CE1 3.26Å; E67-I107 HydrophobicContact CG-CG2 4.24Å
68	N	95.4	Very high	93.2	Very high	9 Å²	9	36 Å²	36	5%	0.048	18%	0.177	C	C	.	.	H	α-helix	trans	-68	-46.6	-179.1	-63.2	-64	0	0	0	112.2	A65 E66 W72 V136 M140	A65-N68 PolarHBondContact O-N 3.26Å; A65-N68 PolarHBondContact O-ND2 2.76Å; E66-N68 PolarHBondContact O-N 3.39Å; E66-N68 VanDerWaalsContact O-N 3.11Å; N68-W72 PolarHBondContact O-N 3.15Å; N68-W72 VanDerWaalsContact O-N 3.12Å; N68-V136 HydrophobicContact CB-CG1 3.77Å; N68-V136 VanDerWaalsContact O-CG1 3.26Å; N68-V136 WeakPolarHBondContact O-CG1 3.32Å; N68-M140 HydrophobicContact CB-CG 3.67Å; N68-M140 HydrophobicContact CB-SD 3.71Å
69	I	94.8	Very high	93.1	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-73.8	-37	179.3	-165.4	171.1	0	0	0	110.9	L47 R53 F56 R57 L60 E66 W72 E73 M140	L47-I69 HydrophobicContact CD1-CD1 4.29Å; L47-I69 HydrophobicContact CD1-CG1 4.38Å; R53-I69 HydrophobicContact CG-CD1 3.97Å; F56-I69 HydrophobicContact CB-CD1 4.44Å; F56-I69 HydrophobicContact CD1-CD1 3.66Å; F56-I69 HydrophobicContact CE1-CD1 4.42Å; F56-I69 HydrophobicContact CG-CD1 4.44Å; R57-I69 HydrophobicContact CB-CD1 3.99Å; R57-I69 HydrophobicContact CB-CG2 4.29Å; R57-I69 HydrophobicContact CG-CG2 3.95Å; L60-I69 HydrophobicContact CD1-CB 3.55Å; L60-I69 HydrophobicContact CD1-CD1 4.33Å; L60-I69 HydrophobicContact CD1-CG2 3.61Å; E66-I69 VanDerWaalsContact O-CG2 3.28Å; E66-I69 WeakPolarHBondContact O-CG2 3.41Å; E66-I69 PolarHBondContact O-N 3.42Å; I69-W72 PolarHBondContact O-N 3.38Å; I69-E73 HydrophobicContact CG1-CG 4.37Å; I69-E73 WeakPolarHBondContact O-CG 3.34Å; I69-E73 PolarHBondContact O-N 3.25Å; I69-M140 HydrophobicContact CB-SD 3.95Å
70	F	92.4	Very high	92.9	Very high	33 Å²	33	39 Å²	39	15%	0.145	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-43	176.5	-71	-47.7	0	0	0	112.7	L13 R57 E66 W72 E73 L74 F98	L13-F70 HydrophobicContact CD1-CB 4.19Å; L13-F70 HydrophobicContact CD1-CG 4.39Å; L13-F70 HydrophobicContact CD2-CB 4Å; L13-F70 HydrophobicContact CD2-CD1 3.83Å; L13-F70 HydrophobicContact CD2-CD2 3.03Å; L13-F70 HydrophobicContact CD2-CE1 3.96Å; L13-F70 HydrophobicContact CD2-CE2 3.15Å; L13-F70 HydrophobicContact CD2-CG 3.38Å; L13-F70 HydrophobicContact CD2-CZ 3.64Å; L13-F70 HydrophobicContact CG-CD2 4.4Å; L13-F70 HydrophobicContact CG-CG 4.45Å; R57-F70 VanDerWaalsContact CD-CE1 3.47Å; R57-F70 HydrophobicContact CG-CE1 4.1Å; R57-F70 HydrophobicContact CG-CZ 4.15Å; E66-F70 HydrophobicContact CB-CD2 3.87Å; E66-F70 HydrophobicContact CB-CE2 3.64Å; E66-F70 HydrophobicContact CG-CD2 3.8Å; E66-F70 HydrophobicContact CG-CE2 3.46Å; E66-F70 VanDerWaalsContact CG-CE2 3.46Å; E66-F70 WeakPolarHBondContact O-CB 3.28Å; E66-F70 WeakPolarHBondContact O-CD2 3.47Å; E66-F70 WeakPolarHBondContact O-CG 3.34Å; E66-F70 PolarHBondContact O-N 2.89Å; F70-W72 VanDerWaalsContact C-N 3.32Å; F70-W72 PolarHBondContact O-N 2.87Å; F70-E73 PolarHBondContact O-N 3.05Å; F70-L74 WeakPolarHBondContact O-CB 3.37Å; F70-L74 PolarHBondContact O-N 3.01Å; F70-F98 HydrophobicContact CB-CE1 4.41Å; F70-F98 HydrophobicContact CB-CZ 4.21Å
71	F	95	Very high	92.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.9	-50.1	171.6	175.4	-102.2	0	0	0	110.4	E67 E73 L74 I75 I94 F98 I107 F129 A132 Q133 V136	E67-F71 VanDerWaalsContact O-CB 3.24Å; E67-F71 WeakPolarHBondContact O-CB 3.48Å; E67-F71 PolarHBondContact O-N 3.16Å; F71-E73 PolarHBondContact O-N 2.88Å; F71-L74 PolarHBondContact O-N 3.13Å; F71-I75 HydrophobicContact CD1-CG1 4.37Å; F71-I75 HydrophobicContact CD2-CD1 4.41Å; F71-I75 HydrophobicContact CD2-CG1 4.39Å; F71-I75 HydrophobicContact CE1-CG1 3.99Å; F71-I75 HydrophobicContact CE2-CD1 3.86Å; F71-I75 HydrophobicContact CE2-CG1 3.99Å; F71-I75 HydrophobicContact CZ-CD1 4.02Å; F71-I75 HydrophobicContact CZ-CG1 3.77Å; F71-I75 WeakPolarHBondContact O-CG1 3.33Å; F71-I75 PolarHBondContact O-N 3.29Å; F71-I94 HydrophobicContact CD2-CG2 4.26Å; F71-I94 HydrophobicContact CE2-CG2 3.8Å; F71-F98 HydrophobicContact CB-CD1 3.83Å; F71-F98 HydrophobicContact CB-CE1 3.98Å; F71-F98 HydrophobicContact CB-CG 4.12Å; F71-F98 HydrophobicContact CB-CZ 4.39Å; F71-F98 HydrophobicContact CD2-CB 3.65Å; F71-F98 HydrophobicContact CD2-CD1 4.27Å; F71-F98 AromaticContact CD2-CD2 3.9Å; F71-F98 HydrophobicContact CD2-CD2 3.9Å; F71-F98 AromaticContact CD2-CG 3.69Å; F71-F98 HydrophobicContact CD2-CG 3.69Å; F71-F98 HydrophobicContact CE2-CB 4.21Å; F71-F98 HydrophobicContact CG-CB 4.48Å; F71-F98 HydrophobicContact CG-CD1 4.49Å; F71-F98 HydrophobicContact CG-CG 4.34Å; F71-I107 HydrophobicContact CB-CG2 3.89Å; F71-I107 HydrophobicContact CD1-CD1 3.62Å; F71-I107 HydrophobicContact CD2-CD1 3.81Å; F71-I107 HydrophobicContact CE1-CD1 3.48Å; F71-I107 VanDerWaalsContact CE1-CD1 3.48Å; F71-I107 HydrophobicContact CE2-CD1 3.69Å; F71-I107 HydrophobicContact CG-CD1 3.77Å; F71-I107 HydrophobicContact CG-CG2 4.12Å; F71-I107 HydrophobicContact CZ-CD1 3.53Å; F71-F129 HydrophobicContact CZ-CB 4.37Å; F71-A132 HydrophobicContact CE1-CB 4.02Å; F71-A132 HydrophobicContact CZ-CB 3.72Å; F71-Q133 HydrophobicContact CE1-CB 4.32Å; F71-V136 HydrophobicContact CD1-CB 4.08Å; F71-V136 HydrophobicContact CD1-CG1 4.2Å; F71-V136 HydrophobicContact CD1-CG2 3.79Å; F71-V136 HydrophobicContact CE1-CB 4.43Å; F71-V136 HydrophobicContact CE1-CG2 3.99Å
72	W	95.8	Very high	92.6	Very high	31 Å²	31	41.5 Å²	41.5	12%	0.117	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-47.4	-178.6	-176.4	92.2	0	0	0	112.8	L47 N68 I69 F70 I75 E76 Q133 Y137 M140	L47-W72 HydrophobicContact CD1-CD2 4.5Å; L47-W72 HydrophobicContact CD1-CE3 4.08Å; L47-W72 HydrophobicContact CD1-CZ3 4.13Å; L47-W72 HydrophobicContact CD2-CD2 3.63Å; L47-W72 HydrophobicContact CD2-CE3 3.91Å; L47-W72 HydrophobicContact CD2-CG 4.3Å; L47-W72 HydrophobicContact CD2-CH2 3.75Å; L47-W72 HydrophobicContact CD2-CZ2 3.42Å; L47-W72 VanDerWaalsContact CD2-CZ2 3.42Å; L47-W72 HydrophobicContact CD2-CZ3 3.98Å; L47-W72 HydrophobicContact CG-CD2 4.21Å; L47-W72 HydrophobicContact CG-CE3 3.96Å; L47-W72 HydrophobicContact CG-CH2 3.66Å; L47-W72 HydrophobicContact CG-CZ2 3.9Å; L47-W72 HydrophobicContact CG-CZ3 3.69Å; N68-W72 PolarHBondContact O-N 3.15Å; N68-W72 VanDerWaalsContact O-N 3.12Å; I69-W72 PolarHBondContact O-N 3.38Å; F70-W72 VanDerWaalsContact C-N 3.32Å; F70-W72 PolarHBondContact O-N 2.87Å; W72-I75 PolarHBondContact O-N 2.62Å; W72-E76 HydrophobicContact CD2-CG 4.39Å; W72-E76 HydrophobicContact CE3-CG 4.18Å; W72-E76 HydrophobicContact CH2-CG 3.64Å; W72-E76 HydrophobicContact CZ2-CG 3.88Å; W72-E76 HydrophobicContact CZ3-CG 3.8Å; W72-E76 PolarHBondContact O-N 3.49Å; W72-Q133 VanDerWaalsContact CD1-CG 3.48Å; W72-Q133 HydrophobicContact CG-CG 4.25Å; W72-Q133 PolarHBondContact O-NE2 3.19Å; W72-Y137 AromaticContact NE1-CD2 3.87Å; W72-M140 HydrophobicContact CB-CE 3.88Å; W72-M140 HydrophobicContact CG-CE 4.11Å
73	E	92.8	Very high	92.7	Very high	16 Å²	16	41.2 Å²	41.2	8%	0.075	20%	0.202	C	C	.	.	H	α-helix	trans	-64.1	-41.6	179.1	-71.8	-170.5	121.5	0	0	112.3	R53 R57 I69 F70 F71 I75 E76 E77	R53-E73 WeakPolarHBondContact CD-OE1 3.43Å; R53-E73 WeakPolarHBondContact CG-OE1 3.42Å; R53-E73 IonicContact CZ-OE1 3.74Å; R53-E73 IonicContact NE-OE1 2.62Å; R53-E73 PolarHBondContact NE-OE1 2.95Å; R57-E73 IonicContact CZ-OE1 2.91Å; R57-E73 IonicContact CZ-OE2 2.7Å; R57-E73 IonicContact NE-OE2 3.59Å; R57-E73 PolarHBondContact NE-OE2 3.22Å; R57-E73 IonicContact NH2-OE1 3.38Å; R57-E73 PolarHBondContact NH2-OE1 3.03Å; R57-E73 IonicContact NH2-OE2 4Å; R57-E73 PolarHBondContact NH2-OE2 3.44Å; I69-E73 HydrophobicContact CG1-CG 4.37Å; I69-E73 WeakPolarHBondContact O-CG 3.34Å; I69-E73 PolarHBondContact O-N 3.25Å; F70-E73 PolarHBondContact O-N 3.05Å; F71-E73 PolarHBondContact O-N 2.88Å; E73-I75 VanDerWaalsContact C-N 3.28Å; E73-I75 PolarHBondContact O-N 3.49Å; E73-E76 WeakPolarHBondContact O-CB 3.49Å; E73-E76 PolarHBondContact O-N 2.63Å; E73-E76 VanDerWaalsContact O-N 3.13Å; E73-E77 PolarHBondContact O-N 2.98Å; E73-E77 VanDerWaalsContact O-N 3.1Å
74	L	92.2	Very high	92.6	Very high	8 Å²	8	43 Å²	43	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-33.6	179.6	-175.6	63.6	0	0	0	111.7	C6 F10 F70 F71 E77 Y78 M90 I94 F98	C6-L74 HydrophobicContact CB-CD1 3.83Å; F10-L74 HydrophobicContact CD2-CD2 4.25Å; F10-L74 HydrophobicContact CE1-CD2 3.99Å; F10-L74 HydrophobicContact CE2-CD1 4.15Å; F10-L74 HydrophobicContact CE2-CD2 3.38Å; F10-L74 HydrophobicContact CE2-CG 4.34Å; F10-L74 HydrophobicContact CZ-CD2 3.22Å; F70-L74 WeakPolarHBondContact O-CB 3.37Å; F70-L74 PolarHBondContact O-N 3.01Å; F71-L74 PolarHBondContact O-N 3.13Å; L74-E77 PolarHBondContact O-N 3.23Å; L74-Y78 WeakPolarHBondContact O-CB 3.23Å; L74-Y78 PolarHBondContact O-N 2.93Å; L74-M90 HydrophobicContact CD1-SD 4.24Å; L74-I94 HydrophobicContact CD2-CD1 4.27Å; L74-I94 HydrophobicContact CD2-CG1 3.51Å; L74-I94 HydrophobicContact CG-CD1 4.18Å; L74-I94 HydrophobicContact CG-CG1 3.97Å; L74-F98 HydrophobicContact CD2-CE2 3.83Å
75	I	94.5	Very high	92.8	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-38.7	172.4	-61.1	-41	0	0	0	111.3	F71 W72 E73 E77 Y78 R79 I94 F129 Q133	F71-I75 HydrophobicContact CD1-CG1 4.37Å; F71-I75 HydrophobicContact CD2-CD1 4.41Å; F71-I75 HydrophobicContact CD2-CG1 4.39Å; F71-I75 HydrophobicContact CE1-CG1 3.99Å; F71-I75 HydrophobicContact CE2-CD1 3.86Å; F71-I75 HydrophobicContact CE2-CG1 3.99Å; F71-I75 HydrophobicContact CZ-CD1 4.02Å; F71-I75 HydrophobicContact CZ-CG1 3.77Å; F71-I75 WeakPolarHBondContact O-CG1 3.33Å; F71-I75 PolarHBondContact O-N 3.29Å; W72-I75 PolarHBondContact O-N 2.62Å; E73-I75 VanDerWaalsContact C-N 3.28Å; E73-I75 PolarHBondContact O-N 3.49Å; I75-E77 VanDerWaalsContact C-N 3.33Å; I75-E77 PolarHBondContact O-N 3.3Å; I75-Y78 PolarHBondContact O-N 3.27Å; I75-R79 HydrophobicContact CG2-CG 4.41Å; I75-R79 VanDerWaalsContact O-CG 3.24Å; I75-R79 WeakPolarHBondContact O-CG 3.45Å; I75-R79 PolarHBondContact O-N 3.42Å; I75-I94 HydrophobicContact CD1-CD1 3.89Å; I75-I94 HydrophobicContact CD1-CG2 3.92Å; I75-F129 HydrophobicContact CD1-CB 3.48Å; I75-F129 VanDerWaalsContact CD1-CB 3.48Å; I75-F129 HydrophobicContact CD1-CD1 4.35Å; I75-F129 HydrophobicContact CD1-CD2 3.54Å; I75-F129 HydrophobicContact CD1-CE2 4.36Å; I75-F129 HydrophobicContact CD1-CG 3.53Å; I75-F129 HydrophobicContact CG1-CB 3.85Å; I75-F129 HydrophobicContact CG1-CG 4.43Å; I75-F129 HydrophobicContact CG2-CB 4.08Å; I75-Q133 HydrophobicContact CB-CB 4.45Å; I75-Q133 HydrophobicContact CB-CG 4.12Å; I75-Q133 HydrophobicContact CG1-CB 4.4Å; I75-Q133 HydrophobicContact CG1-CG 4.44Å; I75-Q133 HydrophobicContact CG2-CB 4.15Å; I75-Q133 VanDerWaalsContact CG2-CD 3.41Å; I75-Q133 HydrophobicContact CG2-CG 4.1Å; I75-Q133 VanDerWaalsContact CG2-OE1 3.24Å
76	E	92.7	Very high	92.8	Very high	75 Å²	75	42.9 Å²	42.9	35%	0.35	22%	0.222	S	C	.	.	H	α-helix	trans	-59.6	-43.1	174.5	-69.1	-59.4	125.7	0	0	111.8	W72 E73 Q80 Q133	W72-E76 HydrophobicContact CD2-CG 4.39Å; W72-E76 HydrophobicContact CE3-CG 4.18Å; W72-E76 HydrophobicContact CH2-CG 3.64Å; W72-E76 HydrophobicContact CZ2-CG 3.88Å; W72-E76 HydrophobicContact CZ3-CG 3.8Å; W72-E76 PolarHBondContact O-N 3.49Å; E73-E76 WeakPolarHBondContact O-CB 3.49Å; E73-E76 PolarHBondContact O-N 2.63Å; E73-E76 VanDerWaalsContact O-N 3.13Å; E76-Q80 WeakPolarHBondContact O-CG 3.37Å; E76-Q133 PolarHBondContact OE1-NE2 3.5Å
77	E	89.5	Confident	92.8	Very high	24 Å²	24	41.5 Å²	41.5	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-70.2	-44.2	175.9	-61.3	-162.9	158.1	0	0	112.1	L2 R5 C6 I21 E73 L74 I75 R79 Q80	L2-E77 HydrophobicContact CD1-CB 4.23Å; L2-E77 HydrophobicContact CD1-CG 4.47Å; L2-E77 WeakPolarHBondContact CD2-O 3.37Å; R5-E77 IonicContact CZ-OE1 3.93Å; R5-E77 IonicContact NE-OE1 3Å; R5-E77 IonicContact NH2-OE1 2.86Å; R5-E77 PolarHBondContact NH2-OE1 3.29Å; C6-E77 VanDerWaalsContact SG-CB 3.56Å; C6-E77 PolarHBondContact SG-OE2 3.15Å; I21-E77 WeakPolarHBondContact CG2-OE1 3.4Å; E73-E77 PolarHBondContact O-N 2.98Å; E73-E77 VanDerWaalsContact O-N 3.1Å; L74-E77 PolarHBondContact O-N 3.23Å; I75-E77 VanDerWaalsContact C-N 3.33Å; I75-E77 PolarHBondContact O-N 3.3Å; E77-R79 VanDerWaalsContact C-N 3.26Å; E77-R79 PolarHBondContact O-N 3.26Å; E77-Q80 WeakPolarHBondContact O-CB 3.18Å; E77-Q80 PolarHBondContact O-N 3.5Å
78	Y	91.9	Very high	92.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-52.8	-42.6	177.2	167.7	-98.5	0	0	0	112.6	L74 I75 Q80 L81 L87 M90 A91 I94 T125 F129	L74-Y78 WeakPolarHBondContact O-CB 3.23Å; L74-Y78 PolarHBondContact O-N 2.93Å; I75-Y78 PolarHBondContact O-N 3.27Å; Y78-Q80 PolarHBondContact O-N 2.9Å; Y78-L81 HydrophobicContact CD2-CD1 4.19Å; Y78-L81 WeakPolarHBondContact O-CB 3.4Å; Y78-L81 PolarHBondContact O-N 3.2Å; Y78-L81 VanDerWaalsContact O-N 3.12Å; Y78-L87 HydrophobicContact CE2-CD2 4.13Å; Y78-L87 HydrophobicContact CE2-CG 3.75Å; Y78-L87 WeakPolarHBondContact CE2-O 3.46Å; Y78-L87 VanDerWaalsContact OH-CD2 3.26Å; Y78-L87 WeakPolarHBondContact OH-CD2 3.37Å; Y78-M90 HydrophobicContact CD2-CB 4.01Å; Y78-M90 HydrophobicContact CD2-CG 3.79Å; Y78-M90 HydrophobicContact CE2-CB 4.42Å; Y78-A91 HydrophobicContact CE2-CB 3.82Å; Y78-I94 HydrophobicContact CD2-CD1 3.74Å; Y78-I94 HydrophobicContact CE2-CD1 4.43Å; Y78-I94 HydrophobicContact CG-CD1 3.89Å; Y78-T125 WeakPolarHBondContact CE1-O 3.21Å; Y78-T125 PolarHBondContact OH-O 3.16Å; Y78-F129 AromaticContact CD1-CD2 3.9Å; Y78-F129 HydrophobicContact CD1-CD2 3.9Å; Y78-F129 HydrophobicContact CD1-CE2 4.32Å; Y78-F129 AromaticContact CE1-CD2 3.63Å; Y78-F129 HydrophobicContact CE1-CD2 3.63Å; Y78-F129 AromaticContact CE1-CE2 3.9Å; Y78-F129 HydrophobicContact CE1-CE2 3.9Å; Y78-F129 HydrophobicContact CE2-CE2 4.09Å; Y78-F129 HydrophobicContact CG-CD2 4.49Å; Y78-F129 AromaticContact CZ-CE2 3.76Å
79	R	92.3	Very high	92.7	Very high	46 Å²	46	47.8 Å²	47.8	17%	0.174	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.1	178.6	-75.3	171.5	-171.5	-64.7	-6	113.7	I75 E77 R126 D130	I75-R79 HydrophobicContact CG2-CG 4.41Å; I75-R79 VanDerWaalsContact O-CG 3.24Å; I75-R79 WeakPolarHBondContact O-CG 3.45Å; I75-R79 PolarHBondContact O-N 3.42Å; E77-R79 VanDerWaalsContact C-N 3.26Å; E77-R79 PolarHBondContact O-N 3.26Å; R79-R126 WeakPolarHBondContact CG-O 3.49Å; R79-R126 PolarHBondContact NH1-O 3.34Å; R79-R126 WeakPolarHBondContact O-CD 3.43Å; R79-D130 IonicContact CZ-OD1 3.51Å; R79-D130 IonicContact NH1-OD1 3.31Å; R79-D130 PolarHBondContact NH1-OD1 2.87Å; R79-D130 IonicContact NH1-OD2 3.3Å; R79-D130 IonicContact NH2-OD1 3.33Å; R79-D130 PolarHBondContact NH2-OD1 2.96Å
80	Q	91.6	Very high	92.6	Very high	126 Å²	126	47.9 Å²	47.9	59%	0.589	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.5	-178.3	-55	-60.2	-27.4	0	0	112.7	L2 E76 E77 Y78 T82	L2-Q80 HydrophobicContact CD2-CB 3.53Å; E76-Q80 WeakPolarHBondContact O-CG 3.37Å; E77-Q80 WeakPolarHBondContact O-CB 3.18Å; E77-Q80 PolarHBondContact O-N 3.5Å; Y78-Q80 PolarHBondContact O-N 2.9Å; Q80-T82 PolarHBondContact O-N 3.04Å
81	L	90.7	Very high	92.7	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.237	C	C	.	.			trans	-64.9	128.9	176.2	-65.6	174.1	0	0	0	111.1	L2 Y78 L87 M90 R126	L2-L81 HydrophobicContact CB-CD2 4.1Å; L2-L81 HydrophobicContact CD2-CD2 3.99Å; L2-L81 HydrophobicContact CD2-CG 4.43Å; L2-L81 HydrophobicContact CG-CD2 4.01Å; Y78-L81 HydrophobicContact CD2-CD1 4.19Å; Y78-L81 WeakPolarHBondContact O-CB 3.4Å; Y78-L81 PolarHBondContact O-N 3.2Å; Y78-L81 VanDerWaalsContact O-N 3.12Å; L81-L87 HydrophobicContact CB-CB 4.36Å; L81-M90 HydrophobicContact CD1-CB 3.71Å; L81-M90 HydrophobicContact CD1-CG 3.88Å; L81-R126 VanDerWaalsContact O-CZ 3.23Å; L81-R126 PolarHBondContact O-NE 2.97Å; L81-R126 PolarHBondContact O-NH2 3.17Å
82	T	91	Very high	92.7	Very high	113 Å²	113	49.2 Å²	49.2	69%	0.693	25%	0.251	S	S	*	.			trans	-101.9	-28.6	-177.9	56.6	0	0	0	0	113.7	Q80	Q80-T82 PolarHBondContact O-N 3.04Å
83	N	92.8	Very high	92.5	Very high	68 Å²	68	51.9 Å²	51.9	36%	0.364	26%	0.264	S	S	.	.			trans	-80.4	130.5	176.6	179.8	-64.4	0	0	0	110.6	D85 E86 L87	N83-D85 WeakPolarHBondContact OD1-CA 3.32Å; N83-D85 WeakPolarHBondContact OD1-CB 3.45Å; N83-D85 PolarHBondContact OD1-N 2.94Å; N83-E86 HydrophobicContact CB-CB 4.01Å; N83-E86 HydrophobicContact CB-CG 3.91Å; N83-E86 PolarHBondContact OD1-N 3.05Å; N83-L87 VanDerWaalsContact O-CB 3.3Å; N83-L87 WeakPolarHBondContact O-CB 3.27Å; N83-L87 PolarHBondContact O-N 3.08Å
84	S	91.9	Very high	92.5	Very high	96 Å²	96	51.1 Å²	51.1	67%	0.671	26%	0.261	S	S	*	.	H	α-helix	trans	-69.9	-33.5	-176.2	-58.6	0	0	0	0	114	Y88	S84-Y88 WeakPolarHBondContact O-CB 3.33Å; S84-Y88 PolarHBondContact O-N 3.39Å
85	D	92.6	Very high	92.6	Very high	118 Å²	118	53.4 Å²	53.4	63%	0.631	27%	0.269	S	S	*	.	H	α-helix	trans	-71.9	-45.1	177.5	-60.8	-30.7	0	0	0	110	N83 L87 Y88 D89	N83-D85 WeakPolarHBondContact OD1-CA 3.32Å; N83-D85 WeakPolarHBondContact OD1-CB 3.45Å; N83-D85 PolarHBondContact OD1-N 2.94Å; D85-L87 VanDerWaalsContact C-N 3.3Å; D85-L87 PolarHBondContact O-N 3.36Å; D85-Y88 PolarHBondContact O-N 3.49Å; D85-D89 WeakPolarHBondContact O-CB 3.37Å; D85-D89 PolarHBondContact O-N 3.13Å
86	E	91.9	Very high	92.5	Very high	54 Å²	54	59.5 Å²	59.5	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-40.8	174.1	-68.6	-176.4	164	0	0	111.8	Y3 N83 M90	Y3-E86 HydrophobicContact CD1-CG 4.44Å; Y3-E86 HydrophobicContact CD2-CB 3.61Å; Y3-E86 HydrophobicContact CD2-CG 3.87Å; Y3-E86 HydrophobicContact CE2-CB 4.2Å; Y3-E86 HydrophobicContact CE2-CG 4.42Å; Y3-E86 HydrophobicContact CG-CB 4.06Å; Y3-E86 HydrophobicContact CG-CG 3.85Å; N83-E86 HydrophobicContact CB-CB 4.01Å; N83-E86 HydrophobicContact CB-CG 3.91Å; N83-E86 PolarHBondContact OD1-N 3.05Å; E86-M90 WeakPolarHBondContact O-CB 3.42Å; E86-M90 PolarHBondContact O-N 3.47Å
87	L	93.3	Very high	92.3	Very high	16 Å²	16	58.6 Å²	58.6	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-46.1	175.5	-177.3	154	0	0	0	111	Y78 L81 N83 D85 M90 A91 P124 R126	Y78-L87 HydrophobicContact CE2-CD2 4.13Å; Y78-L87 HydrophobicContact CE2-CG 3.75Å; Y78-L87 WeakPolarHBondContact CE2-O 3.46Å; Y78-L87 VanDerWaalsContact OH-CD2 3.26Å; Y78-L87 WeakPolarHBondContact OH-CD2 3.37Å; L81-L87 HydrophobicContact CB-CB 4.36Å; N83-L87 VanDerWaalsContact O-CB 3.3Å; N83-L87 WeakPolarHBondContact O-CB 3.27Å; N83-L87 PolarHBondContact O-N 3.08Å; D85-L87 VanDerWaalsContact C-N 3.3Å; D85-L87 PolarHBondContact O-N 3.36Å; L87-M90 PolarHBondContact O-N 3.29Å; L87-A91 WeakPolarHBondContact O-CB 3.4Å; L87-A91 PolarHBondContact O-N 3.31Å; L87-P124 HydrophobicContact CD2-CB 4.18Å; L87-P124 HydrophobicContact CD2-CG 4.29Å; L87-P124 WeakPolarHBondContact CD2-O 3.43Å; L87-R126 HydrophobicContact CD1-CB 4.47Å; L87-R126 HydrophobicContact CD1-CG 3.48Å; L87-R126 VanDerWaalsContact CD1-CG 3.48Å
88	Y	94.8	Very high	92.5	Very high	104 Å²	104	57.5 Å²	57.5	41%	0.408	28%	0.284	S	S	.	.	H	α-helix	trans	-59.7	-51.8	177.9	180	-91.8	0	0	0	111.4	S84 D85 M90 A91 Q92 P124	S84-Y88 WeakPolarHBondContact O-CB 3.33Å; S84-Y88 PolarHBondContact O-N 3.39Å; D85-Y88 PolarHBondContact O-N 3.49Å; Y88-M90 VanDerWaalsContact C-N 3.32Å; Y88-M90 PolarHBondContact O-N 3.35Å; Y88-A91 PolarHBondContact O-N 3.32Å; Y88-Q92 HydrophobicContact CD1-CG 4.26Å; Y88-Q92 HydrophobicContact CE1-CG 3.84Å; Y88-Q92 WeakPolarHBondContact O-CG 3.5Å; Y88-Q92 PolarHBondContact O-N 2.84Å; Y88-Q92 VanDerWaalsContact O-N 3.09Å; Y88-P124 HydrophobicContact CD2-CG 3.6Å; Y88-P124 HydrophobicContact CE2-CG 4.25Å; Y88-P124 HydrophobicContact CG-CG 4.35Å
89	D	92.9	Very high	92.5	Very high	74 Å²	74	57.6 Å²	57.6	40%	0.396	29%	0.285	S	S	.	.	H	α-helix	trans	-57.9	-45.3	179.1	-76.2	-6.3	0	0	0	111.4	Y3 D85 A91 Q92 E93	Y3-D89 HydrophobicContact CE2-CB 3.89Å; Y3-D89 PolarHBondContact OH-OD2 3.49Å; D85-D89 WeakPolarHBondContact O-CB 3.37Å; D85-D89 PolarHBondContact O-N 3.13Å; D89-A91 PolarHBondContact O-N 3.49Å; D89-Q92 PolarHBondContact O-N 3.44Å; D89-E93 PolarHBondContact O-N 3.29Å; D89-E93 VanDerWaalsContact O-N 3.14Å
90	M	92	Very high	92.3	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-41.4	178.8	-169.5	56.1	50	0	0	112.3	Y3 C6 R7 F10 L74 Y78 L81 E86 L87 Y88 Q92 E93 I94	Y3-M90 HydrophobicContact CD2-CE 3.74Å; Y3-M90 HydrophobicContact CE2-CE 3.96Å; C6-M90 HydrophobicContact CB-CE 3.19Å; C6-M90 HydrophobicContact CB-CG 4.39Å; C6-M90 HydrophobicContact CB-SD 3.43Å; C6-M90 WeakPolarHBondContact CB-SD 3.48Å; R7-M90 HydrophobicContact CG-CE 4.03Å; F10-M90 HydrophobicContact CD2-SD 4.04Å; F10-M90 HydrophobicContact CE2-SD 3.52Å; F10-M90 VanDerWaalsContact CE2-SD 3.52Å; L74-M90 HydrophobicContact CD1-SD 4.24Å; Y78-M90 HydrophobicContact CD2-CB 4.01Å; Y78-M90 HydrophobicContact CD2-CG 3.79Å; Y78-M90 HydrophobicContact CE2-CB 4.42Å; L81-M90 HydrophobicContact CD1-CB 3.71Å; L81-M90 HydrophobicContact CD1-CG 3.88Å; E86-M90 WeakPolarHBondContact O-CB 3.42Å; E86-M90 PolarHBondContact O-N 3.47Å; L87-M90 PolarHBondContact O-N 3.29Å; Y88-M90 VanDerWaalsContact C-N 3.32Å; Y88-M90 PolarHBondContact O-N 3.35Å; M90-Q92 VanDerWaalsContact C-N 3.31Å; M90-Q92 PolarHBondContact O-N 3.34Å; M90-E93 PolarHBondContact O-N 3.17Å; M90-I94 HydrophobicContact CG-CD1 3.92Å; M90-I94 HydrophobicContact CG-CG1 4.49Å; M90-I94 WeakPolarHBondContact O-CD1 3.41Å; M90-I94 VanDerWaalsContact O-CG1 3.27Å; M90-I94 WeakPolarHBondContact O-CG1 3.44Å; M90-I94 PolarHBondContact O-N 2.78Å
91	A	94.8	Very high	91.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-40.5	176.9	0	0	0	0	0	111.6	Y78 L87 Y88 D89 I94 Y95 M121 P124 F129	Y78-A91 HydrophobicContact CE2-CB 3.82Å; L87-A91 WeakPolarHBondContact O-CB 3.4Å; L87-A91 PolarHBondContact O-N 3.31Å; Y88-A91 PolarHBondContact O-N 3.32Å; D89-A91 PolarHBondContact O-N 3.49Å; A91-I94 PolarHBondContact O-N 3.41Å; A91-Y95 WeakPolarHBondContact O-CB 3.4Å; A91-Y95 PolarHBondContact O-N 2.86Å; A91-M121 VanDerWaalsContact C-CE 3.41Å; A91-M121 HydrophobicContact CB-CE 3.81Å; A91-M121 HydrophobicContact CB-SD 4.46Å; A91-M121 WeakPolarHBondContact O-CE 3.43Å; A91-P124 HydrophobicContact CB-CB 3.46Å; A91-P124 VanDerWaalsContact CB-CB 3.46Å; A91-P124 HydrophobicContact CB-CG 3.73Å; A91-F129 HydrophobicContact CB-CE2 3.94Å; A91-F129 HydrophobicContact CB-CZ 4Å
92	Q	94.1	Very high	91.5	Very high	62 Å²	62	63.9 Å²	63.9	29%	0.29	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-42.8	177.1	-63.4	-56.4	-40.4	0	0	111.6	Y88 D89 M90 Y95 K96 M121	Y88-Q92 HydrophobicContact CD1-CG 4.26Å; Y88-Q92 HydrophobicContact CE1-CG 3.84Å; Y88-Q92 WeakPolarHBondContact O-CG 3.5Å; Y88-Q92 PolarHBondContact O-N 2.84Å; Y88-Q92 VanDerWaalsContact O-N 3.09Å; D89-Q92 PolarHBondContact O-N 3.44Å; M90-Q92 VanDerWaalsContact C-N 3.31Å; M90-Q92 PolarHBondContact O-N 3.34Å; Q92-Y95 PolarHBondContact O-N 3.33Å; Q92-K96 VanDerWaalsContact O-CB 3.28Å; Q92-K96 WeakPolarHBondContact O-CB 3.48Å; Q92-K96 PolarHBondContact O-N 3.5Å; Q92-M121 PolarHBondContact NE2-O 3.16Å; Q92-M121 VanDerWaalsContact NE2-O 3.17Å
93	E	92.1	Very high	91.2	Very high	86 Å²	86	59.6 Å²	59.6	40%	0.402	30%	0.304	S	S	.	.	H	α-helix	trans	-65.5	-43.6	176.9	-68.9	-61.5	149.1	0	0	112	F10 D89 M90 Y95 K96 R97	F10-E93 HydrophobicContact CD2-CB 4.22Å; F10-E93 HydrophobicContact CE1-CB 4.32Å; F10-E93 HydrophobicContact CE2-CB 3.7Å; F10-E93 VanDerWaalsContact CZ-C 3.47Å; F10-E93 HydrophobicContact CZ-CB 3.76Å; D89-E93 PolarHBondContact O-N 3.29Å; D89-E93 VanDerWaalsContact O-N 3.14Å; M90-E93 PolarHBondContact O-N 3.17Å; E93-Y95 PolarHBondContact O-N 3.28Å; E93-K96 PolarHBondContact O-N 2.81Å; E93-R97 WeakPolarHBondContact O-CB 3.4Å; E93-R97 PolarHBondContact O-N 2.89Å
94	I	93.5	Very high	90.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-55.8	-51.1	173.6	-70.3	162.1	0	0	0	110.4	F10 F71 L74 I75 Y78 M90 A91 K96 R97 F98 F129	F10-I94 HydrophobicContact CE2-CG1 4.27Å; F10-I94 HydrophobicContact CZ-CB 4.47Å; F10-I94 HydrophobicContact CZ-CG1 3.93Å; F71-I94 HydrophobicContact CD2-CG2 4.26Å; F71-I94 HydrophobicContact CE2-CG2 3.8Å; L74-I94 HydrophobicContact CD2-CD1 4.27Å; L74-I94 HydrophobicContact CD2-CG1 3.51Å; L74-I94 HydrophobicContact CG-CD1 4.18Å; L74-I94 HydrophobicContact CG-CG1 3.97Å; I75-I94 HydrophobicContact CD1-CD1 3.89Å; I75-I94 HydrophobicContact CD1-CG2 3.92Å; Y78-I94 HydrophobicContact CD2-CD1 3.74Å; Y78-I94 HydrophobicContact CE2-CD1 4.43Å; Y78-I94 HydrophobicContact CG-CD1 3.89Å; M90-I94 HydrophobicContact CG-CD1 3.92Å; M90-I94 HydrophobicContact CG-CG1 4.49Å; M90-I94 WeakPolarHBondContact O-CD1 3.41Å; M90-I94 VanDerWaalsContact O-CG1 3.27Å; M90-I94 WeakPolarHBondContact O-CG1 3.44Å; M90-I94 PolarHBondContact O-N 2.78Å; A91-I94 PolarHBondContact O-N 3.41Å; I94-K96 PolarHBondContact O-N 2.72Å; I94-R97 PolarHBondContact O-N 3.35Å; I94-F98 HydrophobicContact CG2-CD2 4.49Å; I94-F98 PolarHBondContact O-N 3.5Å; I94-F129 HydrophobicContact CB-CE1 4.45Å; I94-F129 HydrophobicContact CB-CE2 4.22Å; I94-F129 HydrophobicContact CB-CZ 3.93Å; I94-F129 HydrophobicContact CD1-CD2 4.31Å; I94-F129 HydrophobicContact CD1-CE2 3.86Å; I94-F129 HydrophobicContact CD1-CZ 4.44Å; I94-F129 HydrophobicContact CG2-CD1 4.11Å; I94-F129 HydrophobicContact CG2-CD2 4.38Å; I94-F129 HydrophobicContact CG2-CE1 3.71Å; I94-F129 HydrophobicContact CG2-CE2 3.99Å; I94-F129 HydrophobicContact CG2-CG 4.44Å; I94-F129 HydrophobicContact CG2-CZ 3.64Å
95	Y	93.3	Very high	90.8	Very high	56 Å²	56	58.7 Å²	58.7	22%	0.22	30%	0.297	C	S	.	.	I	π-helix	trans	-62.1	-46.3	-178.7	-179.3	-84	0	0	0	111.7	A91 Q92 E93 R97 L99 N100 N118 M121	A91-Y95 WeakPolarHBondContact O-CB 3.4Å; A91-Y95 PolarHBondContact O-N 2.86Å; Q92-Y95 PolarHBondContact O-N 3.33Å; E93-Y95 PolarHBondContact O-N 3.28Å; Y95-R97 VanDerWaalsContact C-N 3.31Å; Y95-R97 PolarHBondContact O-N 3.18Å; Y95-L99 HydrophobicContact CD2-CB 3.87Å; Y95-L99 HydrophobicContact CD2-CD1 3.58Å; Y95-L99 HydrophobicContact CD2-CG 4.36Å; Y95-L99 HydrophobicContact CE2-CB 4.13Å; Y95-L99 HydrophobicContact CE2-CD1 4.3Å; Y95-L99 HydrophobicContact CG-CB 4.23Å; Y95-L99 HydrophobicContact CG-CD1 4.27Å; Y95-L99 WeakPolarHBondContact O-CA 3.49Å; Y95-L99 WeakPolarHBondContact O-CB 3.36Å; Y95-L99 PolarHBondContact O-N 3.4Å; Y95-N100 PolarHBondContact O-N 3.37Å; Y95-N100 VanDerWaalsContact O-N 3.14Å; Y95-N118 VanDerWaalsContact CE2-OD1 3.3Å; Y95-N118 WeakPolarHBondContact CE2-OD1 3.37Å; Y95-N118 PolarHBondContact OH-OD1 2.85Å; Y95-M121 HydrophobicContact CD2-CG 3.31Å; Y95-M121 HydrophobicContact CD2-SD 3.94Å; Y95-M121 HydrophobicContact CE2-CG 3.77Å; Y95-M121 HydrophobicContact CG-CE 4.28Å; Y95-M121 HydrophobicContact CG-CG 3.83Å; Y95-M121 HydrophobicContact CG-SD 4.21Å
96	K	91.9	Very high	90.8	Very high	129 Å²	129	56 Å²	56	56%	0.561	28%	0.281	S	S	*	.	I	π-helix	trans	-60.4	-39.4	179.2	-178.1	-176.7	173.3	-169	0	112.4	Q92 E93 I94 N100	Q92-K96 VanDerWaalsContact O-CB 3.28Å; Q92-K96 WeakPolarHBondContact O-CB 3.48Å; Q92-K96 PolarHBondContact O-N 3.5Å; E93-K96 PolarHBondContact O-N 2.81Å; I94-K96 PolarHBondContact O-N 2.72Å; K96-N100 VanDerWaalsContact O-CB 3.3Å; K96-N100 WeakPolarHBondContact O-CB 3.29Å
97	R	90.2	Very high	90.9	Very high	56 Å²	56	53.5 Å²	53.5	21%	0.211	27%	0.269	C	S	.	.	I	π-helix	trans	-84.3	-38.5	-175.6	-177.5	61.3	168.2	164.2	-3.6	113.9	F10 L13 E93 I94 Y95 S103 T104 S105	F10-R97 HydrophobicContact CD1-CB 4.36Å; F10-R97 HydrophobicContact CD1-CG 4.31Å; F10-R97 HydrophobicContact CE1-CB 3.6Å; F10-R97 HydrophobicContact CE1-CG 3.85Å; L13-R97 PolarHBondContact O-NH2 3.49Å; E93-R97 WeakPolarHBondContact O-CB 3.4Å; E93-R97 PolarHBondContact O-N 2.89Å; I94-R97 PolarHBondContact O-N 3.35Å; Y95-R97 VanDerWaalsContact C-N 3.31Å; Y95-R97 PolarHBondContact O-N 3.18Å; R97-S103 WeakPolarHBondContact O-CB 3.36Å; R97-S103 PolarHBondContact O-OG 3.38Å; R97-T104 PolarHBondContact NH1-OG1 2.9Å; R97-S105 PolarHBondContact NE-OG 3.37Å; R97-S105 PolarHBondContact NH1-OG 3.24Å; R97-S105 PolarHBondContact NH2-OG 3.44Å; R97-S105 CarbonylContact O-C 3.58Å
98	F	93.8	Very high	91	Very high	1 Å²	1	58.3 Å²	58.3	0%	0.004	30%	0.295	C	S	.	.	I	π-helix	trans	-111.3	-19.4	-170.6	-63.3	-79.2	0	0	0	113.4	F10 L13 E67 F70 F71 L74 I94 S105 E106 I107	F10-F98 AromaticContact CE1-CE2 3.99Å; F10-F98 HydrophobicContact CE1-CE2 3.99Å; F10-F98 HydrophobicContact CZ-CE2 4.33Å; L13-F98 HydrophobicContact CD1-CZ 4.01Å; E67-F98 HydrophobicContact CB-CD1 4.4Å; E67-F98 HydrophobicContact CB-CE1 4.15Å; E67-F98 WeakPolarHBondContact O-CE1 3.26Å; F70-F98 HydrophobicContact CB-CE1 4.41Å; F70-F98 HydrophobicContact CB-CZ 4.21Å; F71-F98 HydrophobicContact CB-CD1 3.83Å; F71-F98 HydrophobicContact CB-CE1 3.98Å; F71-F98 HydrophobicContact CB-CG 4.12Å; F71-F98 HydrophobicContact CB-CZ 4.39Å; F71-F98 HydrophobicContact CD2-CB 3.65Å; F71-F98 HydrophobicContact CD2-CD1 4.27Å; F71-F98 AromaticContact CD2-CD2 3.9Å; F71-F98 HydrophobicContact CD2-CD2 3.9Å; F71-F98 AromaticContact CD2-CG 3.69Å; F71-F98 HydrophobicContact CD2-CG 3.69Å; F71-F98 HydrophobicContact CE2-CB 4.21Å; F71-F98 HydrophobicContact CG-CB 4.48Å; F71-F98 HydrophobicContact CG-CD1 4.49Å; F71-F98 HydrophobicContact CG-CG 4.34Å; L74-F98 HydrophobicContact CD2-CE2 3.83Å; I94-F98 HydrophobicContact CG2-CD2 4.49Å; I94-F98 PolarHBondContact O-N 3.5Å; F98-S105 WeakPolarHBondContact CA-O 3.24Å; F98-S105 VanDerWaalsContact CD1-O 3.24Å; F98-S105 WeakPolarHBondContact CD1-O 3.44Å; F98-E106 CarbonylContact O-C 3.58Å; F98-E106 WeakPolarHBondContact O-CA 3.47Å; F98-I107 HydrophobicContact CB-CG1 4.19Å; F98-I107 HydrophobicContact CB-CG2 4.28Å; F98-I107 HydrophobicContact CD1-CG2 3.96Å; F98-I107 VanDerWaalsContact O-CG1 3.29Å; F98-I107 WeakPolarHBondContact O-CG1 3.37Å; F98-I107 PolarHBondContact O-N 3.48Å
99	L	91.7	Very high	91	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.01	28%	0.277	C	S	.	.	I	π-helix	trans	-115.2	-15.4	-171.8	-59.1	174.8	0	0	0	114.2	Y95 I107 I109 L117 F129	Y95-L99 HydrophobicContact CD2-CB 3.87Å; Y95-L99 HydrophobicContact CD2-CD1 3.58Å; Y95-L99 HydrophobicContact CD2-CG 4.36Å; Y95-L99 HydrophobicContact CE2-CB 4.13Å; Y95-L99 HydrophobicContact CE2-CD1 4.3Å; Y95-L99 HydrophobicContact CG-CB 4.23Å; Y95-L99 HydrophobicContact CG-CD1 4.27Å; Y95-L99 WeakPolarHBondContact O-CA 3.49Å; Y95-L99 WeakPolarHBondContact O-CB 3.36Å; Y95-L99 PolarHBondContact O-N 3.4Å; L99-I107 HydrophobicContact CD2-CD1 3.82Å; L99-I107 HydrophobicContact CD2-CG1 3.93Å; L99-I109 HydrophobicContact CD2-CD1 3.49Å; L99-I109 VanDerWaalsContact CD2-CD1 3.49Å; L99-I109 HydrophobicContact CD2-CG1 4.3Å; L99-L117 HydrophobicContact CD1-CB 4.38Å; L99-L117 HydrophobicContact CD1-CD1 3.69Å; L99-L117 HydrophobicContact CD1-CD2 4.45Å; L99-L117 HydrophobicContact CD1-CG 4.39Å; L99-L117 HydrophobicContact CD2-CD1 4.02Å; L99-F129 HydrophobicContact CD1-CD1 4.18Å; L99-F129 HydrophobicContact CD1-CE1 3.81Å
100	N	87.9	Confident	91.2	Very high	70 Å²	70	53.5 Å²	53.5	37%	0.374	28%	0.276	S	S	.	.	S	Bend	trans	-75	129.6	179	-164.7	8.4	0	0	0	111	Y95 K96 N102 S103	Y95-N100 PolarHBondContact O-N 3.37Å; Y95-N100 VanDerWaalsContact O-N 3.14Å; K96-N100 VanDerWaalsContact O-CB 3.3Å; K96-N100 WeakPolarHBondContact O-CB 3.29Å; N100-N102 PolarHBondContact O-N 2.98Å; N100-S103 WeakPolarHBondContact O-CB 3.47Å; N100-S103 PolarHBondContact O-N 2.83Å
101	T	81.8	Confident	91.3	Very high	87 Å²	87	59.7 Å²	59.7	53%	0.534	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	0.4	-171.9	-48.7	0	0	0	0	115.5	E106 R114	T101-E106 WeakPolarHBondContact CA-OE2 3.39Å; T101-R114 PolarHBondContact OG1-NH1 2.67Å; T101-R114 VanDerWaalsContact OG1-NH1 3.16Å
102	N	83	Confident	91.4	Very high	148 Å²	148	68 Å²	68	79%	0.791	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	11.9	176.9	-62.4	-53.6	0	0	0	112	N100	N100-N102 PolarHBondContact O-N 2.98Å
103	S	86	Confident	91.5	Very high	24 Å²	24	65.4 Å²	65.4	17%	0.168	33%	0.333	C	S	.	.			trans	-78.4	139.4	176.6	-172.7	0	0	0	0	110.4	R97 N100 S105 E106	R97-S103 WeakPolarHBondContact O-CB 3.36Å; R97-S103 PolarHBondContact O-OG 3.38Å; N100-S103 WeakPolarHBondContact O-CB 3.47Å; N100-S103 PolarHBondContact O-N 2.83Å; S103-S105 PolarHBondContact O-N 3.45Å; S103-S105 PolarHBondContact OG-N 2.94Å; S103-E106 WeakPolarHBondContact O-CB 3.15Å; S103-E106 PolarHBondContact O-N 3.42Å
104	T	85.1	Confident	91.6	Very high	128 Å²	128	63.4 Å²	63.4	79%	0.785	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.6	173.1	61.1	0	0	0	0	113.3	R97	R97-T104 PolarHBondContact NH1-OG1 2.9Å
105	S	89.3	Confident	91.7	Very high	17 Å²	17	67.3 Å²	67.3	12%	0.119	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	29.8	-178.7	-55.9	0	0	0	0	110.9	R97 F98 S103 I107	R97-S105 PolarHBondContact NE-OG 3.37Å; R97-S105 PolarHBondContact NH1-OG 3.24Å; R97-S105 PolarHBondContact NH2-OG 3.44Å; R97-S105 CarbonylContact O-C 3.58Å; F98-S105 WeakPolarHBondContact CA-O 3.24Å; F98-S105 VanDerWaalsContact CD1-O 3.24Å; F98-S105 WeakPolarHBondContact CD1-O 3.44Å; S103-S105 PolarHBondContact O-N 3.45Å; S103-S105 PolarHBondContact OG-N 2.94Å; S105-I107 PolarHBondContact O-N 2.83Å
106	E	92.9	Very high	91.8	Very high	61 Å²	61	66.6 Å²	66.6	29%	0.285	35%	0.348	S	S	.	.			trans	-61.9	122.1	177.4	-177.3	179.6	-178.7	0	0	110.8	F98 T101 S103 R114	F98-E106 CarbonylContact O-C 3.58Å; F98-E106 WeakPolarHBondContact O-CA 3.47Å; T101-E106 WeakPolarHBondContact CA-OE2 3.39Å; S103-E106 WeakPolarHBondContact O-CB 3.15Å; S103-E106 PolarHBondContact O-N 3.42Å; E106-R114 IonicContact OE1-CZ 3.26Å; E106-R114 IonicContact OE1-NH1 3.53Å; E106-R114 PolarHBondContact OE1-NH1 3.4Å; E106-R114 IonicContact OE1-NH2 3.02Å; E106-R114 PolarHBondContact OE1-NH2 2.94Å
107	I	95.3	Very high	92	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	32%	0.322	C	S	.	.			trans	-79.5	148.1	175.8	56.1	167.6	0	0	0	111.2	E67 F71 F98 L99 S105 I109 V136	E67-I107 HydrophobicContact CG-CG2 4.24Å; F71-I107 HydrophobicContact CB-CG2 3.89Å; F71-I107 HydrophobicContact CD1-CD1 3.62Å; F71-I107 HydrophobicContact CD2-CD1 3.81Å; F71-I107 HydrophobicContact CE1-CD1 3.48Å; F71-I107 VanDerWaalsContact CE1-CD1 3.48Å; F71-I107 HydrophobicContact CE2-CD1 3.69Å; F71-I107 HydrophobicContact CG-CD1 3.77Å; F71-I107 HydrophobicContact CG-CG2 4.12Å; F71-I107 HydrophobicContact CZ-CD1 3.53Å; F98-I107 HydrophobicContact CB-CG1 4.19Å; F98-I107 HydrophobicContact CB-CG2 4.28Å; F98-I107 HydrophobicContact CD1-CG2 3.96Å; F98-I107 VanDerWaalsContact O-CG1 3.29Å; F98-I107 WeakPolarHBondContact O-CG1 3.37Å; F98-I107 PolarHBondContact O-N 3.48Å; L99-I107 HydrophobicContact CD2-CD1 3.82Å; L99-I107 HydrophobicContact CD2-CG1 3.93Å; S105-I107 PolarHBondContact O-N 2.83Å; I107-I109 HydrophobicContact CD1-CG2 3.76Å; I107-I109 HydrophobicContact CG1-CG2 4.15Å; I107-I109 PolarHBondContact O-N 2.91Å; I107-V136 HydrophobicContact CB-CG2 4Å; I107-V136 HydrophobicContact CD1-CG2 3.54Å; I107-V136 HydrophobicContact CG1-CG2 4.3Å; I107-V136 HydrophobicContact CG2-CG2 4.32Å
108	N	94.5	Very high	92.1	Very high	117 Å²	117	61 Å²	61	63%	0.626	33%	0.328	S	S	*	.			trans	-83.6	98.8	176.9	-173.1	7.9	0	0	0	111.2	L139	N108-L139 HydrophobicContact CB-CD2 4Å
109	I	95.6	Very high	92.1	Very high	8 Å²	8	67.7 Å²	67.7	4%	0.041	36%	0.36	C	S	.	.			trans	-124.7	154.6	172.6	60.2	163.7	0	0	0	110.9	L99 I107 C113 R114 L117 A132 Q135 V136	L99-I109 HydrophobicContact CD2-CD1 3.49Å; L99-I109 VanDerWaalsContact CD2-CD1 3.49Å; L99-I109 HydrophobicContact CD2-CG1 4.3Å; I107-I109 HydrophobicContact CD1-CG2 3.76Å; I107-I109 HydrophobicContact CG1-CG2 4.15Å; I107-I109 PolarHBondContact O-N 2.91Å; I109-C113 HydrophobicContact CD1-CB 4.33Å; I109-R114 HydrophobicContact CD1-CB 4.08Å; I109-L117 HydrophobicContact CD1-CD1 3.72Å; I109-A132 HydrophobicContact CD1-CB 4.46Å; I109-A132 HydrophobicContact CG2-CB 4.22Å; I109-Q135 HydrophobicContact CG2-CB 4.24Å; I109-V136 HydrophobicContact CG2-CG2 4.11Å
110	D	95.8	Very high	92.3	Very high	70 Å²	70	71.7 Å²	71.7	37%	0.374	38%	0.378	S	S	.	.			trans	-67.7	158.1	179.7	79.4	47.1	0	0	0	113.1	K112 C113 R114 Q135	D110-K112 PolarHBondContact O-N 3.45Å; D110-K112 WeakPolarHBondContact OD1-CA 3.32Å; D110-K112 VanDerWaalsContact OD1-CB 3.3Å; D110-K112 WeakPolarHBondContact OD1-CB 3.32Å; D110-K112 PolarHBondContact OD1-N 2.64Å; D110-C113 PolarHBondContact O-N 3.31Å; D110-C113 PolarHBondContact OD1-N 2.72Å; D110-R114 PolarHBondContact O-N 3.44Å; D110-Q135 VanDerWaalsContact CG-NE2 3.34Å; D110-Q135 PolarHBondContact OD2-NE2 3.32Å; D110-Q135 PolarHBondContact OD2-OE1 2.7Å
111	I	94.7	Very high	92.6	Very high	130 Å²	130	69 Å²	69	67%	0.667	36%	0.363	S	S	*	.	H	α-helix	trans	-62.6	-30.6	-176.4	-62.2	169.2	0	0	0	111.7	N115	I111-N115 WeakPolarHBondContact O-CB 3.17Å; I111-N115 PolarHBondContact O-N 2.96Å; I111-N115 PolarHBondContact O-ND2 2.91Å
112	K	96.2	Very high	93.1	Very high	176 Å²	176	72.8 Å²	72.8	77%	0.765	37%	0.373	S	S	*	.	H	α-helix	trans	-70.5	-45.5	-179.8	-62.4	179.6	179.9	177.3	0	110.5	D110 N115 A116	D110-K112 PolarHBondContact O-N 3.45Å; D110-K112 WeakPolarHBondContact OD1-CA 3.32Å; D110-K112 VanDerWaalsContact OD1-CB 3.3Å; D110-K112 WeakPolarHBondContact OD1-CB 3.32Å; D110-K112 PolarHBondContact OD1-N 2.64Å; K112-N115 PolarHBondContact O-N 3.17Å; K112-A116 PolarHBondContact O-N 2.86Å
113	C	96.3	Very high	93.7	Very high	6 Å²	6	76.2 Å²	76.2	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-47.9	174.6	-179.2	0	0	0	0	110.7	I109 D110 N115 A116 L117 E131	I109-C113 HydrophobicContact CD1-CB 4.33Å; D110-C113 PolarHBondContact O-N 3.31Å; D110-C113 PolarHBondContact OD1-N 2.72Å; C113-N115 PolarHBondContact O-N 3.45Å; C113-A116 PolarHBondContact O-N 2.68Å; C113-L117 WeakPolarHBondContact O-CG 3.42Å; C113-L117 PolarHBondContact O-N 2.87Å; C113-E131 HydrophobicContact CB-CG 4.15Å
114	R	95.4	Very high	94.1	Very high	45 Å²	45	75.9 Å²	75.9	17%	0.17	37%	0.372	C	S	.	.	H	α-helix	trans	-57.8	-46.9	176.4	-170.8	179.4	-61.5	-140.8	5.4	112.4	T101 E106 I109 D110 A116 L117 N118	T101-R114 PolarHBondContact OG1-NH1 2.67Å; T101-R114 VanDerWaalsContact OG1-NH1 3.16Å; E106-R114 IonicContact OE1-CZ 3.26Å; E106-R114 IonicContact OE1-NH1 3.53Å; E106-R114 PolarHBondContact OE1-NH1 3.4Å; E106-R114 IonicContact OE1-NH2 3.02Å; E106-R114 PolarHBondContact OE1-NH2 2.94Å; I109-R114 HydrophobicContact CD1-CB 4.08Å; D110-R114 PolarHBondContact O-N 3.44Å; R114-A116 VanDerWaalsContact C-N 3.31Å; R114-A116 PolarHBondContact O-N 3.41Å; R114-L117 PolarHBondContact O-N 3.3Å; R114-N118 PolarHBondContact O-N 3.39Å; R114-N118 PolarHBondContact O-OD1 2.71Å
115	N	94.4	Very high	94.6	Very high	82 Å²	82	73.4 Å²	73.4	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-36	179.2	-73.7	-21.1	0	0	0	112.8	I111 K112 C113	I111-N115 WeakPolarHBondContact O-CB 3.17Å; I111-N115 PolarHBondContact O-N 2.96Å; I111-N115 PolarHBondContact O-ND2 2.91Å; K112-N115 PolarHBondContact O-N 3.17Å; C113-N115 PolarHBondContact O-N 3.45Å
116	A	95.4	Very high	94.9	Very high	40 Å²	40	77.7 Å²	77.7	33%	0.331	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-48.1	174	0	0	0	0	0	111.1	K112 C113 R114 N118 Q119 E120	K112-A116 PolarHBondContact O-N 2.86Å; C113-A116 PolarHBondContact O-N 2.68Å; R114-A116 VanDerWaalsContact C-N 3.31Å; R114-A116 PolarHBondContact O-N 3.41Å; A116-N118 VanDerWaalsContact C-N 3.32Å; A116-N118 PolarHBondContact O-N 3.17Å; A116-Q119 WeakPolarHBondContact O-CB 3.28Å; A116-Q119 PolarHBondContact O-N 3.21Å; A116-E120 WeakPolarHBondContact O-CG 3.24Å; A116-E120 PolarHBondContact O-N 3.29Å
117	L	96	Very high	95	Very high	5 Å²	5	79.7 Å²	79.7	3%	0.026	38%	0.382	C	S	.	.	H	α-helix	trans	-56.3	-44.6	176.9	-72	162.6	0	0	0	111.7	L99 I109 C113 R114 Q119 E120 M121 T128 F129 A132	L99-L117 HydrophobicContact CD1-CB 4.38Å; L99-L117 HydrophobicContact CD1-CD1 3.69Å; L99-L117 HydrophobicContact CD1-CD2 4.45Å; L99-L117 HydrophobicContact CD1-CG 4.39Å; L99-L117 HydrophobicContact CD2-CD1 4.02Å; I109-L117 HydrophobicContact CD1-CD1 3.72Å; C113-L117 WeakPolarHBondContact O-CG 3.42Å; C113-L117 PolarHBondContact O-N 2.87Å; R114-L117 PolarHBondContact O-N 3.3Å; L117-Q119 PolarHBondContact O-N 3.22Å; L117-Q119 VanDerWaalsContact O-N 3.08Å; L117-E120 PolarHBondContact O-N 2.93Å; L117-E120 VanDerWaalsContact O-N 3.09Å; L117-M121 WeakPolarHBondContact O-CB 3.43Å; L117-M121 VanDerWaalsContact O-CG 3.23Å; L117-M121 WeakPolarHBondContact O-CG 3.31Å; L117-M121 PolarHBondContact O-N 3.24Å; L117-T128 HydrophobicContact CD2-CG2 3.97Å; L117-T128 WeakPolarHBondContact CD2-O 3.43Å; L117-F129 HydrophobicContact CD2-CD1 3.69Å; L117-F129 HydrophobicContact CD2-CE1 4.04Å; L117-A132 HydrophobicContact CD1-CB 3.91Å
118	N	93.6	Very high	95.1	Very high	62 Å²	62	79.9 Å²	79.9	33%	0.332	38%	0.384	S	S	.	.	H	α-helix	trans	-55.8	-30.5	177.5	-64.5	-3.4	0	0	0	113.1	Y95 R114 A116	Y95-N118 VanDerWaalsContact CE2-OD1 3.3Å; Y95-N118 WeakPolarHBondContact CE2-OD1 3.37Å; Y95-N118 PolarHBondContact OH-OD1 2.85Å; R114-N118 PolarHBondContact O-N 3.39Å; R114-N118 PolarHBondContact O-OD1 2.71Å; A116-N118 VanDerWaalsContact C-N 3.32Å; A116-N118 PolarHBondContact O-N 3.17Å
119	Q	94.2	Very high	95.2	Very high	143 Å²	143	74.4 Å²	74.4	67%	0.668	35%	0.354	S	S	*	.	H	α-helix	trans	-82.7	-43	176.9	-62.5	178.8	17.2	0	0	111.6	A116 L117 M121 K122	A116-Q119 WeakPolarHBondContact O-CB 3.28Å; A116-Q119 PolarHBondContact O-N 3.21Å; L117-Q119 PolarHBondContact O-N 3.22Å; L117-Q119 VanDerWaalsContact O-N 3.08Å; Q119-M121 VanDerWaalsContact C-N 3.32Å; Q119-M121 PolarHBondContact O-N 3.39Å; Q119-K122 PolarHBondContact O-N 3.47Å
120	E	94.5	Very high	95.3	Very high	85 Å²	85	77.1 Å²	77.1	40%	0.397	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-29	-178.6	-68.9	-176.9	-166.5	0	0	113.1	A116 L117 K122 R123 T128	A116-E120 WeakPolarHBondContact O-CG 3.24Å; A116-E120 PolarHBondContact O-N 3.29Å; L117-E120 PolarHBondContact O-N 2.93Å; L117-E120 VanDerWaalsContact O-N 3.09Å; E120-K122 PolarHBondContact O-N 3Å; E120-R123 CarbonylContact O-C 3.51Å; E120-R123 PolarHBondContact O-N 3.3Å; E120-T128 HydrophobicContact CB-CG2 4.05Å; E120-T128 WeakPolarHBondContact OE2-CA 3.38Å
121	M	94.9	Very high	95.4	Very high	14 Å²	14	77.4 Å²	77.4	7%	0.069	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-13.8	178.4	-76.6	-43.8	-60.8	0	0	114.8	A91 Q92 Y95 L117 Q119 R123 T128 F129	A91-M121 VanDerWaalsContact C-CE 3.41Å; A91-M121 HydrophobicContact CB-CE 3.81Å; A91-M121 HydrophobicContact CB-SD 4.46Å; A91-M121 WeakPolarHBondContact O-CE 3.43Å; Q92-M121 PolarHBondContact NE2-O 3.16Å; Q92-M121 VanDerWaalsContact NE2-O 3.17Å; Y95-M121 HydrophobicContact CD2-CG 3.31Å; Y95-M121 HydrophobicContact CD2-SD 3.94Å; Y95-M121 HydrophobicContact CE2-CG 3.77Å; Y95-M121 HydrophobicContact CG-CE 4.28Å; Y95-M121 HydrophobicContact CG-CG 3.83Å; Y95-M121 HydrophobicContact CG-SD 4.21Å; L117-M121 WeakPolarHBondContact O-CB 3.43Å; L117-M121 VanDerWaalsContact O-CG 3.23Å; L117-M121 WeakPolarHBondContact O-CG 3.31Å; L117-M121 PolarHBondContact O-N 3.24Å; Q119-M121 VanDerWaalsContact C-N 3.32Å; Q119-M121 PolarHBondContact O-N 3.39Å; M121-R123 VanDerWaalsContact C-N 3.28Å; M121-T128 HydrophobicContact SD-CG2 4.19Å; M121-F129 HydrophobicContact SD-CE1 4.12Å; M121-F129 HydrophobicContact SD-CZ 3.89Å
122	K	93	Very high	95.5	Very high	167 Å²	167	71.3 Å²	71.3	73%	0.726	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-31.6	170.9	-64.8	179	-177.6	176.6	0	112.1	Q119 E120	Q119-K122 PolarHBondContact O-N 3.47Å; E120-K122 PolarHBondContact O-N 3Å
123	R	94.6	Very high	95.6	Very high	220 Å²	220	63.6 Å²	63.6	83%	0.83	30%	0.304	S	S	*	.	S	Bend	trans	-148.3	71.1	-178.3	-73.5	-173	152.8	-168.7	-8	109.4	E120 M121	E120-R123 CarbonylContact O-C 3.51Å; E120-R123 PolarHBondContact O-N 3.3Å; M121-R123 VanDerWaalsContact C-N 3.28Å
124	P	95.5	Very high	95.7	Very high	17 Å²	17	69.4 Å²	69.4	11%	0.11	33%	0.325	C	S	.	.			trans	-60.8	146.4	-179.2	26.6	-35.6	0	0	0	111.3	L87 Y88 A91 T128	L87-P124 HydrophobicContact CD2-CB 4.18Å; L87-P124 HydrophobicContact CD2-CG 4.29Å; L87-P124 WeakPolarHBondContact CD2-O 3.43Å; Y88-P124 HydrophobicContact CD2-CG 3.6Å; Y88-P124 HydrophobicContact CE2-CG 4.25Å; Y88-P124 HydrophobicContact CG-CG 4.35Å; A91-P124 HydrophobicContact CB-CB 3.46Å; A91-P124 VanDerWaalsContact CB-CB 3.46Å; A91-P124 HydrophobicContact CB-CG 3.73Å; P124-T128 WeakPolarHBondContact CA-OG1 3.44Å
125	T	95.3	Very high	95.8	Very high	76 Å²	76	68.5 Å²	68.5	47%	0.466	32%	0.323	S	S	.	.			trans	-127	169.7	175.3	72.8	0	0	0	0	108.7	Y78 N127 T128	Y78-T125 WeakPolarHBondContact CE1-O 3.21Å; Y78-T125 PolarHBondContact OH-O 3.16Å; T125-N127 PolarHBondContact O-N 2.86Å; T125-N127 PolarHBondContact OG1-N 2.81Å; T125-T128 PolarHBondContact N-OG1 3.49Å; T125-T128 WeakPolarHBondContact O-CB 3.31Å; T125-T128 PolarHBondContact O-N 3.42Å; T125-T128 PolarHBondContact O-OG1 3.4Å; T125-T128 PolarHBondContact OG1-OG1 3.39Å
126	R	94.9	Very high	96	Very high	107 Å²	107	64.6 Å²	64.6	40%	0.404	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-19.5	176	-65.3	-179.2	-176.9	-175.9	15.4	113.7	R79 L81 L87	R79-R126 WeakPolarHBondContact CG-O 3.49Å; R79-R126 PolarHBondContact NH1-O 3.34Å; R79-R126 WeakPolarHBondContact O-CD 3.43Å; L81-R126 VanDerWaalsContact O-CZ 3.23Å; L81-R126 PolarHBondContact O-NE 2.97Å; L81-R126 PolarHBondContact O-NH2 3.17Å; L87-R126 HydrophobicContact CD1-CB 4.47Å; L87-R126 HydrophobicContact CD1-CG 3.48Å; L87-R126 VanDerWaalsContact CD1-CG 3.48Å
127	N	95.8	Very high	96.1	Very high	102 Å²	102	64.6 Å²	64.6	55%	0.545	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	4.4	-177.2	-57.9	-10.3	0	0	0	113.6	T125 F129 D130	T125-N127 PolarHBondContact O-N 2.86Å; T125-N127 PolarHBondContact OG1-N 2.81Å; N127-F129 PolarHBondContact O-N 3.33Å; N127-D130 VanDerWaalsContact C-OD1 3.25Å; N127-D130 WeakPolarHBondContact CA-OD1 3.4Å; N127-D130 PolarHBondContact O-N 3.17Å
128	T	96.5	Very high	96.2	Very high	6 Å²	6	68.9 Å²	68.9	4%	0.037	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.1	-174.7	-74.1	0	0	0	0	112.8	L117 E120 M121 P124 T125	L117-T128 HydrophobicContact CD2-CG2 3.97Å; L117-T128 WeakPolarHBondContact CD2-O 3.43Å; E120-T128 HydrophobicContact CB-CG2 4.05Å; E120-T128 WeakPolarHBondContact OE2-CA 3.38Å; M121-T128 HydrophobicContact SD-CG2 4.19Å; P124-T128 WeakPolarHBondContact CA-OG1 3.44Å; T125-T128 PolarHBondContact N-OG1 3.49Å; T125-T128 WeakPolarHBondContact O-CB 3.31Å; T125-T128 PolarHBondContact O-N 3.42Å; T125-T128 PolarHBondContact O-OG1 3.4Å; T125-T128 PolarHBondContact OG1-OG1 3.39Å
129	F	97.1	Very high	96.4	Very high	1 Å²	1	68.6 Å²	68.6	0%	0.004	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	9.8	-175.8	-56.5	-70.7	0	0	0	114.3	F71 I75 Y78 A91 I94 L99 L117 M121 N127 E131 A132 Q133	F71-F129 HydrophobicContact CZ-CB 4.37Å; I75-F129 HydrophobicContact CD1-CB 3.48Å; I75-F129 VanDerWaalsContact CD1-CB 3.48Å; I75-F129 HydrophobicContact CD1-CD1 4.35Å; I75-F129 HydrophobicContact CD1-CD2 3.54Å; I75-F129 HydrophobicContact CD1-CE2 4.36Å; I75-F129 HydrophobicContact CD1-CG 3.53Å; I75-F129 HydrophobicContact CG1-CB 3.85Å; I75-F129 HydrophobicContact CG1-CG 4.43Å; I75-F129 HydrophobicContact CG2-CB 4.08Å; Y78-F129 AromaticContact CD1-CD2 3.9Å; Y78-F129 HydrophobicContact CD1-CD2 3.9Å; Y78-F129 HydrophobicContact CD1-CE2 4.32Å; Y78-F129 AromaticContact CE1-CD2 3.63Å; Y78-F129 HydrophobicContact CE1-CD2 3.63Å; Y78-F129 AromaticContact CE1-CE2 3.9Å; Y78-F129 HydrophobicContact CE1-CE2 3.9Å; Y78-F129 HydrophobicContact CE2-CE2 4.09Å; Y78-F129 HydrophobicContact CG-CD2 4.49Å; Y78-F129 AromaticContact CZ-CE2 3.76Å; A91-F129 HydrophobicContact CB-CE2 3.94Å; A91-F129 HydrophobicContact CB-CZ 4Å; I94-F129 HydrophobicContact CB-CE1 4.45Å; I94-F129 HydrophobicContact CB-CE2 4.22Å; I94-F129 HydrophobicContact CB-CZ 3.93Å; I94-F129 HydrophobicContact CD1-CD2 4.31Å; I94-F129 HydrophobicContact CD1-CE2 3.86Å; I94-F129 HydrophobicContact CD1-CZ 4.44Å; I94-F129 HydrophobicContact CG2-CD1 4.11Å; I94-F129 HydrophobicContact CG2-CD2 4.38Å; I94-F129 HydrophobicContact CG2-CE1 3.71Å; I94-F129 HydrophobicContact CG2-CE2 3.99Å; I94-F129 HydrophobicContact CG2-CG 4.44Å; I94-F129 HydrophobicContact CG2-CZ 3.64Å; L99-F129 HydrophobicContact CD1-CD1 4.18Å; L99-F129 HydrophobicContact CD1-CE1 3.81Å; L117-F129 HydrophobicContact CD2-CD1 3.69Å; L117-F129 HydrophobicContact CD2-CE1 4.04Å; M121-F129 HydrophobicContact SD-CE1 4.12Å; M121-F129 HydrophobicContact SD-CZ 3.89Å; N127-F129 PolarHBondContact O-N 3.33Å; F129-E131 PolarHBondContact O-N 3.38Å; F129-A132 PolarHBondContact O-N 2.57Å; F129-Q133 VanDerWaalsContact O-CB 3.29Å; F129-Q133 WeakPolarHBondContact O-CB 3.48Å; F129-Q133 PolarHBondContact O-N 2.97Å
130	D	97.2	Very high	96.5	Very high	65 Å²	65	61.9 Å²	61.9	35%	0.348	28%	0.279	S	S	.	.	H	α-helix	trans	-54.5	-51.2	-175	-71.3	18.3	0	0	0	112.7	R79 N127 Q133 R134	R79-D130 IonicContact CZ-OD1 3.51Å; R79-D130 IonicContact NH1-OD1 3.31Å; R79-D130 PolarHBondContact NH1-OD1 2.87Å; R79-D130 IonicContact NH1-OD2 3.3Å; R79-D130 IonicContact NH2-OD1 3.33Å; R79-D130 PolarHBondContact NH2-OD1 2.96Å; N127-D130 VanDerWaalsContact C-OD1 3.25Å; N127-D130 WeakPolarHBondContact CA-OD1 3.4Å; N127-D130 PolarHBondContact O-N 3.17Å; D130-Q133 PolarHBondContact O-N 2.91Å; D130-R134 VanDerWaalsContact O-CB 3.3Å; D130-R134 WeakPolarHBondContact O-CB 3.29Å; D130-R134 PolarHBondContact O-N 3.32Å
131	E	97.6	Very high	96.7	Very high	77 Å²	77	60.1 Å²	60.1	36%	0.36	27%	0.27	S	S	.	.	H	α-helix	trans	-68.5	-40.9	-176.5	177.7	52.7	-157.5	0	0	111.3	C113 F129 R134 Q135	C113-E131 HydrophobicContact CB-CG 4.15Å; F129-E131 PolarHBondContact O-N 3.38Å; E131-R134 PolarHBondContact O-N 2.92Å; E131-R134 IonicContact OE1-CZ 3.69Å; E131-R134 IonicContact OE1-NE 2.64Å; E131-R134 IonicContact OE1-NH2 3.04Å; E131-R134 PolarHBondContact OE1-NH2 2.82Å; E131-R134 IonicContact OE2-CZ 3.66Å; E131-R134 IonicContact OE2-NE 3.75Å; E131-R134 PolarHBondContact OE2-NE 2.85Å; E131-R134 IonicContact OE2-NH2 2.64Å; E131-R134 PolarHBondContact OE2-NH2 2.81Å; E131-R134 VanDerWaalsContact OE2-NH2 3.09Å; E131-Q135 WeakPolarHBondContact O-CG 3.26Å; E131-Q135 PolarHBondContact O-N 3.39Å; E131-Q135 PolarHBondContact OE1-NE2 2.91Å
132	A	97.7	Very high	96.8	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-63.8	-46.6	175.1	0	0	0	0	0	111.8	F71 I109 L117 F129 R134 Q135 V136	F71-A132 HydrophobicContact CE1-CB 4.02Å; F71-A132 HydrophobicContact CZ-CB 3.72Å; I109-A132 HydrophobicContact CD1-CB 4.46Å; I109-A132 HydrophobicContact CG2-CB 4.22Å; L117-A132 HydrophobicContact CD1-CB 3.91Å; F129-A132 PolarHBondContact O-N 2.57Å; A132-R134 VanDerWaalsContact C-N 3.27Å; A132-R134 PolarHBondContact O-N 2.6Å; A132-Q135 PolarHBondContact O-N 3Å; A132-Q135 VanDerWaalsContact O-N 3.13Å; A132-V136 WeakPolarHBondContact O-CG2 3.21Å; A132-V136 PolarHBondContact O-N 3.38Å
133	Q	97.7	Very high	97	Very high	15 Å²	15	64.5 Å²	64.5	7%	0.07	29%	0.287	C	S	.	.	H	α-helix	trans	-60.4	-39.9	178	-167.7	-171.6	21	0	0	111	F71 W72 I75 E76 F129 D130 V136 Y137	F71-Q133 HydrophobicContact CE1-CB 4.32Å; W72-Q133 VanDerWaalsContact CD1-CG 3.48Å; W72-Q133 HydrophobicContact CG-CG 4.25Å; W72-Q133 PolarHBondContact O-NE2 3.19Å; I75-Q133 HydrophobicContact CB-CB 4.45Å; I75-Q133 HydrophobicContact CB-CG 4.12Å; I75-Q133 HydrophobicContact CG1-CB 4.4Å; I75-Q133 HydrophobicContact CG1-CG 4.44Å; I75-Q133 HydrophobicContact CG2-CB 4.15Å; I75-Q133 VanDerWaalsContact CG2-CD 3.41Å; I75-Q133 HydrophobicContact CG2-CG 4.1Å; I75-Q133 VanDerWaalsContact CG2-OE1 3.24Å; E76-Q133 PolarHBondContact OE1-NE2 3.5Å; F129-Q133 VanDerWaalsContact O-CB 3.29Å; F129-Q133 WeakPolarHBondContact O-CB 3.48Å; F129-Q133 PolarHBondContact O-N 2.97Å; D130-Q133 PolarHBondContact O-N 2.91Å; Q133-V136 PolarHBondContact O-N 3.2Å; Q133-Y137 VanDerWaalsContact O-CB 3.25Å; Q133-Y137 WeakPolarHBondContact O-CB 3.42Å; Q133-Y137 PolarHBondContact O-N 3.32Å
134	R	98	Very high	97.1	Very high	127 Å²	127	54.3 Å²	54.3	48%	0.479	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-41.8	174.9	-169.8	-167.7	66.3	69.4	-4	112.1	D130 E131 A132 K138	D130-R134 VanDerWaalsContact O-CB 3.3Å; D130-R134 WeakPolarHBondContact O-CB 3.29Å; D130-R134 PolarHBondContact O-N 3.32Å; E131-R134 PolarHBondContact O-N 2.92Å; E131-R134 IonicContact OE1-CZ 3.69Å; E131-R134 IonicContact OE1-NE 2.64Å; E131-R134 IonicContact OE1-NH2 3.04Å; E131-R134 PolarHBondContact OE1-NH2 2.82Å; E131-R134 IonicContact OE2-CZ 3.66Å; E131-R134 IonicContact OE2-NE 3.75Å; E131-R134 PolarHBondContact OE2-NE 2.85Å; E131-R134 IonicContact OE2-NH2 2.64Å; E131-R134 PolarHBondContact OE2-NH2 2.81Å; E131-R134 VanDerWaalsContact OE2-NH2 3.09Å; A132-R134 VanDerWaalsContact C-N 3.27Å; A132-R134 PolarHBondContact O-N 2.6Å; R134-K138 WeakPolarHBondContact O-CG 3.42Å; R134-K138 PolarHBondContact O-N 3.01Å; R134-K138 VanDerWaalsContact O-N 3.09Å
135	Q	98.3	Very high	97.2	Very high	27 Å²	27	54.3 Å²	54.3	13%	0.126	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-46.4	176.8	-70.9	-169.1	28	0	0	111.8	I109 D110 E131 A132 K138 L139	I109-Q135 HydrophobicContact CG2-CB 4.24Å; D110-Q135 VanDerWaalsContact CG-NE2 3.34Å; D110-Q135 PolarHBondContact OD2-NE2 3.32Å; D110-Q135 PolarHBondContact OD2-OE1 2.7Å; E131-Q135 WeakPolarHBondContact O-CG 3.26Å; E131-Q135 PolarHBondContact O-N 3.39Å; E131-Q135 PolarHBondContact OE1-NE2 2.91Å; A132-Q135 PolarHBondContact O-N 3Å; A132-Q135 VanDerWaalsContact O-N 3.13Å; Q135-K138 PolarHBondContact O-N 3.39Å; Q135-K138 VanDerWaalsContact O-N 3.17Å; Q135-L139 PolarHBondContact O-N 2.8Å
136	V	97.5	Very high	97.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-41	177.7	176.3	0	0	0	0	111.7	N68 F71 I107 I109 A132 Q133 K138 L139 M140	N68-V136 HydrophobicContact CB-CG1 3.77Å; N68-V136 VanDerWaalsContact O-CG1 3.26Å; N68-V136 WeakPolarHBondContact O-CG1 3.32Å; F71-V136 HydrophobicContact CD1-CB 4.08Å; F71-V136 HydrophobicContact CD1-CG1 4.2Å; F71-V136 HydrophobicContact CD1-CG2 3.79Å; F71-V136 HydrophobicContact CE1-CB 4.43Å; F71-V136 HydrophobicContact CE1-CG2 3.99Å; I107-V136 HydrophobicContact CB-CG2 4Å; I107-V136 HydrophobicContact CD1-CG2 3.54Å; I107-V136 HydrophobicContact CG1-CG2 4.3Å; I107-V136 HydrophobicContact CG2-CG2 4.32Å; I109-V136 HydrophobicContact CG2-CG2 4.11Å; A132-V136 WeakPolarHBondContact O-CG2 3.21Å; A132-V136 PolarHBondContact O-N 3.38Å; Q133-V136 PolarHBondContact O-N 3.2Å; V136-K138 VanDerWaalsContact C-N 3.31Å; V136-K138 PolarHBondContact O-N 2.84Å; V136-L139 WeakPolarHBondContact O-CB 3.24Å; V136-L139 PolarHBondContact O-N 3.25Å; V136-M140 HydrophobicContact CG1-CE 4.15Å; V136-M140 WeakPolarHBondContact O-CG 3.48Å; V136-M140 PolarHBondContact O-N 3.4Å
137	Y	98.2	Very high	97.5	Very high	40 Å²	40	51.7 Å²	51.7	16%	0.157	23%	0.233	C	C	.	.	H	α-helix	trans	-55.2	-47.8	171.7	176.5	-80	0	0	0	110.9	F43 S44 L47 W72 Q133 L139 M140 E141	F43-Y137 HydrophobicContact CD1-CD1 4.4Å; F43-Y137 HydrophobicContact CD1-CD2 4.07Å; F43-Y137 AromaticContact CD1-CE1 3.88Å; F43-Y137 HydrophobicContact CD1-CE1 3.88Å; F43-Y137 AromaticContact CD1-CE2 3.54Å; F43-Y137 HydrophobicContact CD1-CE2 3.54Å; F43-Y137 HydrophobicContact CD1-CG 4.46Å; F43-Y137 AromaticContact CD1-CZ 3.41Å; F43-Y137 VanDerWaalsContact CD1-CZ 3.41Å; F43-Y137 HydrophobicContact CE1-CD1 4.48Å; F43-Y137 AromaticContact CE1-CD2 3.76Å; F43-Y137 HydrophobicContact CE1-CD2 3.76Å; F43-Y137 HydrophobicContact CE1-CE1 4.38Å; F43-Y137 AromaticContact CE1-CE2 3.69Å; F43-Y137 HydrophobicContact CE1-CE2 3.69Å; F43-Y137 HydrophobicContact CE1-CG 4.16Å; F43-Y137 AromaticContact CE1-CZ 3.99Å; S44-Y137 WeakPolarHBondContact CB-OH 3.47Å; S44-Y137 PolarHBondContact N-OH 3.36Å; L47-Y137 HydrophobicContact CD2-CD2 3.78Å; L47-Y137 HydrophobicContact CD2-CE2 3.82Å; W72-Y137 AromaticContact NE1-CD2 3.87Å; Q133-Y137 VanDerWaalsContact O-CB 3.25Å; Q133-Y137 WeakPolarHBondContact O-CB 3.42Å; Q133-Y137 PolarHBondContact O-N 3.32Å; Y137-L139 VanDerWaalsContact C-N 3.34Å; Y137-L139 PolarHBondContact O-N 3.12Å; Y137-M140 PolarHBondContact O-N 3.38Å; Y137-E141 HydrophobicContact CE1-CB 4.34Å; Y137-E141 VanDerWaalsContact O-CB 3.28Å; Y137-E141 WeakPolarHBondContact O-CB 3.12Å; Y137-E141 PolarHBondContact O-N 3.04Å; Y137-E141 PolarHBondContact OH-OE1 3.07Å
138	K	98.1	Very high	97.6	Very high	94 Å²	94	46.9 Å²	46.9	41%	0.409	21%	0.207	S	C	.	.	H	α-helix	trans	-69.6	-30.1	179.6	-72.3	-67.1	171.6	-167	0	113.3	R134 Q135 V136 E141 R142	R134-K138 WeakPolarHBondContact O-CG 3.42Å; R134-K138 PolarHBondContact O-N 3.01Å; R134-K138 VanDerWaalsContact O-N 3.09Å; Q135-K138 PolarHBondContact O-N 3.39Å; Q135-K138 VanDerWaalsContact O-N 3.17Å; V136-K138 VanDerWaalsContact C-N 3.31Å; V136-K138 PolarHBondContact O-N 2.84Å; K138-E141 VanDerWaalsContact CD-OE2 3.3Å; K138-E141 WeakPolarHBondContact CD-OE2 3.48Å; K138-E141 WeakPolarHBondContact CE-OE2 3.4Å; K138-E141 IonicContact NZ-OE2 2.61Å; K138-E141 PolarHBondContact NZ-OE2 2.64Å; K138-R142 WeakPolarHBondContact O-CB 3.45Å; K138-R142 WeakPolarHBondContact O-CG 3.36Å; K138-R142 PolarHBondContact O-N 2.8Å; K138-R142 VanDerWaalsContact O-N 3.15Å
139	L	97.1	Very high	97.6	Very high	57 Å²	57	47.9 Å²	47.9	30%	0.298	21%	0.212	S	C	.	.	H	α-helix	trans	-63.7	-55.2	172.2	177.5	63.8	0	0	0	110.1	N108 Q135 V136 Y137 E141 R142 D143	N108-L139 HydrophobicContact CB-CD2 4Å; Q135-L139 PolarHBondContact O-N 2.8Å; V136-L139 WeakPolarHBondContact O-CB 3.24Å; V136-L139 PolarHBondContact O-N 3.25Å; Y137-L139 VanDerWaalsContact C-N 3.34Å; Y137-L139 PolarHBondContact O-N 3.12Å; L139-E141 VanDerWaalsContact C-N 3.34Å; L139-E141 PolarHBondContact O-N 3.41Å; L139-R142 PolarHBondContact O-N 3.34Å; L139-D143 WeakPolarHBondContact O-CB 3.23Å; L139-D143 PolarHBondContact O-N 3.15Å
140	M	97.8	Very high	97.5	Very high	1 Å²	1	56 Å²	56	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-45.5	177.6	-68.3	-171.5	-66.3	0	0	111.8	F43 F56 L60 N68 I69 W72 V136 Y137 R142 D143 S144 Y145	F43-M140 HydrophobicContact CE1-CB 3.94Å; F43-M140 HydrophobicContact CE1-CE 4.39Å; F43-M140 HydrophobicContact CZ-CB 3.63Å; F43-M140 HydrophobicContact CZ-CE 4.06Å; F43-M140 HydrophobicContact CZ-SD 4.42Å; F56-M140 HydrophobicContact CE1-CB 4.2Å; F56-M140 HydrophobicContact CE1-CG 4.45Å; F56-M140 HydrophobicContact CE1-SD 3.93Å; F56-M140 HydrophobicContact CZ-CB 4.21Å; L60-M140 HydrophobicContact CD1-SD 4.1Å; N68-M140 HydrophobicContact CB-CG 3.67Å; N68-M140 HydrophobicContact CB-SD 3.71Å; I69-M140 HydrophobicContact CB-SD 3.95Å; W72-M140 HydrophobicContact CB-CE 3.88Å; W72-M140 HydrophobicContact CG-CE 4.11Å; V136-M140 HydrophobicContact CG1-CE 4.15Å; V136-M140 WeakPolarHBondContact O-CG 3.48Å; V136-M140 PolarHBondContact O-N 3.4Å; Y137-M140 PolarHBondContact O-N 3.38Å; M140-R142 VanDerWaalsContact C-N 3.34Å; M140-R142 PolarHBondContact O-N 3.26Å; M140-D143 PolarHBondContact O-N 2.76Å; M140-S144 PolarHBondContact O-N 3.27Å; M140-Y145 VanDerWaalsContact O-CB 3.24Å; M140-Y145 WeakPolarHBondContact O-CB 3.31Å; M140-Y145 PolarHBondContact O-N 3.43Å
141	E	98.1	Very high	97.5	Very high	48 Å²	48	53.6 Å²	53.6	22%	0.224	23%	0.231	C	C	.	.	H	α-helix	trans	-60.7	-39.6	-179.2	-172.4	173	-125	0	0	112.8	F43 Y137 K138 L139 Y145 T146	F43-E141 HydrophobicContact CB-CB 4.4Å; F43-E141 HydrophobicContact CB-CG 3.85Å; F43-E141 HydrophobicContact CD1-CB 3.49Å; F43-E141 VanDerWaalsContact CD1-CB 3.49Å; F43-E141 HydrophobicContact CD1-CG 3.86Å; F43-E141 HydrophobicContact CE1-CB 4.04Å; F43-E141 HydrophobicContact CG-CB 4.11Å; F43-E141 HydrophobicContact CG-CG 4.13Å; Y137-E141 HydrophobicContact CE1-CB 4.34Å; Y137-E141 VanDerWaalsContact O-CB 3.28Å; Y137-E141 WeakPolarHBondContact O-CB 3.12Å; Y137-E141 PolarHBondContact O-N 3.04Å; Y137-E141 PolarHBondContact OH-OE1 3.07Å; K138-E141 VanDerWaalsContact CD-OE2 3.3Å; K138-E141 WeakPolarHBondContact CD-OE2 3.48Å; K138-E141 WeakPolarHBondContact CE-OE2 3.4Å; K138-E141 IonicContact NZ-OE2 2.61Å; K138-E141 PolarHBondContact NZ-OE2 2.64Å; L139-E141 VanDerWaalsContact C-N 3.34Å; L139-E141 PolarHBondContact O-N 3.41Å; E141-Y145 WeakPolarHBondContact O-CD1 3.18Å; E141-T146 VanDerWaalsContact O-CG2 3.3Å; E141-T146 WeakPolarHBondContact O-CG2 3.49Å
142	R	96.9	Very high	97.3	Very high	205 Å²	205	54 Å²	54	77%	0.774	24%	0.235	S	C	*	.	H	α-helix	trans	-86	-24.4	-175	-68.9	178.8	76	-171.2	3.8	113.2	K138 L139 M140 T146	K138-R142 WeakPolarHBondContact O-CB 3.45Å; K138-R142 WeakPolarHBondContact O-CG 3.36Å; K138-R142 PolarHBondContact O-N 2.8Å; K138-R142 VanDerWaalsContact O-N 3.15Å; L139-R142 PolarHBondContact O-N 3.34Å; M140-R142 VanDerWaalsContact C-N 3.34Å; M140-R142 PolarHBondContact O-N 3.26Å; R142-T146 WeakPolarHBondContact O-CG2 3.31Å
143	D	96.1	Very high	97.1	Very high	69 Å²	69	58.7 Å²	58.7	37%	0.369	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-90.2	-174	-165.1	50.4	0	0	0	110.6	L139 M140 Y145 T146 R147	L139-D143 WeakPolarHBondContact O-CB 3.23Å; L139-D143 PolarHBondContact O-N 3.15Å; M140-D143 PolarHBondContact O-N 2.76Å; D143-Y145 PolarHBondContact O-N 2.82Å; D143-T146 PolarHBondContact O-N 3.22Å; D143-T146 PolarHBondContact O-OG1 3.31Å; D143-R147 PolarHBondContact O-N 3.22Å; D143-R147 IonicContact OD1-CZ 3.76Å; D143-R147 IonicContact OD1-NH1 3.67Å; D143-R147 PolarHBondContact OD1-NH1 2.73Å; D143-R147 IonicContact OD1-NH2 2.72Å; D143-R147 IonicContact OD2-CZ 3.29Å; D143-R147 VanDerWaalsContact OD2-CZ 3.28Å; D143-R147 IonicContact OD2-NH1 2.68Å; D143-R147 PolarHBondContact OD2-NH1 3.2Å; D143-R147 IonicContact OD2-NH2 2.98Å; D143-R147 PolarHBondContact OD2-NH2 3.42Å
144	S	97.3	Very high	97.1	Very high	5 Å²	5	58 Å²	58	4%	0.035	25%	0.254	C	S	.	.	H	α-helix	trans	-59.1	-40	-171.2	-47.5	0	0	0	0	114	L60 M140 T146 R147 F148	L60-S144 WeakPolarHBondContact CD2-OG 3.33Å; M140-S144 PolarHBondContact O-N 3.27Å; S144-T146 VanDerWaalsContact C-N 3.3Å; S144-T146 PolarHBondContact O-N 2.97Å; S144-R147 PolarHBondContact O-N 3.33Å; S144-F148 WeakPolarHBondContact O-CB 3.42Å; S144-F148 PolarHBondContact O-N 3.1Å
145	Y	98.3	Very high	97	Very high	17 Å²	17	52.6 Å²	52.6	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-41.6	176.8	166.2	-109.3	0	0	0	111.7	W39 Q40 S42 F43 M46 M140 E141 D143 R147 F148 I149	W39-Y145 WeakPolarHBondContact O-CE2 3.48Å; W39-Y145 PolarHBondContact O-OH 3.49Å; Q40-Y145 PolarHBondContact O-OH 3.29Å; S42-Y145 PolarHBondContact N-OH 3.23Å; F43-Y145 HydrophobicContact CB-CD1 3.89Å; F43-Y145 HydrophobicContact CB-CD2 4.12Å; F43-Y145 HydrophobicContact CB-CE1 3.91Å; F43-Y145 HydrophobicContact CB-CE2 4.09Å; F43-Y145 HydrophobicContact CB-CG 3.99Å; F43-Y145 HydrophobicContact CD2-CD1 4.28Å; F43-Y145 AromaticContact CD2-CD2 3.42Å; F43-Y145 HydrophobicContact CD2-CD2 3.42Å; F43-Y145 VanDerWaalsContact CD2-CD2 3.42Å; F43-Y145 HydrophobicContact CD2-CE2 4.05Å; F43-Y145 AromaticContact CD2-CG 3.52Å; F43-Y145 HydrophobicContact CD2-CG 3.52Å; F43-Y145 HydrophobicContact CE2-CD2 4.24Å; F43-Y145 HydrophobicContact CE2-CG 4.3Å; F43-Y145 HydrophobicContact CG-CD1 4.29Å; F43-Y145 HydrophobicContact CG-CD2 4.15Å; F43-Y145 AromaticContact CG-CG 3.97Å; F43-Y145 HydrophobicContact CG-CG 3.97Å; F43-Y145 PolarHBondContact N-OH 3.36Å; M46-Y145 HydrophobicContact CE-CD2 3.65Å; M46-Y145 HydrophobicContact CE-CE2 4.15Å; M46-Y145 HydrophobicContact SD-CD2 4.04Å; M46-Y145 HydrophobicContact SD-CE2 4.06Å; M140-Y145 VanDerWaalsContact O-CB 3.24Å; M140-Y145 WeakPolarHBondContact O-CB 3.31Å; M140-Y145 PolarHBondContact O-N 3.43Å; E141-Y145 WeakPolarHBondContact O-CD1 3.18Å; D143-Y145 PolarHBondContact O-N 2.82Å; Y145-R147 VanDerWaalsContact C-N 3.26Å; Y145-R147 PolarHBondContact O-N 3.29Å; Y145-F148 PolarHBondContact O-N 3.23Å; Y145-I149 HydrophobicContact CD2-CG2 3.76Å; Y145-I149 HydrophobicContact CE1-CD1 4.1Å; Y145-I149 HydrophobicContact CE2-CG2 3.33Å; Y145-I149 WeakPolarHBondContact O-CG1 3.27Å; Y145-I149 PolarHBondContact O-N 3.37Å
146	T	97.5	Very high	96.8	Very high	39 Å²	39	54.5 Å²	54.5	24%	0.239	25%	0.248	C	C	.	.	H	α-helix	trans	-68.9	-27	-179.2	77.3	0	0	0	0	112.8	E141 R142 D143 S144 R150	E141-T146 VanDerWaalsContact O-CG2 3.3Å; E141-T146 WeakPolarHBondContact O-CG2 3.49Å; R142-T146 WeakPolarHBondContact O-CG2 3.31Å; D143-T146 PolarHBondContact O-N 3.22Å; D143-T146 PolarHBondContact O-OG1 3.31Å; S144-T146 VanDerWaalsContact C-N 3.3Å; S144-T146 PolarHBondContact O-N 2.97Å; T146-R150 WeakPolarHBondContact O-CD 3.14Å; T146-R150 WeakPolarHBondContact O-CG 3.46Å; T146-R150 PolarHBondContact O-NH1 2.88Å
147	R	97.7	Very high	96.6	Very high	90 Å²	90	55.8 Å²	55.8	34%	0.34	25%	0.253	S	S	.	.	H	α-helix	trans	-78.4	-46	171	-64	-166.3	-70.3	-91.5	-5.6	110.7	Y59 E63 D143 S144 Y145 I149 R150 S151	Y59-R147 HydrophobicContact CE1-CB 4.46Å; Y59-R147 WeakPolarHBondContact OH-CB 3.47Å; E63-R147 IonicContact OE1-CZ 3.74Å; E63-R147 IonicContact OE1-NE 3.43Å; E63-R147 PolarHBondContact OE1-NE 3.46Å; E63-R147 IonicContact OE1-NH2 3.77Å; E63-R147 IonicContact OE2-CZ 2.59Å; E63-R147 IonicContact OE2-NE 3.72Å; E63-R147 PolarHBondContact OE2-NE 3.43Å; E63-R147 IonicContact OE2-NH2 2.67Å; E63-R147 PolarHBondContact OE2-NH2 3.43Å; D143-R147 PolarHBondContact O-N 3.22Å; D143-R147 IonicContact OD1-CZ 3.76Å; D143-R147 IonicContact OD1-NH1 3.67Å; D143-R147 PolarHBondContact OD1-NH1 2.73Å; D143-R147 IonicContact OD1-NH2 2.72Å; D143-R147 IonicContact OD2-CZ 3.29Å; D143-R147 VanDerWaalsContact OD2-CZ 3.28Å; D143-R147 IonicContact OD2-NH1 2.68Å; D143-R147 PolarHBondContact OD2-NH1 3.2Å; D143-R147 IonicContact OD2-NH2 2.98Å; D143-R147 PolarHBondContact OD2-NH2 3.42Å; S144-R147 PolarHBondContact O-N 3.33Å; Y145-R147 VanDerWaalsContact C-N 3.26Å; Y145-R147 PolarHBondContact O-N 3.29Å; R147-I149 PolarHBondContact O-N 2.93Å; R147-R150 CarbonylContact O-C 3.59Å; R147-R150 WeakPolarHBondContact O-CA 3.37Å; R147-R150 PolarHBondContact O-N 3.26Å; R147-S151 PolarHBondContact O-N 3.25Å
148	F	98	Very high	96.5	Very high	1 Å²	1	54 Å²	54	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-53.3	-52.7	179.2	176.5	-119.3	0	0	0	112.5	M46 Q55 F56 Y59 S144 Y145 R150 S151 F154	M46-F148 HydrophobicContact CE-CD1 4.18Å; M46-F148 HydrophobicContact CE-CE1 4.39Å; M46-F148 HydrophobicContact SD-CD1 3.59Å; M46-F148 VanDerWaalsContact SD-CD1 3.59Å; M46-F148 HydrophobicContact SD-CE1 3.41Å; M46-F148 WeakPolarHBondContact SD-CE1 3.46Å; Q55-F148 HydrophobicContact CB-CZ 3.89Å; F56-F148 HydrophobicContact CB-CD1 4.49Å; F56-F148 HydrophobicContact CB-CE1 4.35Å; F56-F148 HydrophobicContact CD2-CB 3.89Å; F56-F148 AromaticContact CD2-CD1 3.69Å; F56-F148 HydrophobicContact CD2-CD1 3.69Å; F56-F148 HydrophobicContact CD2-CD2 4.48Å; F56-F148 HydrophobicContact CD2-CE1 4.35Å; F56-F148 AromaticContact CD2-CG 3.75Å; F56-F148 HydrophobicContact CD2-CG 3.75Å; F56-F148 HydrophobicContact CE2-CB 3.94Å; F56-F148 HydrophobicContact CE2-CD1 4.45Å; F56-F148 HydrophobicContact CE2-CG 4.32Å; Y59-F148 VanDerWaalsContact CB-CD2 3.46Å; Y59-F148 HydrophobicContact CD1-CB 3.67Å; Y59-F148 AromaticContact CD1-CD2 3.9Å; Y59-F148 HydrophobicContact CD1-CD2 3.9Å; Y59-F148 HydrophobicContact CD1-CG 4.13Å; Y59-F148 HydrophobicContact CD2-CB 4.44Å; Y59-F148 AromaticContact CD2-CD2 3.57Å; Y59-F148 HydrophobicContact CD2-CD2 3.57Å; Y59-F148 HydrophobicContact CD2-CE2 4.35Å; Y59-F148 HydrophobicContact CD2-CG 4.47Å; Y59-F148 HydrophobicContact CE1-CB 3.77Å; Y59-F148 HydrophobicContact CE2-CB 4.48Å; Y59-F148 HydrophobicContact CE2-CD2 4.26Å; Y59-F148 HydrophobicContact CG-CB 4.03Å; Y59-F148 AromaticContact CG-CD2 3.34Å; Y59-F148 HydrophobicContact CG-CD2 3.34Å; Y59-F148 HydrophobicContact CG-CE2 4.14Å; Y59-F148 HydrophobicContact CG-CG 4.04Å; S144-F148 WeakPolarHBondContact O-CB 3.42Å; S144-F148 PolarHBondContact O-N 3.1Å; Y145-F148 PolarHBondContact O-N 3.23Å; F148-R150 PolarHBondContact O-N 2.79Å; F148-S151 WeakPolarHBondContact O-CB 3.47Å; F148-S151 PolarHBondContact O-N 3.09Å; F148-S151 PolarHBondContact O-OG 3.28Å; F148-F154 HydrophobicContact CD1-CD2 4.35Å; F148-F154 HydrophobicContact CD2-CB 4.19Å; F148-F154 HydrophobicContact CE1-CB 4.32Å; F148-F154 AromaticContact CE1-CD2 3.52Å; F148-F154 HydrophobicContact CE1-CD2 3.52Å; F148-F154 HydrophobicContact CE1-CE2 4.18Å; F148-F154 HydrophobicContact CE1-CG 4.12Å; F148-F154 HydrophobicContact CE2-CB 3.89Å; F148-F154 HydrophobicContact CE2-CD2 4.31Å; F148-F154 HydrophobicContact CZ-CB 3.96Å; F148-F154 AromaticContact CZ-CD2 3.52Å; F148-F154 HydrophobicContact CZ-CD2 3.52Å; F148-F154 HydrophobicContact CZ-CE2 4.46Å; F148-F154 HydrophobicContact CZ-CG 4.11Å; F148-F154 WeakPolarHBondContact O-CB 3.26Å
149	I	97.4	Very high	96.3	Very high	26 Å²	26	49.7 Å²	49.7	13%	0.133	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-15.5	-178.3	65.4	178.9	0	0	0	113.8	Q40 Y145 R147 F154	Q40-I149 HydrophobicContact CG-CB 4.43Å; Y145-I149 HydrophobicContact CD2-CG2 3.76Å; Y145-I149 HydrophobicContact CE1-CD1 4.1Å; Y145-I149 HydrophobicContact CE2-CG2 3.33Å; Y145-I149 WeakPolarHBondContact O-CG1 3.27Å; Y145-I149 PolarHBondContact O-N 3.37Å; R147-I149 PolarHBondContact O-N 2.93Å; I149-F154 HydrophobicContact CB-CD1 4.32Å; I149-F154 HydrophobicContact CB-CE1 4.48Å; I149-F154 WeakPolarHBondContact O-CD1 3.38Å
150	R	95.6	Very high	96	Very high	172 Å²	172	49 Å²	49	65%	0.649	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	-12.8	175.2	-63.6	-177.2	-176.4	113.2	-5.3	112.9	T146 R147 F148 R185	T146-R150 WeakPolarHBondContact O-CD 3.14Å; T146-R150 WeakPolarHBondContact O-CG 3.46Å; T146-R150 PolarHBondContact O-NH1 2.88Å; R147-R150 CarbonylContact O-C 3.59Å; R147-R150 WeakPolarHBondContact O-CA 3.37Å; R147-R150 PolarHBondContact O-N 3.26Å; F148-R150 PolarHBondContact O-N 2.79Å; R150-R185 PolarHBondContact O-NH2 3.46Å
151	S	96.3	Very high	95.7	Very high	14 Å²	14	50.3 Å²	50.3	10%	0.098	23%	0.231	C	C	.	.	S	Bend	trans	-64.5	168	-176.1	76.3	0	0	0	0	112.2	R147 F148 E153 F154 F155 R185	R147-S151 PolarHBondContact O-N 3.25Å; F148-S151 WeakPolarHBondContact O-CB 3.47Å; F148-S151 PolarHBondContact O-N 3.09Å; F148-S151 PolarHBondContact O-OG 3.28Å; S151-E153 WeakPolarHBondContact CB-OE2 3.29Å; S151-E153 PolarHBondContact OG-OE2 3.42Å; S151-F154 PolarHBondContact OG-N 3.36Å; S151-F154 VanDerWaalsContact OG-N 3.12Å; S151-F155 PolarHBondContact O-N 2.89Å; S151-R185 PolarHBondContact O-NH2 3.42Å
152	N	94.4	Very high	95.5	Very high	85 Å²	85	48.6 Å²	48.6	46%	0.455	22%	0.224	S	C	.	.	H	α-helix	trans	-80.7	-26.6	174.9	-78.6	-15.8	0	0	0	111.3	F155 T156 R185	N152-F155 PolarHBondContact O-N 3.12Å; N152-T156 VanDerWaalsContact O-CB 3.29Å; N152-T156 WeakPolarHBondContact O-CB 3.41Å; N152-T156 PolarHBondContact O-N 2.92Å; N152-T156 PolarHBondContact O-OG1 2.9Å; N152-R185 PolarHBondContact OD1-NH2 3.45Å
153	E	93.9	Very high	95.2	Very high	100 Å²	100	41.8 Å²	41.8	47%	0.467	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-52.8	175.5	-65.3	80.9	171.5	0	0	109.8	S151 F155 T156 F157	S151-E153 WeakPolarHBondContact CB-OE2 3.29Å; S151-E153 PolarHBondContact OG-OE2 3.42Å; E153-F155 VanDerWaalsContact C-N 3.35Å; E153-F155 PolarHBondContact O-N 3.17Å; E153-T156 PolarHBondContact O-N 3.14Å; E153-F157 WeakPolarHBondContact O-CB 3.45Å; E153-F157 PolarHBondContact O-N 2.92Å
154	F	96.7	Very high	94.9	Very high	1 Å²	1	41 Å²	41	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-36.1	177.5	-174.8	-109.3	0	0	0	112.6	A36 W39 Q40 F148 I149 S151 F157 L158	A36-F154 WeakPolarHBondContact O-CZ 3.43Å; W39-F154 HydrophobicContact CB-CZ 4.39Å; W39-F154 AromaticContact CE3-CE2 3.88Å; W39-F154 HydrophobicContact CE3-CE2 3.88Å; W39-F154 HydrophobicContact CZ3-CE2 4.5Å; Q40-F154 HydrophobicContact CG-CD1 4.46Å; Q40-F154 HydrophobicContact CG-CE1 3.42Å; Q40-F154 VanDerWaalsContact CG-CE1 3.42Å; Q40-F154 HydrophobicContact CG-CZ 3.98Å; F148-F154 HydrophobicContact CD1-CD2 4.35Å; F148-F154 HydrophobicContact CD2-CB 4.19Å; F148-F154 HydrophobicContact CE1-CB 4.32Å; F148-F154 AromaticContact CE1-CD2 3.52Å; F148-F154 HydrophobicContact CE1-CD2 3.52Å; F148-F154 HydrophobicContact CE1-CE2 4.18Å; F148-F154 HydrophobicContact CE1-CG 4.12Å; F148-F154 HydrophobicContact CE2-CB 3.89Å; F148-F154 HydrophobicContact CE2-CD2 4.31Å; F148-F154 HydrophobicContact CZ-CB 3.96Å; F148-F154 AromaticContact CZ-CD2 3.52Å; F148-F154 HydrophobicContact CZ-CD2 3.52Å; F148-F154 HydrophobicContact CZ-CE2 4.46Å; F148-F154 HydrophobicContact CZ-CG 4.11Å; F148-F154 WeakPolarHBondContact O-CB 3.26Å; I149-F154 HydrophobicContact CB-CD1 4.32Å; I149-F154 HydrophobicContact CB-CE1 4.48Å; I149-F154 WeakPolarHBondContact O-CD1 3.38Å; S151-F154 PolarHBondContact OG-N 3.36Å; S151-F154 VanDerWaalsContact OG-N 3.12Å; F154-F157 WeakPolarHBondContact O-CB 3.46Å; F154-F157 PolarHBondContact O-N 3Å; F154-L158 HydrophobicContact CD1-CD1 4.06Å; F154-L158 HydrophobicContact CD1-CG 4.33Å; F154-L158 HydrophobicContact CE1-CD1 3.54Å; F154-L158 HydrophobicContact CE1-CD2 4.24Å; F154-L158 HydrophobicContact CE1-CG 3.85Å; F154-L158 HydrophobicContact CE2-CD2 4.48Å; F154-L158 HydrophobicContact CE2-CG 4.47Å; F154-L158 HydrophobicContact CZ-CD1 4.07Å; F154-L158 HydrophobicContact CZ-CD2 3.9Å; F154-L158 HydrophobicContact CZ-CG 3.95Å; F154-L158 WeakPolarHBondContact O-CG 3.3Å; F154-L158 PolarHBondContact O-N 3.49Å
155	F	96.1	Very high	94.7	Very high	13 Å²	13	48 Å²	48	6%	0.057	23%	0.234	C	C	.	.	H	α-helix	trans	-64.1	-45.4	174.2	173	-116.2	0	0	0	112.8	S151 N152 E153 F157 L158 V159 E182 R185 L186	S151-F155 PolarHBondContact O-N 2.89Å; N152-F155 PolarHBondContact O-N 3.12Å; E153-F155 VanDerWaalsContact C-N 3.35Å; E153-F155 PolarHBondContact O-N 3.17Å; F155-F157 VanDerWaalsContact C-N 3.25Å; F155-F157 PolarHBondContact O-N 2.9Å; F155-L158 PolarHBondContact O-N 3.47Å; F155-V159 HydrophobicContact CD2-CG2 4.02Å; F155-V159 HydrophobicContact CE1-CG2 4.1Å; F155-V159 HydrophobicContact CE2-CG2 3.49Å; F155-V159 VanDerWaalsContact CE2-CG2 3.49Å; F155-V159 HydrophobicContact CZ-CG2 3.54Å; F155-V159 WeakPolarHBondContact O-CG2 3.18Å; F155-V159 PolarHBondContact O-N 3.42Å; F155-E182 HydrophobicContact CE2-CB 4.16Å; F155-E182 HydrophobicContact CE2-CG 4.34Å; F155-R185 HydrophobicContact CD1-CG 4.46Å; F155-R185 HydrophobicContact CD2-CB 4.47Å; F155-R185 VanDerWaalsContact CD2-CD 3.47Å; F155-R185 HydrophobicContact CD2-CG 4.09Å; F155-R185 HydrophobicContact CE1-CG 4.1Å; F155-R185 HydrophobicContact CE2-CB 3.74Å; F155-R185 HydrophobicContact CE2-CG 3.68Å; F155-R185 HydrophobicContact CG-CG 4.45Å; F155-R185 HydrophobicContact CZ-CB 3.92Å; F155-R185 HydrophobicContact CZ-CG 3.69Å; F155-L186 HydrophobicContact CE1-CD1 4.29Å; F155-L186 HydrophobicContact CZ-CB 4Å; F155-L186 HydrophobicContact CZ-CD1 4.25Å
156	T	93.4	Very high	94.6	Very high	68 Å²	68	49 Å²	49	42%	0.417	24%	0.242	S	C	.	.	H	α-helix	trans	-60.8	-40.8	176.1	-57.7	0	0	0	0	110	N152 E153 V159 N160	N152-T156 VanDerWaalsContact O-CB 3.29Å; N152-T156 WeakPolarHBondContact O-CB 3.41Å; N152-T156 PolarHBondContact O-N 2.92Å; N152-T156 PolarHBondContact O-OG1 2.9Å; E153-T156 PolarHBondContact O-N 3.14Å; T156-V159 PolarHBondContact O-N 2.86Å; T156-N160 WeakPolarHBondContact O-CB 3.34Å; T156-N160 PolarHBondContact O-N 3.44Å; T156-N160 PolarHBondContact O-ND2 3.3Å
157	F	93.5	Very high	94.5	Very high	26 Å²	26	47.3 Å²	47.3	11%	0.114	23%	0.231	C	C	.	.	H	α-helix	trans	-58.5	-50.7	172.6	-174.4	-94.7	0	0	0	111.7	V31 A36 W39 V51 Q55 E153 F154 F155 V159 N160 N161	V31-F157 HydrophobicContact CG1-CE1 3.7Å; V31-F157 HydrophobicContact CG1-CZ 3.48Å; V31-F157 VanDerWaalsContact CG1-CZ 3.48Å; A36-F157 HydrophobicContact CB-CD1 4.25Å; A36-F157 HydrophobicContact CB-CE1 3.78Å; W39-F157 AromaticContact CH2-CE1 3.9Å; W39-F157 HydrophobicContact CH2-CE1 3.9Å; W39-F157 HydrophobicContact CH2-CZ 4.15Å; W39-F157 HydrophobicContact CZ3-CD1 4.25Å; W39-F157 AromaticContact CZ3-CE1 3.54Å; W39-F157 HydrophobicContact CZ3-CE1 3.54Å; W39-F157 HydrophobicContact CZ3-CZ 4.11Å; V51-F157 HydrophobicContact CG1-CE2 4.18Å; V51-F157 HydrophobicContact CG1-CZ 3.71Å; Q55-F157 VanDerWaalsContact CD-CD2 3.46Å; Q55-F157 HydrophobicContact CG-CD2 3.7Å; Q55-F157 HydrophobicContact CG-CE2 3.56Å; Q55-F157 HydrophobicContact CG-CG 4.26Å; Q55-F157 HydrophobicContact CG-CZ 4Å; E153-F157 WeakPolarHBondContact O-CB 3.45Å; E153-F157 PolarHBondContact O-N 2.92Å; F154-F157 WeakPolarHBondContact O-CB 3.46Å; F154-F157 PolarHBondContact O-N 3Å; F155-F157 VanDerWaalsContact C-N 3.25Å; F155-F157 PolarHBondContact O-N 2.9Å; F157-V159 PolarHBondContact O-N 3.05Å; F157-N160 PolarHBondContact O-N 3.33Å; F157-N161 WeakPolarHBondContact CE1-ND2 3.05Å; F157-N161 WeakPolarHBondContact CZ-ND2 3.47Å; F157-N161 PolarHBondContact O-N 3.17Å; F157-N161 PolarHBondContact O-ND2 3.17Å
158	L	95.5	Very high	94.3	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-58.1	-47.6	177.3	-72.8	178	0	0	0	112.3	Y33 A36 K37 F154 F155 N160 N161 L162 E182	Y33-L158 HydrophobicContact CD2-CD2 4.34Å; Y33-L158 HydrophobicContact CE2-CD2 4.47Å; A36-L158 HydrophobicContact CB-CD2 3.68Å; K37-L158 HydrophobicContact CB-CD2 4.23Å; F154-L158 HydrophobicContact CD1-CD1 4.06Å; F154-L158 HydrophobicContact CD1-CG 4.33Å; F154-L158 HydrophobicContact CE1-CD1 3.54Å; F154-L158 HydrophobicContact CE1-CD2 4.24Å; F154-L158 HydrophobicContact CE1-CG 3.85Å; F154-L158 HydrophobicContact CE2-CD2 4.48Å; F154-L158 HydrophobicContact CE2-CG 4.47Å; F154-L158 HydrophobicContact CZ-CD1 4.07Å; F154-L158 HydrophobicContact CZ-CD2 3.9Å; F154-L158 HydrophobicContact CZ-CG 3.95Å; F154-L158 WeakPolarHBondContact O-CG 3.3Å; F154-L158 PolarHBondContact O-N 3.49Å; F155-L158 PolarHBondContact O-N 3.47Å; L158-N160 VanDerWaalsContact C-N 3.32Å; L158-N160 PolarHBondContact O-N 2.75Å; L158-N161 PolarHBondContact O-N 2.87Å; L158-L162 PolarHBondContact O-N 3.27Å; L158-E182 HydrophobicContact CB-CG 4.37Å
159	V	94	Very high	94.3	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.024	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-45.8	179.8	170.4	0	0	0	0	110.2	F155 T156 F157 N161 L162 I167 E182 V288 H292	F155-V159 HydrophobicContact CD2-CG2 4.02Å; F155-V159 HydrophobicContact CE1-CG2 4.1Å; F155-V159 HydrophobicContact CE2-CG2 3.49Å; F155-V159 VanDerWaalsContact CE2-CG2 3.49Å; F155-V159 HydrophobicContact CZ-CG2 3.54Å; F155-V159 WeakPolarHBondContact O-CG2 3.18Å; F155-V159 PolarHBondContact O-N 3.42Å; T156-V159 PolarHBondContact O-N 2.86Å; F157-V159 PolarHBondContact O-N 3.05Å; V159-N161 PolarHBondContact O-N 2.96Å; V159-L162 VanDerWaalsContact O-CB 3.31Å; V159-L162 WeakPolarHBondContact O-CB 3.38Å; V159-L162 PolarHBondContact O-N 3.05Å; V159-L162 VanDerWaalsContact O-N 3.1Å; V159-I167 HydrophobicContact CG1-CD1 4.48Å; V159-E182 HydrophobicContact CG2-CB 4.38Å; V159-V288 HydrophobicContact CG1-CG1 3.81Å; V159-H292 PolarHBondContact O-CE1 3.14Å; V159-H292 VanDerWaalsContact O-CE1 3.26Å; V159-H292 PolarHBondContact O-NE2 2.69Å
160	N	91.1	Very high	94.2	Very high	44 Å²	44	49.2 Å²	49.2	24%	0.235	25%	0.246	C	C	.	.	H	α-helix	trans	-67.9	-15.3	-179.4	-70.7	-15.4	0	0	0	114.9	T156 F157 L158 N295	T156-N160 WeakPolarHBondContact O-CB 3.34Å; T156-N160 PolarHBondContact O-N 3.44Å; T156-N160 PolarHBondContact O-ND2 3.3Å; F157-N160 PolarHBondContact O-N 3.33Å; L158-N160 VanDerWaalsContact C-N 3.32Å; L158-N160 PolarHBondContact O-N 2.75Å; N160-N295 PolarHBondContact O-ND2 3.34Å
161	N	91.6	Very high	94.3	Very high	27 Å²	27	42 Å²	42	14%	0.144	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	2.2	175.2	-71.2	-87.5	0	0	0	112.3	V31 Y33 F157 L158 V159	V31-N161 PolarHBondContact O-OD1 2.8Å; Y33-N161 VanDerWaalsContact CB-O 3.27Å; Y33-N161 WeakPolarHBondContact CB-O 3.29Å; F157-N161 WeakPolarHBondContact CE1-ND2 3.05Å; F157-N161 WeakPolarHBondContact CZ-ND2 3.47Å; F157-N161 PolarHBondContact O-N 3.17Å; F157-N161 PolarHBondContact O-ND2 3.17Å; L158-N161 PolarHBondContact O-N 2.87Å; V159-N161 PolarHBondContact O-N 2.96Å
162	L	93.3	Very high	94.3	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.063	25%	0.251	C	S	.	.	S	Bend	trans	-69	153.9	168.3	-70	166.8	0	0	0	110.1	Y33 L158 V159 T166 I167 W170 E182 H292	Y33-L162 HydrophobicContact CD1-CD2 3.88Å; Y33-L162 HydrophobicContact CD2-CD2 3.52Å; Y33-L162 HydrophobicContact CD2-CG 4.01Å; Y33-L162 HydrophobicContact CE1-CD2 4.02Å; Y33-L162 HydrophobicContact CE2-CD2 3.71Å; Y33-L162 HydrophobicContact CE2-CG 4.38Å; Y33-L162 HydrophobicContact CG-CD2 3.6Å; Y33-L162 HydrophobicContact CG-CG 4.36Å; L158-L162 PolarHBondContact O-N 3.27Å; V159-L162 VanDerWaalsContact O-CB 3.31Å; V159-L162 WeakPolarHBondContact O-CB 3.38Å; V159-L162 PolarHBondContact O-N 3.05Å; V159-L162 VanDerWaalsContact O-N 3.1Å; L162-T166 HydrophobicContact CD2-CG2 4.41Å; L162-I167 HydrophobicContact CB-CD1 4.2Å; L162-I167 HydrophobicContact CB-CG1 4.35Å; L162-I167 HydrophobicContact CD1-CD1 3.9Å; L162-W170 HydrophobicContact CD1-CH2 3.38Å; L162-W170 HydrophobicContact CD1-CZ2 4.19Å; L162-W170 HydrophobicContact CD1-CZ3 3.86Å; L162-E182 HydrophobicContact CD1-CB 4.35Å; L162-H292 PolarHBondContact O-CD2 2.83Å; L162-H292 VanDerWaalsContact O-CD2 3.27Å
163	S	91.4	Very high	94.4	Very high	62 Å²	62	47.2 Å²	47.2	43%	0.434	25%	0.245	S	C	.	.			trans	-68.2	146.8	176.5	69.6	0	0	0	0	111.3	E165 T166 I167	S163-E165 PolarHBondContact O-N 3.38Å; S163-T166 WeakPolarHBondContact O-CB 3.4Å; S163-T166 PolarHBondContact O-N 3.05Å; S163-T166 PolarHBondContact OG-N 3.29Å; S163-T166 PolarHBondContact OG-OG1 3.31Å; S163-I167 PolarHBondContact O-N 3.02Å
164	H	90.6	Very high	94.6	Very high	52 Å²	52	42.5 Å²	42.5	24%	0.241	22%	0.223	C	C	.	.	H	α-helix	trans	-53.1	-39.9	172.6	179.2	-82.4	0	0	0	112	T166 I167 E168 D296	H164-T166 VanDerWaalsContact C-N 3.3Å; H164-T166 PolarHBondContact O-N 2.85Å; H164-I167 PolarHBondContact O-N 3.4Å; H164-E168 IonicContact CE1-OE2 3.54Å; H164-E168 IonicContact ND1-OE2 2.64Å; H164-E168 VanDerWaalsContact O-CB 3.31Å; H164-E168 WeakPolarHBondContact O-CB 3.27Å; H164-E168 PolarHBondContact O-N 3.39Å; H164-D296 WeakPolarHBondContact CB-OD2 3.37Å; H164-D296 IonicContact CD2-OD2 3.28Å; H164-D296 IonicContact CG-OD2 2.69Å; H164-D296 VanDerWaalsContact CG-OD2 3.31Å
165	E	92.6	Very high	94.7	Very high	153 Å²	153	45.5 Å²	45.5	72%	0.715	24%	0.239	S	C	*	.	H	α-helix	trans	-58.7	-40.1	175.8	-176	-179.7	-176.6	0	0	112.4	S163 E168 N169	S163-E165 PolarHBondContact O-N 3.38Å; E165-E168 PolarHBondContact O-N 3.15Å; E165-N169 VanDerWaalsContact O-CB 3.23Å; E165-N169 WeakPolarHBondContact O-CB 3.43Å; E165-N169 PolarHBondContact O-N 3.25Å
166	T	95.4	Very high	94.8	Very high	39 Å²	39	46 Å²	46	24%	0.239	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-48.9	178.4	-60.1	0	0	0	0	110.6	L162 S163 H164 N169 W170	L162-T166 HydrophobicContact CD2-CG2 4.41Å; S163-T166 WeakPolarHBondContact O-CB 3.4Å; S163-T166 PolarHBondContact O-N 3.05Å; S163-T166 PolarHBondContact OG-N 3.29Å; S163-T166 PolarHBondContact OG-OG1 3.31Å; H164-T166 VanDerWaalsContact C-N 3.3Å; H164-T166 PolarHBondContact O-N 2.85Å; T166-N169 PolarHBondContact O-N 3.42Å; T166-W170 HydrophobicContact CG2-CD2 4.36Å; T166-W170 HydrophobicContact CG2-CH2 4.4Å; T166-W170 HydrophobicContact CG2-CZ2 3.62Å; T166-W170 VanDerWaalsContact O-CD1 3.28Å; T166-W170 PolarHBondContact O-N 3.42Å
167	I	95.4	Very high	95	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-41.8	179.5	-60.2	-57.5	0	0	0	111.2	V159 L162 S163 H164 N169 W170 G171 F285 V288 Q289	V159-I167 HydrophobicContact CG1-CD1 4.48Å; L162-I167 HydrophobicContact CB-CD1 4.2Å; L162-I167 HydrophobicContact CB-CG1 4.35Å; L162-I167 HydrophobicContact CD1-CD1 3.9Å; S163-I167 PolarHBondContact O-N 3.02Å; H164-I167 PolarHBondContact O-N 3.4Å; I167-N169 VanDerWaalsContact C-N 3.32Å; I167-N169 PolarHBondContact O-N 3.04Å; I167-W170 HydrophobicContact CD1-CE3 3.84Å; I167-W170 HydrophobicContact CD1-CZ3 3.8Å; I167-W170 PolarHBondContact O-N 3.29Å; I167-G171 PolarHBondContact O-N 3.48Å; I167-F285 HydrophobicContact CG2-CE2 4.34Å; I167-F285 HydrophobicContact CG2-CZ 4.24Å; I167-F285 WeakPolarHBondContact O-CZ 3.38Å; I167-V288 HydrophobicContact CD1-CG1 4.32Å; I167-V288 HydrophobicContact CG2-CG1 4.19Å; I167-Q289 HydrophobicContact CG2-CG 3.93Å
168	E	94.4	Very high	95.1	Very high	81 Å²	81	41.8 Å²	41.8	38%	0.379	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-41.4	176.1	-170.3	-174.7	167.2	0	0	111.4	H164 E165 G171 K172	H164-E168 IonicContact CE1-OE2 3.54Å; H164-E168 IonicContact ND1-OE2 2.64Å; H164-E168 VanDerWaalsContact O-CB 3.31Å; H164-E168 WeakPolarHBondContact O-CB 3.27Å; H164-E168 PolarHBondContact O-N 3.39Å; E165-E168 PolarHBondContact O-N 3.15Å; E168-G171 PolarHBondContact O-N 3.06Å; E168-K172 IonicContact OE1-NZ 3.69Å; E168-K172 PolarHBondContact OE1-NZ 3.28Å
169	N	96.7	Very high	95.2	Very high	71 Å²	71	45.7 Å²	45.7	38%	0.38	25%	0.254	S	S	.	.	H	α-helix	trans	-65.1	-39.6	177.1	-170.1	38.9	0	0	0	111.8	E165 T166 I167 G171 K172 D173 A176	E165-N169 VanDerWaalsContact O-CB 3.23Å; E165-N169 WeakPolarHBondContact O-CB 3.43Å; E165-N169 PolarHBondContact O-N 3.25Å; T166-N169 PolarHBondContact O-N 3.42Å; I167-N169 VanDerWaalsContact C-N 3.32Å; I167-N169 PolarHBondContact O-N 3.04Å; N169-G171 PolarHBondContact O-N 3.35Å; N169-K172 PolarHBondContact O-N 3.39Å; N169-D173 PolarHBondContact O-N 3.13Å; N169-A176 VanDerWaalsContact ND2-CB 3.26Å; N169-A176 WeakPolarHBondContact ND2-CB 3.03Å
170	W	97	Very high	95.3	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.019	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-24.6	174.2	-67.1	-1.8	0	0	0	113.4	L162 T166 I167 K172 A176 M177 H180 E182 G183 L186 F276 F285	L162-W170 HydrophobicContact CD1-CH2 3.38Å; L162-W170 HydrophobicContact CD1-CZ2 4.19Å; L162-W170 HydrophobicContact CD1-CZ3 3.86Å; T166-W170 HydrophobicContact CG2-CD2 4.36Å; T166-W170 HydrophobicContact CG2-CH2 4.4Å; T166-W170 HydrophobicContact CG2-CZ2 3.62Å; T166-W170 VanDerWaalsContact O-CD1 3.28Å; T166-W170 PolarHBondContact O-N 3.42Å; I167-W170 HydrophobicContact CD1-CE3 3.84Å; I167-W170 HydrophobicContact CD1-CZ3 3.8Å; I167-W170 PolarHBondContact O-N 3.29Å; W170-K172 PolarHBondContact O-N 3.35Å; W170-A176 PolarHBondContact NE1-O 3.34Å; W170-M177 HydrophobicContact CB-CB 3.94Å; W170-M177 HydrophobicContact CB-CG 4.13Å; W170-M177 VanDerWaalsContact CD1-CA 3.42Å; W170-M177 HydrophobicContact CD2-CB 4.23Å; W170-M177 HydrophobicContact CD2-CG 3.98Å; W170-M177 HydrophobicContact CE3-CG 4.26Å; W170-M177 HydrophobicContact CG-CB 3.73Å; W170-M177 HydrophobicContact CG-CG 3.93Å; W170-H180 HydrophobicContact CH2-CB 4.44Å; W170-H180 AromaticContact CH2-ND1 3.68Å; W170-H180 HydrophobicContact CZ2-CB 3.57Å; W170-H180 AromaticContact CZ2-CG 3.46Å; W170-H180 VanDerWaalsContact CZ2-CG 3.46Å; W170-H180 AromaticContact CZ2-ND1 3.47Å; W170-H180 WeakPolarHBondContact CZ2-ND1 3.48Å; W170-E182 HydrophobicContact CH2-CB 4.08Å; W170-G183 VanDerWaalsContact CH2-N 3.29Å; W170-L186 HydrophobicContact CE3-CD2 4.32Å; W170-L186 HydrophobicContact CZ3-CD2 4.26Å; W170-F276 VanDerWaalsContact O-CE2 3.28Å; W170-F276 WeakPolarHBondContact O-CE2 3.43Å; W170-F276 WeakPolarHBondContact O-CZ 3.37Å; W170-F285 HydrophobicContact CB-CZ 4.3Å
171	G	96.2	Very high	95.5	Very high	21 Å²	21	50 Å²	50	22%	0.216	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-13	171.7	0	0	0	0	0	114.4	I167 E168 N169	I167-G171 PolarHBondContact O-N 3.48Å; E168-G171 PolarHBondContact O-N 3.06Å; N169-G171 PolarHBondContact O-N 3.35Å
172	K	96.6	Very high	95.7	Very high	147 Å²	147	49.2 Å²	49.2	64%	0.639	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-32.8	-173.7	-60.9	172.1	-170.4	169.3	0	112.7	E168 N169 W170	E168-K172 IonicContact OE1-NZ 3.69Å; E168-K172 PolarHBondContact OE1-NZ 3.28Å; N169-K172 PolarHBondContact O-N 3.39Å; W170-K172 PolarHBondContact O-N 3.35Å
173	D	97.7	Very high	95.9	Very high	60 Å²	60	48.6 Å²	48.6	32%	0.321	27%	0.267	S	S	.	.			trans	-128.7	108.6	-173.1	-172.4	-7.4	0	0	0	111.6	N169 D175 A176 M177	N169-D173 PolarHBondContact O-N 3.13Å; D173-D175 VanDerWaalsContact C-N 3.28Å; D173-D175 PolarHBondContact O-N 3.37Å; D173-D175 WeakPolarHBondContact OD1-CB 3.2Å; D173-D175 PolarHBondContact OD1-N 3.18Å; D173-A176 HydrophobicContact CB-CB 3.88Å; D173-A176 PolarHBondContact O-N 2.97Å; D173-A176 PolarHBondContact OD1-N 2.82Å; D173-M177 PolarHBondContact O-N 2.97Å
174	F	98	Very high	96.1	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.009	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-36.8	175.6	-176.9	-113.1	0	0	0	112.5	A176 M177 M178 F187 Y268 M271 K272 F276	F174-A176 VanDerWaalsContact C-N 3.34Å; F174-M177 HydrophobicContact CD2-CE 3.63Å; F174-M177 HydrophobicContact CE2-CE 3.75Å; F174-M177 PolarHBondContact O-N 3.42Å; F174-M178 HydrophobicContact CD1-CG 4.05Å; F174-M178 HydrophobicContact CD2-CG 3.95Å; F174-M178 HydrophobicContact CE1-CG 3.68Å; F174-M178 HydrophobicContact CE2-CG 3.55Å; F174-M178 HydrophobicContact CE2-SD 3.9Å; F174-M178 HydrophobicContact CG-CG 4.21Å; F174-M178 HydrophobicContact CZ-CE 4.48Å; F174-M178 HydrophobicContact CZ-CG 3.42Å; F174-M178 VanDerWaalsContact CZ-CG 3.42Å; F174-M178 HydrophobicContact CZ-SD 3.93Å; F174-M178 WeakPolarHBondContact O-CB 3.37Å; F174-M178 VanDerWaalsContact O-CG 3.31Å; F174-M178 WeakPolarHBondContact O-CG 3.5Å; F174-M178 PolarHBondContact O-N 3Å; F174-F187 HydrophobicContact CE2-CD1 4.12Å; F174-F187 AromaticContact CE2-CE1 3.67Å; F174-F187 HydrophobicContact CE2-CE1 3.67Å; F174-F187 HydrophobicContact CE2-CE2 4.32Å; F174-F187 AromaticContact CE2-CZ 3.78Å; F174-F187 HydrophobicContact CE2-CZ 3.78Å; F174-F187 HydrophobicContact CZ-CE1 4.05Å; F174-F187 HydrophobicContact CZ-CZ 4.42Å; F174-Y268 AromaticContact CD1-CE1 3.97Å; F174-Y268 HydrophobicContact CD1-CE1 3.97Å; F174-Y268 HydrophobicContact CD1-CE2 4.29Å; F174-Y268 AromaticContact CD1-CZ 3.74Å; F174-Y268 HydrophobicContact CE1-CD1 4.27Å; F174-Y268 HydrophobicContact CE1-CD2 4.04Å; F174-Y268 AromaticContact CE1-CE1 3.88Å; F174-Y268 HydrophobicContact CE1-CE1 3.88Å; F174-Y268 AromaticContact CE1-CE2 3.65Å; F174-Y268 HydrophobicContact CE1-CE2 3.65Å; F174-Y268 HydrophobicContact CE1-CG 4.35Å; F174-Y268 AromaticContact CE1-CZ 3.55Å; F174-Y268 HydrophobicContact CZ-CE2 4.44Å; F174-M271 HydrophobicContact CZ-CB 3.88Å; F174-K272 HydrophobicContact CB-CD 4.32Å; F174-K272 HydrophobicContact CB-CG 3.89Å; F174-K272 HydrophobicContact CD1-CB 3.51Å; F174-K272 HydrophobicContact CD1-CD 3.86Å; F174-K272 HydrophobicContact CD1-CG 3.6Å; F174-K272 HydrophobicContact CE1-CB 3.75Å; F174-K272 HydrophobicContact CE1-CG 4.36Å; F174-K272 HydrophobicContact CG-CB 4.1Å; F174-K272 HydrophobicContact CG-CD 4.46Å; F174-K272 HydrophobicContact CG-CG 3.92Å; F174-F276 HydrophobicContact CB-CD1 3.76Å; F174-F276 HydrophobicContact CB-CD2 4.27Å; F174-F276 HydrophobicContact CB-CE1 3.8Å; F174-F276 HydrophobicContact CB-CE2 4.28Å; F174-F276 HydrophobicContact CB-CG 3.98Å; F174-F276 HydrophobicContact CB-CZ 4.05Å; F174-F276 HydrophobicContact CD2-CB 3.65Å; F174-F276 HydrophobicContact CD2-CD1 4.17Å; F174-F276 AromaticContact CD2-CD2 3.45Å; F174-F276 HydrophobicContact CD2-CD2 3.45Å; F174-F276 VanDerWaalsContact CD2-CD2 3.45Å; F174-F276 HydrophobicContact CD2-CE2 4.04Å; F174-F276 AromaticContact CD2-CG 3.49Å; F174-F276 HydrophobicContact CD2-CG 3.49Å; F174-F276 VanDerWaalsContact CD2-CG 3.49Å; F174-F276 HydrophobicContact CE2-CB 4.06Å; F174-F276 HydrophobicContact CE2-CD2 4.25Å; F174-F276 HydrophobicContact CE2-CG 4.33Å; F174-F276 HydrophobicContact CG-CB 4.34Å; F174-F276 HydrophobicContact CG-CD1 4.33Å; F174-F276 HydrophobicContact CG-CD2 4.31Å; F174-F276 HydrophobicContact CG-CG 4.08Å
175	D	97.8	Very high	96.4	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.342	26%	0.256	S	S	.	.	H	α-helix	trans	-69.9	-37.6	-177	-58.7	-31.8	0	0	0	110.3	D173 M178 A179 Y268 K272	D173-D175 VanDerWaalsContact C-N 3.28Å; D173-D175 PolarHBondContact O-N 3.37Å; D173-D175 WeakPolarHBondContact OD1-CB 3.2Å; D173-D175 PolarHBondContact OD1-N 3.18Å; D175-M178 PolarHBondContact O-N 2.9Å; D175-A179 VanDerWaalsContact O-CB 3.24Å; D175-A179 WeakPolarHBondContact O-CB 3.28Å; D175-A179 PolarHBondContact O-N 2.96Å; D175-Y268 WeakPolarHBondContact CA-OH 3.47Å; D175-Y268 VanDerWaalsContact OD1-CE1 3.26Å; D175-Y268 WeakPolarHBondContact OD1-CE1 3.43Å; D175-Y268 PolarHBondContact OD1-OH 2.94Å; D175-K272 IonicContact OD1-NZ 3.87Å; D175-K272 PolarHBondContact OD1-NZ 2.99Å; D175-K272 IonicContact OD2-NZ 2.76Å; D175-K272 PolarHBondContact OD2-NZ 3.01Å
176	A	97.8	Very high	96.5	Very high	23 Å²	23	41 Å²	41	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-41.7	172.9	0	0	0	0	0	112.5	N169 W170 D173 F174	N169-A176 VanDerWaalsContact ND2-CB 3.26Å; N169-A176 WeakPolarHBondContact ND2-CB 3.03Å; W170-A176 PolarHBondContact NE1-O 3.34Å; D173-A176 HydrophobicContact CB-CB 3.88Å; D173-A176 PolarHBondContact O-N 2.97Å; D173-A176 PolarHBondContact OD1-N 2.82Å; F174-A176 VanDerWaalsContact C-N 3.34Å
177	M	97.9	Very high	96.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-47.1	176.1	-175.4	-178.4	66.8	0	0	111.7	W170 D173 F174 A179 H180 F187 F276 F279	W170-M177 HydrophobicContact CB-CB 3.94Å; W170-M177 HydrophobicContact CB-CG 4.13Å; W170-M177 VanDerWaalsContact CD1-CA 3.42Å; W170-M177 HydrophobicContact CD2-CB 4.23Å; W170-M177 HydrophobicContact CD2-CG 3.98Å; W170-M177 HydrophobicContact CE3-CG 4.26Å; W170-M177 HydrophobicContact CG-CB 3.73Å; W170-M177 HydrophobicContact CG-CG 3.93Å; D173-M177 PolarHBondContact O-N 2.97Å; F174-M177 HydrophobicContact CD2-CE 3.63Å; F174-M177 HydrophobicContact CE2-CE 3.75Å; F174-M177 PolarHBondContact O-N 3.42Å; M177-A179 VanDerWaalsContact C-N 3.27Å; M177-A179 PolarHBondContact O-N 3.35Å; M177-H180 PolarHBondContact O-N 3.15Å; M177-F187 HydrophobicContact CE-CB 3.63Å; M177-F187 HydrophobicContact CE-CD1 4.21Å; M177-F187 HydrophobicContact CE-CD2 3.55Å; M177-F187 HydrophobicContact CE-CE2 4.22Å; M177-F187 HydrophobicContact CE-CG 3.54Å; M177-F187 HydrophobicContact SD-CB 4.1Å; M177-F187 HydrophobicContact SD-CD2 4.48Å; M177-F276 HydrophobicContact CE-CD2 3.73Å; M177-F276 HydrophobicContact CE-CE2 3.8Å; M177-F276 HydrophobicContact SD-CE2 4.2Å; M177-F279 HydrophobicContact CE-CD1 4.44Å; M177-F279 HydrophobicContact CE-CE1 4.3Å; M177-F279 HydrophobicContact SD-CD1 4.12Å; M177-F279 HydrophobicContact SD-CE1 3.43Å; M177-F279 WeakPolarHBondContact SD-CE1 3.35Å; M177-F279 HydrophobicContact SD-CZ 3.94Å
178	M	96.9	Very high	96.7	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-74.6	-16.2	-177.3	-66.1	-58.4	-66.9	0	0	113.3	F174 D175 Q184 F187 W203 Y268	F174-M178 HydrophobicContact CD1-CG 4.05Å; F174-M178 HydrophobicContact CD2-CG 3.95Å; F174-M178 HydrophobicContact CE1-CG 3.68Å; F174-M178 HydrophobicContact CE2-CG 3.55Å; F174-M178 HydrophobicContact CE2-SD 3.9Å; F174-M178 HydrophobicContact CG-CG 4.21Å; F174-M178 HydrophobicContact CZ-CE 4.48Å; F174-M178 HydrophobicContact CZ-CG 3.42Å; F174-M178 VanDerWaalsContact CZ-CG 3.42Å; F174-M178 HydrophobicContact CZ-SD 3.93Å; F174-M178 WeakPolarHBondContact O-CB 3.37Å; F174-M178 VanDerWaalsContact O-CG 3.31Å; F174-M178 WeakPolarHBondContact O-CG 3.5Å; F174-M178 PolarHBondContact O-N 3Å; D175-M178 PolarHBondContact O-N 2.9Å; M178-Q184 HydrophobicContact CE-CG 4.04Å; M178-Q184 VanDerWaalsContact O-CG 3.31Å; M178-Q184 WeakPolarHBondContact O-CG 3.41Å; M178-Q184 PolarHBondContact O-NE2 3.02Å; M178-Q184 HydrophobicContact SD-CG 4.27Å; M178-F187 HydrophobicContact SD-CB 4.48Å; M178-F187 HydrophobicContact SD-CD1 3.89Å; M178-F187 HydrophobicContact SD-CG 4.45Å; M178-W203 HydrophobicContact CE-CE3 4.02Å; M178-W203 HydrophobicContact CE-CH2 3.82Å; M178-W203 HydrophobicContact CE-CZ2 4.38Å; M178-W203 HydrophobicContact CE-CZ3 3.65Å; M178-Y268 HydrophobicContact CB-CE2 3.96Å; M178-Y268 HydrophobicContact CG-CE2 4.08Å
179	A	95.9	Very high	96.7	Very high	84 Å²	84	43.9 Å²	43.9	69%	0.694	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-14.4	170.7	0	0	0	0	0	113.3	D175 M177	D175-A179 VanDerWaalsContact O-CB 3.24Å; D175-A179 WeakPolarHBondContact O-CB 3.28Å; D175-A179 PolarHBondContact O-N 2.96Å; M177-A179 VanDerWaalsContact C-N 3.27Å; M177-A179 PolarHBondContact O-N 3.35Å
180	H	96.6	Very high	96.7	Very high	43 Å²	43	41 Å²	41	20%	0.199	21%	0.212	C	C	.	.	S	Bend	trans	-111.5	135.9	-176	-163.6	-80.8	0	0	0	111.6	Y33 W170 M177 E182 G183 Q184	Y33-H180 AromaticContact CE1-NE2 3.77Å; Y33-H180 AromaticContact CZ-CE1 3.48Å; Y33-H180 VanDerWaalsContact CZ-CE1 3.48Å; Y33-H180 AromaticContact CZ-NE2 3.6Å; Y33-H180 PolarHBondContact OH-CE1 3Å; Y33-H180 PolarHBondContact OH-NE2 2.77Å; Y33-H180 VanDerWaalsContact OH-NE2 3.14Å; W170-H180 HydrophobicContact CH2-CB 4.44Å; W170-H180 AromaticContact CH2-ND1 3.68Å; W170-H180 HydrophobicContact CZ2-CB 3.57Å; W170-H180 AromaticContact CZ2-CG 3.46Å; W170-H180 VanDerWaalsContact CZ2-CG 3.46Å; W170-H180 AromaticContact CZ2-ND1 3.47Å; W170-H180 WeakPolarHBondContact CZ2-ND1 3.48Å; M177-H180 PolarHBondContact O-N 3.15Å; H180-E182 IonicContact CE1-OE2 2.81Å; H180-E182 PolarHBondContact CE1-OE2 3.31Å; H180-E182 PolarHBondContact ND1-N 3.2Å; H180-E182 IonicContact ND1-OE2 3.98Å; H180-E182 PolarHBondContact ND1-OE2 3.42Å; H180-E182 IonicContact NE2-OE2 2.85Å; H180-E182 PolarHBondContact O-N 3.06Å; H180-G183 PolarHBondContact O-N 3.03Å; H180-Q184 WeakPolarHBondContact O-CG 3.38Å; H180-Q184 PolarHBondContact O-N 3.23Å
181	D	94.8	Very high	96.6	Very high	96 Å²	96	40.8 Å²	40.8	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-61.3	-44.3	-174.2	-61.7	-34.6	0	0	0	112.2	K37 G183 Q184 R185	K37-D181 IonicContact NZ-OD2 3.71Å; K37-D181 PolarHBondContact NZ-OD2 3.4Å; D181-G183 VanDerWaalsContact C-N 3.32Å; D181-G183 PolarHBondContact O-N 3.11Å; D181-Q184 WeakPolarHBondContact O-CB 3.43Å; D181-Q184 PolarHBondContact O-N 2.97Å; D181-R185 PolarHBondContact O-N 2.94Å
182	E	96.2	Very high	96.6	Very high	10 Å²	10	43 Å²	43	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-35.4	179	-70.6	65.6	-159.8	0	0	111	Y33 K37 F155 L158 V159 L162 W170 H180 R185 L186	Y33-E182 HydrophobicContact CE2-CG 4.03Å; Y33-E182 PolarHBondContact OH-OE1 3.46Å; Y33-E182 PolarHBondContact OH-OE2 3.42Å; K37-E182 IonicContact NZ-OE1 2.75Å; K37-E182 IonicContact NZ-OE2 3.29Å; K37-E182 PolarHBondContact NZ-OE2 3.3Å; F155-E182 HydrophobicContact CE2-CB 4.16Å; F155-E182 HydrophobicContact CE2-CG 4.34Å; L158-E182 HydrophobicContact CB-CG 4.37Å; V159-E182 HydrophobicContact CG2-CB 4.38Å; L162-E182 HydrophobicContact CD1-CB 4.35Å; W170-E182 HydrophobicContact CH2-CB 4.08Å; H180-E182 IonicContact CE1-OE2 2.81Å; H180-E182 PolarHBondContact CE1-OE2 3.31Å; H180-E182 PolarHBondContact ND1-N 3.2Å; H180-E182 IonicContact ND1-OE2 3.98Å; H180-E182 PolarHBondContact ND1-OE2 3.42Å; H180-E182 IonicContact NE2-OE2 2.85Å; H180-E182 PolarHBondContact O-N 3.06Å; E182-R185 PolarHBondContact O-N 3.15Å; E182-L186 VanDerWaalsContact O-CB 3.24Å; E182-L186 WeakPolarHBondContact O-CB 3.47Å; E182-L186 PolarHBondContact O-N 2.94Å
183	G	97.1	Very high	96.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.6	-43.2	173.8	0	0	0	0	0	111.9	W170 H180 D181 R185 L186 F187	W170-G183 VanDerWaalsContact CH2-N 3.29Å; H180-G183 PolarHBondContact O-N 3.03Å; D181-G183 VanDerWaalsContact C-N 3.32Å; D181-G183 PolarHBondContact O-N 3.11Å; G183-R185 PolarHBondContact O-N 3.4Å; G183-L186 PolarHBondContact O-N 3.29Å; G183-F187 WeakPolarHBondContact O-CB 3.23Å; G183-F187 PolarHBondContact O-N 3.08Å
184	Q	96.5	Very high	96.2	Very high	39 Å²	39	41.3 Å²	41.3	18%	0.182	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-44.9	172.6	-68.9	174.8	45.1	0	0	111.8	M178 H180 D181 R188 W203	M178-Q184 HydrophobicContact CE-CG 4.04Å; M178-Q184 VanDerWaalsContact O-CG 3.31Å; M178-Q184 WeakPolarHBondContact O-CG 3.41Å; M178-Q184 PolarHBondContact O-NE2 3.02Å; M178-Q184 HydrophobicContact SD-CG 4.27Å; H180-Q184 WeakPolarHBondContact O-CG 3.38Å; H180-Q184 PolarHBondContact O-N 3.23Å; D181-Q184 WeakPolarHBondContact O-CB 3.43Å; D181-Q184 PolarHBondContact O-N 2.97Å; Q184-R188 VanDerWaalsContact O-CB 3.29Å; Q184-R188 WeakPolarHBondContact O-CB 3.49Å; Q184-R188 PolarHBondContact O-N 3.46Å; Q184-W203 HydrophobicContact CG-CZ3 4.41Å
185	R	96.1	Very high	95.9	Very high	64 Å²	64	51.6 Å²	51.6	24%	0.242	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-45	177.4	-179.5	169.3	173.5	-177.3	-3.1	111.3	R150 S151 N152 F155 D181 E182 G183 F187 R188 E189	R150-R185 PolarHBondContact O-NH2 3.46Å; S151-R185 PolarHBondContact O-NH2 3.42Å; N152-R185 PolarHBondContact OD1-NH2 3.45Å; F155-R185 HydrophobicContact CD1-CG 4.46Å; F155-R185 HydrophobicContact CD2-CB 4.47Å; F155-R185 VanDerWaalsContact CD2-CD 3.47Å; F155-R185 HydrophobicContact CD2-CG 4.09Å; F155-R185 HydrophobicContact CE1-CG 4.1Å; F155-R185 HydrophobicContact CE2-CB 3.74Å; F155-R185 HydrophobicContact CE2-CG 3.68Å; F155-R185 HydrophobicContact CG-CG 4.45Å; F155-R185 HydrophobicContact CZ-CB 3.92Å; F155-R185 HydrophobicContact CZ-CG 3.69Å; D181-R185 PolarHBondContact O-N 2.94Å; E182-R185 PolarHBondContact O-N 3.15Å; G183-R185 PolarHBondContact O-N 3.4Å; R185-F187 VanDerWaalsContact C-N 3.35Å; R185-F187 PolarHBondContact O-N 3.46Å; R185-R188 WeakPolarHBondContact O-CB 3.16Å; R185-R188 PolarHBondContact O-N 2.91Å; R185-E189 HydrophobicContact CG-CG 4.45Å; R185-E189 WeakPolarHBondContact O-CG 3.39Å; R185-E189 PolarHBondContact O-N 3.33Å
186	L	96.2	Very high	95.6	Very high	4 Å²	4	49 Å²	49	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-47.8	179.6	-173.1	65.6	0	0	0	111.3	F155 W170 E182 G183 E189 Y190 F279 F284 F285 V288	F155-L186 HydrophobicContact CE1-CD1 4.29Å; F155-L186 HydrophobicContact CZ-CB 4Å; F155-L186 HydrophobicContact CZ-CD1 4.25Å; W170-L186 HydrophobicContact CE3-CD2 4.32Å; W170-L186 HydrophobicContact CZ3-CD2 4.26Å; E182-L186 VanDerWaalsContact O-CB 3.24Å; E182-L186 WeakPolarHBondContact O-CB 3.47Å; E182-L186 PolarHBondContact O-N 2.94Å; G183-L186 PolarHBondContact O-N 3.29Å; L186-E189 PolarHBondContact O-N 3.01Å; L186-Y190 PolarHBondContact O-N 3.3Å; L186-Y190 VanDerWaalsContact O-N 3.16Å; L186-F279 HydrophobicContact CD2-CZ 4.02Å; L186-F279 HydrophobicContact CG-CE2 4.34Å; L186-F279 HydrophobicContact CG-CZ 4.14Å; L186-F284 HydrophobicContact CD1-CE1 3.48Å; L186-F284 VanDerWaalsContact CD1-CE1 3.48Å; L186-F284 HydrophobicContact CD1-CZ 3.79Å; L186-F284 HydrophobicContact CG-CE1 3.94Å; L186-F285 HydrophobicContact CD2-CD2 4.26Å; L186-F285 HydrophobicContact CD2-CE2 4.3Å; L186-V288 HydrophobicContact CD1-CG2 4.1Å; L186-V288 HydrophobicContact CD2-CG1 4.38Å; L186-V288 HydrophobicContact CD2-CG2 4.44Å
187	F	97.3	Very high	95.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-41.4	177.2	-172.7	-119	0	0	0	111.8	F174 M177 M178 G183 R185 E189 Y190 L191 M271 C275 F276 F279	F174-F187 HydrophobicContact CE2-CD1 4.12Å; F174-F187 AromaticContact CE2-CE1 3.67Å; F174-F187 HydrophobicContact CE2-CE1 3.67Å; F174-F187 HydrophobicContact CE2-CE2 4.32Å; F174-F187 AromaticContact CE2-CZ 3.78Å; F174-F187 HydrophobicContact CE2-CZ 3.78Å; F174-F187 HydrophobicContact CZ-CE1 4.05Å; F174-F187 HydrophobicContact CZ-CZ 4.42Å; M177-F187 HydrophobicContact CE-CB 3.63Å; M177-F187 HydrophobicContact CE-CD1 4.21Å; M177-F187 HydrophobicContact CE-CD2 3.55Å; M177-F187 HydrophobicContact CE-CE2 4.22Å; M177-F187 HydrophobicContact CE-CG 3.54Å; M177-F187 HydrophobicContact SD-CB 4.1Å; M177-F187 HydrophobicContact SD-CD2 4.48Å; M178-F187 HydrophobicContact SD-CB 4.48Å; M178-F187 HydrophobicContact SD-CD1 3.89Å; M178-F187 HydrophobicContact SD-CG 4.45Å; G183-F187 WeakPolarHBondContact O-CB 3.23Å; G183-F187 PolarHBondContact O-N 3.08Å; R185-F187 VanDerWaalsContact C-N 3.35Å; R185-F187 PolarHBondContact O-N 3.46Å; F187-E189 PolarHBondContact O-N 3.18Å; F187-Y190 HydrophobicContact CE2-CD1 4.45Å; F187-Y190 WeakPolarHBondContact O-CB 3.34Å; F187-Y190 PolarHBondContact O-N 3.02Å; F187-L191 HydrophobicContact CD1-CD1 4.01Å; F187-L191 HydrophobicContact CD1-CG 4.31Å; F187-L191 HydrophobicContact CE1-CD1 3.61Å; F187-L191 HydrophobicContact CE1-CD2 4.3Å; F187-L191 HydrophobicContact CE1-CG 4.07Å; F187-L191 HydrophobicContact CE2-CD2 4.2Å; F187-L191 HydrophobicContact CZ-CD1 4.1Å; F187-L191 HydrophobicContact CZ-CD2 3.93Å; F187-L191 HydrophobicContact CZ-CG 4.19Å; F187-L191 WeakPolarHBondContact O-CG 3.39Å; F187-L191 PolarHBondContact O-N 3.27Å; F187-M271 HydrophobicContact CE1-CB 4.2Å; F187-M271 HydrophobicContact CE1-CG 4.49Å; F187-M271 HydrophobicContact CE1-SD 4.08Å; F187-M271 HydrophobicContact CZ-CB 4.41Å; F187-C275 HydrophobicContact CE2-CB 4.36Å; F187-C275 HydrophobicContact CZ-CB 3.72Å; F187-F276 HydrophobicContact CE2-CB 4.39Å; F187-F276 HydrophobicContact CZ-CB 4.49Å; F187-F279 HydrophobicContact CD2-CB 4.05Å; F187-F279 HydrophobicContact CD2-CD1 4.09Å; F187-F279 HydrophobicContact CD2-CD2 4.04Å; F187-F279 HydrophobicContact CD2-CE2 4.49Å; F187-F279 AromaticContact CD2-CG 3.79Å; F187-F279 HydrophobicContact CD2-CG 3.79Å; F187-F279 HydrophobicContact CE2-CB 3.81Å; F187-F279 HydrophobicContact CE2-CD1 4.49Å; F187-F279 HydrophobicContact CE2-CG 4.07Å
188	R	96.6	Very high	95.3	Very high	123 Å²	123	51.1 Å²	51.1	46%	0.464	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-45.9	175.2	174.1	178.3	171.5	-165.4	-5.1	112.4	Q184 R185 Y190 L191 V192 V200	Q184-R188 VanDerWaalsContact O-CB 3.29Å; Q184-R188 WeakPolarHBondContact O-CB 3.49Å; Q184-R188 PolarHBondContact O-N 3.46Å; R185-R188 WeakPolarHBondContact O-CB 3.16Å; R185-R188 PolarHBondContact O-N 2.91Å; R188-Y190 VanDerWaalsContact C-N 3.27Å; R188-Y190 PolarHBondContact O-N 3.34Å; R188-L191 PolarHBondContact O-N 2.98Å; R188-L191 VanDerWaalsContact O-N 3.15Å; R188-V192 WeakPolarHBondContact O-CG2 3.46Å; R188-V192 PolarHBondContact O-N 2.66Å; R188-V200 HydrophobicContact CB-CG1 3.96Å; R188-V200 HydrophobicContact CB-CG2 4.29Å; R188-V200 HydrophobicContact CG-CG1 3.8Å
189	E	95	Very high	95.2	Very high	61 Å²	61	51.2 Å²	51.2	29%	0.285	25%	0.252	S	S	.	.	H	α-helix	trans	-57.6	-43.9	177.1	-71.1	-63.3	158.6	0	0	110.6	R185 L186 F187 L191 V192 T193 F284	R185-E189 HydrophobicContact CG-CG 4.45Å; R185-E189 WeakPolarHBondContact O-CG 3.39Å; R185-E189 PolarHBondContact O-N 3.33Å; L186-E189 PolarHBondContact O-N 3.01Å; F187-E189 PolarHBondContact O-N 3.18Å; E189-L191 PolarHBondContact O-N 2.51Å; E189-V192 PolarHBondContact O-N 3.31Å; E189-T193 WeakPolarHBondContact O-CG2 3.4Å; E189-T193 PolarHBondContact O-N 3.28Å; E189-F284 HydrophobicContact CB-CZ 4Å
190	Y	96.4	Very high	95.2	Very high	10 Å²	10	47.3 Å²	47.3	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-47.5	173	171.1	-106.1	0	0	0	112.6	L186 F187 R188 V192 T193 E194 R278 F279 F284	L186-Y190 PolarHBondContact O-N 3.3Å; L186-Y190 VanDerWaalsContact O-N 3.16Å; F187-Y190 HydrophobicContact CE2-CD1 4.45Å; F187-Y190 WeakPolarHBondContact O-CB 3.34Å; F187-Y190 PolarHBondContact O-N 3.02Å; R188-Y190 VanDerWaalsContact C-N 3.27Å; R188-Y190 PolarHBondContact O-N 3.34Å; Y190-V192 PolarHBondContact O-N 3.47Å; Y190-T193 WeakPolarHBondContact O-CA 3.24Å; Y190-T193 WeakPolarHBondContact O-CB 3.4Å; Y190-T193 PolarHBondContact O-N 3.13Å; Y190-T193 PolarHBondContact O-OG1 2.86Å; Y190-E194 HydrophobicContact CD1-CG 4.48Å; Y190-E194 HydrophobicContact CD2-CG 4.45Å; Y190-E194 HydrophobicContact CE1-CG 3.85Å; Y190-E194 HydrophobicContact CE2-CG 3.79Å; Y190-E194 VanDerWaalsContact CZ-CG 3.46Å; Y190-E194 PolarHBondContact O-N 2.68Å; Y190-E194 VanDerWaalsContact O-N 3.12Å; Y190-E194 WeakPolarHBondContact OH-CG 3.24Å; Y190-R278 VanDerWaalsContact OH-CB 3.28Å; Y190-R278 WeakPolarHBondContact OH-CB 3.5Å; Y190-F279 HydrophobicContact CD1-CB 3.65Å; Y190-F279 AromaticContact CD1-CD2 3.61Å; Y190-F279 HydrophobicContact CD1-CD2 3.61Å; Y190-F279 HydrophobicContact CD1-CG 4.08Å; Y190-F279 HydrophobicContact CD2-CD2 4.16Å; Y190-F279 HydrophobicContact CE1-CB 3.55Å; Y190-F279 HydrophobicContact CE1-CD2 4.29Å; Y190-F279 HydrophobicContact CE1-CG 4.43Å; Y190-F279 HydrophobicContact CG-CB 4.35Å; Y190-F279 AromaticContact CG-CD2 3.53Å; Y190-F279 HydrophobicContact CG-CD2 3.53Å; Y190-F279 HydrophobicContact CG-CE2 4.34Å; Y190-F279 HydrophobicContact CG-CG 4.42Å; Y190-F284 HydrophobicContact CD2-CB 4.22Å; Y190-F284 HydrophobicContact CD2-CD1 4.41Å; Y190-F284 HydrophobicContact CD2-CG 4.34Å
191	L	95.8	Very high	95.1	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-30.6	179.7	-65.1	-172.7	0	0	0	113.2	F187 R188 E189 T193 E194 R195 A196 D197 V200 M271 C275	F187-L191 HydrophobicContact CD1-CD1 4.01Å; F187-L191 HydrophobicContact CD1-CG 4.31Å; F187-L191 HydrophobicContact CE1-CD1 3.61Å; F187-L191 HydrophobicContact CE1-CD2 4.3Å; F187-L191 HydrophobicContact CE1-CG 4.07Å; F187-L191 HydrophobicContact CE2-CD2 4.2Å; F187-L191 HydrophobicContact CZ-CD1 4.1Å; F187-L191 HydrophobicContact CZ-CD2 3.93Å; F187-L191 HydrophobicContact CZ-CG 4.19Å; F187-L191 WeakPolarHBondContact O-CG 3.39Å; F187-L191 PolarHBondContact O-N 3.27Å; R188-L191 PolarHBondContact O-N 2.98Å; R188-L191 VanDerWaalsContact O-N 3.15Å; E189-L191 PolarHBondContact O-N 2.51Å; L191-T193 VanDerWaalsContact C-N 3.28Å; L191-T193 PolarHBondContact O-N 3.3Å; L191-E194 CarbonylContact O-C 3.49Å; L191-E194 PolarHBondContact O-N 2.66Å; L191-R195 PolarHBondContact O-N 3.44Å; L191-A196 HydrophobicContact CD2-CB 4.34Å; L191-A196 PolarHBondContact O-N 2.85Å; L191-D197 HydrophobicContact CB-CB 4.1Å; L191-D197 PolarHBondContact O-N 3.09Å; L191-V200 HydrophobicContact CD1-CB 4.01Å; L191-V200 HydrophobicContact CD1-CG1 3.96Å; L191-M271 HydrophobicContact CD1-SD 4.17Å; L191-C275 HydrophobicContact CD2-CB 3.71Å
192	V	94.7	Very high	95.2	Very high	66 Å²	66	44.7 Å²	44.7	40%	0.4	20%	0.204	S	C	.	.	H	α-helix	trans	-62.5	-39.6	172.8	171.5	0	0	0	0	110.1	R188 E189 Y190 E194 R195 D197	R188-V192 WeakPolarHBondContact O-CG2 3.46Å; R188-V192 PolarHBondContact O-N 2.66Å; E189-V192 PolarHBondContact O-N 3.31Å; Y190-V192 PolarHBondContact O-N 3.47Å; V192-E194 VanDerWaalsContact C-N 3.32Å; V192-E194 PolarHBondContact O-N 3.22Å; V192-R195 PolarHBondContact O-N 3.2Å; V192-D197 HydrophobicContact CB-CB 4.4Å; V192-D197 HydrophobicContact CG2-CB 3.6Å
193	T	93.6	Very high	95.3	Very high	91 Å²	91	44.9 Å²	44.9	56%	0.558	20%	0.204	S	C	*	.	H	α-helix	trans	-66	-35	175.7	73.1	0	0	0	0	112.7	E189 Y190 L191 R195	E189-T193 WeakPolarHBondContact O-CG2 3.4Å; E189-T193 PolarHBondContact O-N 3.28Å; Y190-T193 WeakPolarHBondContact O-CA 3.24Å; Y190-T193 WeakPolarHBondContact O-CB 3.4Å; Y190-T193 PolarHBondContact O-N 3.13Å; Y190-T193 PolarHBondContact O-OG1 2.86Å; L191-T193 VanDerWaalsContact C-N 3.28Å; L191-T193 PolarHBondContact O-N 3.3Å; T193-R195 VanDerWaalsContact C-N 3.3Å; T193-R195 PolarHBondContact O-N 3.48Å
194	E	92.3	Very high	95.2	Very high	82 Å²	82	47 Å²	47	38%	0.383	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.2	176.5	-68	-72.7	114.2	0	0	113.5	Y190 L191 V192 A196 R278	Y190-E194 HydrophobicContact CD1-CG 4.48Å; Y190-E194 HydrophobicContact CD2-CG 4.45Å; Y190-E194 HydrophobicContact CE1-CG 3.85Å; Y190-E194 HydrophobicContact CE2-CG 3.79Å; Y190-E194 VanDerWaalsContact CZ-CG 3.46Å; Y190-E194 PolarHBondContact O-N 2.68Å; Y190-E194 VanDerWaalsContact O-N 3.12Å; Y190-E194 WeakPolarHBondContact OH-CG 3.24Å; L191-E194 CarbonylContact O-C 3.49Å; L191-E194 PolarHBondContact O-N 2.66Å; V192-E194 VanDerWaalsContact C-N 3.32Å; V192-E194 PolarHBondContact O-N 3.22Å; E194-A196 HydrophobicContact CB-CB 4.44Å; E194-A196 PolarHBondContact O-N 2.88Å; E194-R278 IonicContact OE2-CZ 2.67Å; E194-R278 IonicContact OE2-NH1 3.16Å; E194-R278 PolarHBondContact OE2-NH1 2.94Å
195	R	91.7	Very high	95.2	Very high	218 Å²	218	47.7 Å²	47.7	82%	0.823	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	40.5	-173.4	-54.4	-179.9	177	-178.4	-0.9	113.3	L191 V192 T193	L191-R195 PolarHBondContact O-N 3.44Å; V192-R195 PolarHBondContact O-N 3.2Å; T193-R195 VanDerWaalsContact C-N 3.3Å; T193-R195 PolarHBondContact O-N 3.48Å
196	A	92.2	Very high	95.2	Very high	10 Å²	10	44.8 Å²	44.8	8%	0.083	21%	0.211	C	C	.	.			trans	-123.6	16.6	179.7	0	0	0	0	0	112.1	L191 E194 E198 N199	L191-A196 HydrophobicContact CD2-CB 4.34Å; L191-A196 PolarHBondContact O-N 2.85Å; E194-A196 HydrophobicContact CB-CB 4.44Å; E194-A196 PolarHBondContact O-N 2.88Å; A196-E198 WeakPolarHBondContact CA-OE2 3.3Å; A196-E198 PolarHBondContact O-N 3.48Å; A196-N199 PolarHBondContact O-N 3.39Å; A196-N199 PolarHBondContact O-ND2 2.67Å; A196-N199 VanDerWaalsContact O-ND2 3.16Å
197	D	94.3	Very high	95.2	Very high	26 Å²	26	47.7 Å²	47.7	14%	0.139	22%	0.224	C	C	.	.	H	α-helix	trans	-74.6	-8.9	-173.8	65.6	-66.8	0	0	0	113.8	L191 V192 N199 V200 K201	L191-D197 HydrophobicContact CB-CB 4.1Å; L191-D197 PolarHBondContact O-N 3.09Å; V192-D197 HydrophobicContact CB-CB 4.4Å; V192-D197 HydrophobicContact CG2-CB 3.6Å; D197-N199 PolarHBondContact O-N 3.17Å; D197-V200 HydrophobicContact CB-CG1 4.37Å; D197-V200 VanDerWaalsContact O-CG1 3.31Å; D197-V200 WeakPolarHBondContact O-CG1 3.43Å; D197-V200 PolarHBondContact O-N 2.89Å; D197-K201 WeakPolarHBondContact O-CB 3.46Å; D197-K201 VanDerWaalsContact O-CG 3.24Å; D197-K201 WeakPolarHBondContact O-CG 3.4Å; D197-K201 PolarHBondContact O-N 3.25Å; D197-K201 WeakPolarHBondContact OD2-CD 3.42Å; D197-K201 WeakPolarHBondContact OD2-CE 3.49Å; D197-K201 IonicContact OD2-NZ 2.64Å; D197-K201 PolarHBondContact OD2-NZ 2.77Å
198	E	95.3	Very high	95.1	Very high	41 Å²	41	53.2 Å²	53.2	19%	0.192	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-33.9	170.4	72.1	-70.4	164	0	0	112.2	A196 F202 F229 I238	A196-E198 WeakPolarHBondContact CA-OE2 3.3Å; A196-E198 PolarHBondContact O-N 3.48Å; E198-F202 VanDerWaalsContact O-CB 3.28Å; E198-F202 WeakPolarHBondContact O-CB 3.28Å; E198-F202 PolarHBondContact O-N 3.16Å; E198-F229 HydrophobicContact CB-CD1 4.43Å; E198-F229 HydrophobicContact CB-CE1 4.3Å; E198-I238 HydrophobicContact CB-CG2 4.44Å; E198-I238 HydrophobicContact CG-CG2 4.11Å
199	N	95.3	Very high	95.2	Very high	6 Å²	6	47.4 Å²	47.4	3%	0.032	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-48.7	-178.4	-63.5	-59	0	0	0	111.8	A196 D197 W203 I267 M271	A196-N199 PolarHBondContact O-N 3.39Å; A196-N199 PolarHBondContact O-ND2 2.67Å; A196-N199 VanDerWaalsContact O-ND2 3.16Å; D197-N199 PolarHBondContact O-N 3.17Å; N199-W203 WeakPolarHBondContact O-CB 3.48Å; N199-W203 PolarHBondContact O-N 3.5Å; N199-I267 HydrophobicContact CB-CG2 3.77Å; N199-I267 WeakPolarHBondContact O-CG2 3.44Å; N199-M271 HydrophobicContact CB-CG 3.7Å; N199-M271 HydrophobicContact CB-SD 3.7Å
200	V	95	Very high	95.2	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-69.8	-38	177.6	66.4	0	0	0	0	111.2	R188 L191 D197 W203 T204 M271	R188-V200 HydrophobicContact CB-CG1 3.96Å; R188-V200 HydrophobicContact CB-CG2 4.29Å; R188-V200 HydrophobicContact CG-CG1 3.8Å; L191-V200 HydrophobicContact CD1-CB 4.01Å; L191-V200 HydrophobicContact CD1-CG1 3.96Å; D197-V200 HydrophobicContact CB-CG1 4.37Å; D197-V200 VanDerWaalsContact O-CG1 3.31Å; D197-V200 WeakPolarHBondContact O-CG1 3.43Å; D197-V200 PolarHBondContact O-N 2.89Å; V200-W203 PolarHBondContact O-N 2.77Å; V200-T204 WeakPolarHBondContact O-CB 3.41Å; V200-T204 PolarHBondContact O-N 2.66Å; V200-T204 PolarHBondContact O-OG1 3.19Å; V200-T204 VanDerWaalsContact O-OG1 3.04Å; V200-M271 HydrophobicContact CB-SD 4.03Å
201	K	95.3	Very high	95.2	Very high	84 Å²	84	53.9 Å²	53.9	37%	0.365	26%	0.255	S	S	.	.	H	α-helix	trans	-59	-49.5	174.3	-78.1	170.9	170.8	168.4	0	111.6	D197 T204 L205 F229	D197-K201 WeakPolarHBondContact O-CB 3.46Å; D197-K201 VanDerWaalsContact O-CG 3.24Å; D197-K201 WeakPolarHBondContact O-CG 3.4Å; D197-K201 PolarHBondContact O-N 3.25Å; D197-K201 WeakPolarHBondContact OD2-CD 3.42Å; D197-K201 WeakPolarHBondContact OD2-CE 3.49Å; D197-K201 IonicContact OD2-NZ 2.64Å; D197-K201 PolarHBondContact OD2-NZ 2.77Å; K201-T204 PolarHBondContact O-N 3.13Å; K201-L205 WeakPolarHBondContact O-CB 3.2Å; K201-L205 WeakPolarHBondContact O-CG 3.45Å; K201-L205 PolarHBondContact O-N 2.96Å; K201-F229 HydrophobicContact CB-CE1 4.16Å; K201-F229 HydrophobicContact CB-CZ 4.01Å
202	F	97.2	Very high	95.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-48.9	176.7	170.5	-98	0	0	0	111.4	E198 T204 L205 A206 I225 F229 I230 I238 F260 A263 I267	E198-F202 VanDerWaalsContact O-CB 3.28Å; E198-F202 WeakPolarHBondContact O-CB 3.28Å; E198-F202 PolarHBondContact O-N 3.16Å; F202-T204 PolarHBondContact O-N 3.35Å; F202-L205 PolarHBondContact O-N 3.47Å; F202-A206 HydrophobicContact CE1-CB 4.38Å; F202-A206 HydrophobicContact CZ-CB 4.24Å; F202-A206 WeakPolarHBondContact O-CB 3.19Å; F202-A206 PolarHBondContact O-N 3.01Å; F202-I225 HydrophobicContact CD2-CG2 3.97Å; F202-I225 HydrophobicContact CE2-CG2 3.7Å; F202-F229 HydrophobicContact CB-CD1 4.02Å; F202-F229 HydrophobicContact CB-CD2 4.38Å; F202-F229 HydrophobicContact CB-CE1 4.31Å; F202-F229 HydrophobicContact CB-CG 4.05Å; F202-F229 HydrophobicContact CD2-CB 3.81Å; F202-F229 HydrophobicContact CD2-CD2 4.03Å; F202-F229 AromaticContact CD2-CG 3.95Å; F202-F229 HydrophobicContact CD2-CG 3.95Å; F202-F229 HydrophobicContact CG-CG 4.45Å; F202-I230 HydrophobicContact CE2-CD1 3.9Å; F202-I230 HydrophobicContact CE2-CG1 4.44Å; F202-I230 HydrophobicContact CZ-CD1 4.31Å; F202-I238 HydrophobicContact CB-CD1 4.36Å; F202-I238 HydrophobicContact CB-CG2 3.9Å; F202-I238 HydrophobicContact CD1-CD1 3.53Å; F202-I238 HydrophobicContact CD2-CD1 3.66Å; F202-I238 HydrophobicContact CE1-CD1 3.63Å; F202-I238 HydrophobicContact CE2-CD1 3.76Å; F202-I238 HydrophobicContact CG-CD1 3.55Å; F202-I238 HydrophobicContact CG-CG2 4.23Å; F202-I238 HydrophobicContact CZ-CD1 3.75Å; F202-F260 HydrophobicContact CE2-CD1 4.27Å; F202-F260 HydrophobicContact CZ-CB 4.34Å; F202-F260 HydrophobicContact CZ-CD1 4.39Å; F202-A263 HydrophobicContact CE1-CB 3.85Å; F202-A263 HydrophobicContact CZ-CB 3.56Å; F202-I267 HydrophobicContact CD1-CB 4.22Å; F202-I267 HydrophobicContact CD1-CG1 3.88Å; F202-I267 HydrophobicContact CD1-CG2 4.31Å; F202-I267 HydrophobicContact CE1-CB 4.49Å; F202-I267 HydrophobicContact CE1-CG1 4.03Å
203	W	96.6	Very high	95.4	Very high	13 Å²	13	58.1 Å²	58.1	5%	0.049	27%	0.271	C	S	.	.	H	α-helix	trans	-58	-45.5	-179.8	176.1	83.6	0	0	0	112.2	M178 Q184 N199 V200 A206 K207 Y268 M271	M178-W203 HydrophobicContact CE-CE3 4.02Å; M178-W203 HydrophobicContact CE-CH2 3.82Å; M178-W203 HydrophobicContact CE-CZ2 4.38Å; M178-W203 HydrophobicContact CE-CZ3 3.65Å; Q184-W203 HydrophobicContact CG-CZ3 4.41Å; N199-W203 WeakPolarHBondContact O-CB 3.48Å; N199-W203 PolarHBondContact O-N 3.5Å; V200-W203 PolarHBondContact O-N 2.77Å; W203-A206 PolarHBondContact O-N 3.05Å; W203-K207 HydrophobicContact CD2-CD 3.94Å; W203-K207 VanDerWaalsContact CE2-CD 3.47Å; W203-K207 HydrophobicContact CE3-CD 4.23Å; W203-K207 HydrophobicContact CH2-CD 3.79Å; W203-K207 HydrophobicContact CZ2-CD 3.41Å; W203-K207 VanDerWaalsContact CZ2-CD 3.41Å; W203-K207 HydrophobicContact CZ3-CD 4.15Å; W203-K207 PolarHBondContact O-N 2.86Å; W203-K207 VanDerWaalsContact O-N 3.13Å; W203-Y268 AromaticContact CE2-CD2 3.77Å; W203-Y268 HydrophobicContact CZ2-CD2 4.08Å; W203-Y268 HydrophobicContact CZ2-CE2 4.05Å; W203-Y268 AromaticContact NE1-CD2 3.4Å; W203-M271 HydrophobicContact CB-CE 4.04Å; W203-M271 HydrophobicContact CG-CE 4.14Å
204	T	95.1	Very high	95.6	Very high	45 Å²	45	58 Å²	58	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-62.6	-46	176.9	-59.4	0	0	0	0	111.8	V200 K201 F202 K207 Q208	V200-T204 WeakPolarHBondContact O-CB 3.41Å; V200-T204 PolarHBondContact O-N 2.66Å; V200-T204 PolarHBondContact O-OG1 3.19Å; V200-T204 VanDerWaalsContact O-OG1 3.04Å; K201-T204 PolarHBondContact O-N 3.13Å; F202-T204 PolarHBondContact O-N 3.35Å; T204-K207 PolarHBondContact O-N 3.02Å; T204-Q208 WeakPolarHBondContact O-CG 3.48Å; T204-Q208 PolarHBondContact O-N 3.16Å; T204-Q208 VanDerWaalsContact O-N 3.08Å
205	L	96.4	Very high	95.8	Very high	54 Å²	54	57.5 Å²	57.5	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-66.7	-38.7	179.8	-73.4	170.6	0	0	0	112.3	K201 F202 K207 Q208 Y209 I225 F229	K201-L205 WeakPolarHBondContact O-CB 3.2Å; K201-L205 WeakPolarHBondContact O-CG 3.45Å; K201-L205 PolarHBondContact O-N 2.96Å; F202-L205 PolarHBondContact O-N 3.47Å; L205-K207 VanDerWaalsContact C-N 3.35Å; L205-K207 PolarHBondContact O-N 2.66Å; L205-Q208 PolarHBondContact O-N 3.07Å; L205-Y209 VanDerWaalsContact O-CB 3.24Å; L205-Y209 WeakPolarHBondContact O-CB 3.34Å; L205-Y209 PolarHBondContact O-N 3.45Å; L205-I225 HydrophobicContact CB-CD1 4.07Å; L205-I225 HydrophobicContact CB-CG1 4.21Å; L205-F229 HydrophobicContact CD1-CE2 3.58Å; L205-F229 HydrophobicContact CD1-CZ 3.98Å
206	A	97.4	Very high	96.1	Very high	2 Å²	2	55.3 Å²	55.3	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-40.8	176.4	0	0	0	0	0	111.9	F202 W203 Y209 R210 F260 E264	F202-A206 HydrophobicContact CE1-CB 4.38Å; F202-A206 HydrophobicContact CZ-CB 4.24Å; F202-A206 WeakPolarHBondContact O-CB 3.19Å; F202-A206 PolarHBondContact O-N 3.01Å; W203-A206 PolarHBondContact O-N 3.05Å; A206-Y209 PolarHBondContact O-N 3.21Å; A206-R210 PolarHBondContact O-N 3.29Å; A206-F260 HydrophobicContact CB-CB 3.91Å; A206-E264 HydrophobicContact CB-CB 4.17Å; A206-E264 HydrophobicContact CB-CG 4.28Å
207	K	94.9	Very high	96.3	Very high	66 Å²	66	60.2 Å²	60.2	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-49.4	173.2	-76	177.5	65.5	-178.9	0	111.9	W203 T204 L205 Y209 R210 E264	W203-K207 HydrophobicContact CD2-CD 3.94Å; W203-K207 VanDerWaalsContact CE2-CD 3.47Å; W203-K207 HydrophobicContact CE3-CD 4.23Å; W203-K207 HydrophobicContact CH2-CD 3.79Å; W203-K207 HydrophobicContact CZ2-CD 3.41Å; W203-K207 VanDerWaalsContact CZ2-CD 3.41Å; W203-K207 HydrophobicContact CZ3-CD 4.15Å; W203-K207 PolarHBondContact O-N 2.86Å; W203-K207 VanDerWaalsContact O-N 3.13Å; T204-K207 PolarHBondContact O-N 3.02Å; L205-K207 VanDerWaalsContact C-N 3.35Å; L205-K207 PolarHBondContact O-N 2.66Å; K207-Y209 VanDerWaalsContact C-N 3.32Å; K207-Y209 PolarHBondContact O-N 3Å; K207-R210 PolarHBondContact O-N 3.16Å; K207-E264 HydrophobicContact CG-CG 4.48Å; K207-E264 WeakPolarHBondContact CG-OE1 3.43Å
208	Q	95.8	Very high	96.5	Very high	116 Å²	116	60.3 Å²	60.3	54%	0.542	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-39.8	179.2	-71.2	174.6	-3.2	0	0	112.1	T204 L205 R210 E211	T204-Q208 WeakPolarHBondContact O-CG 3.48Å; T204-Q208 PolarHBondContact O-N 3.16Å; T204-Q208 VanDerWaalsContact O-N 3.08Å; L205-Q208 PolarHBondContact O-N 3.07Å; Q208-R210 VanDerWaalsContact C-N 3.28Å; Q208-R210 PolarHBondContact O-N 3.4Å; Q208-E211 PolarHBondContact O-N 3.41Å; Q208-E211 VanDerWaalsContact O-N 3.17Å
209	Y	98.2	Very high	96.6	Very high	1 Å²	1	64.3 Å²	64.3	0%	0.004	30%	0.295	C	S	.	.	H	α-helix	trans	-55.7	-40.8	177.5	166	-89.8	0	0	0	112.9	L205 A206 K207 E211 I212 R218 V221 A222 I225 A255 D256 L259 F260	L205-Y209 VanDerWaalsContact O-CB 3.24Å; L205-Y209 WeakPolarHBondContact O-CB 3.34Å; L205-Y209 PolarHBondContact O-N 3.45Å; A206-Y209 PolarHBondContact O-N 3.21Å; K207-Y209 VanDerWaalsContact C-N 3.32Å; K207-Y209 PolarHBondContact O-N 3Å; Y209-E211 PolarHBondContact O-N 3.32Å; Y209-I212 WeakPolarHBondContact O-CB 3.38Å; Y209-I212 PolarHBondContact O-N 2.81Å; Y209-I212 VanDerWaalsContact O-N 3.16Å; Y209-R218 HydrophobicContact CD2-CG 3.83Å; Y209-R218 HydrophobicContact CE1-CG 4.38Å; Y209-R218 HydrophobicContact CE2-CB 4.41Å; Y209-R218 HydrophobicContact CE2-CG 3.19Å; Y209-R218 WeakPolarHBondContact CE2-O 3.24Å; Y209-V221 HydrophobicContact CD2-CB 4.2Å; Y209-V221 HydrophobicContact CD2-CG1 3.9Å; Y209-A222 HydrophobicContact CE2-CB 3.65Å; Y209-I225 HydrophobicContact CD2-CD1 4.32Å; Y209-I225 HydrophobicContact CG-CD1 4.25Å; Y209-A255 WeakPolarHBondContact OH-CA 3.14Å; Y209-A255 PolarHBondContact OH-O 2.64Å; Y209-D256 VanDerWaalsContact CE1-O 3.23Å; Y209-D256 WeakPolarHBondContact CE1-O 3.46Å; Y209-D256 PolarHBondContact OH-O 2.75Å; Y209-L259 HydrophobicContact CE1-CB 4.15Å; Y209-F260 AromaticContact CD1-CD2 3.49Å; Y209-F260 HydrophobicContact CD1-CD2 3.49Å; Y209-F260 VanDerWaalsContact CD1-CD2 3.49Å; Y209-F260 AromaticContact CD1-CE2 3.89Å; Y209-F260 HydrophobicContact CD1-CE2 3.89Å; Y209-F260 HydrophobicContact CD2-CD2 4.33Å; Y209-F260 AromaticContact CD2-CE2 3.92Å; Y209-F260 HydrophobicContact CD2-CE2 3.92Å; Y209-F260 AromaticContact CE1-CD2 3.69Å; Y209-F260 HydrophobicContact CE1-CD2 3.69Å; Y209-F260 AromaticContact CE1-CE2 3.88Å; Y209-F260 HydrophobicContact CE1-CE2 3.88Å; Y209-F260 HydrophobicContact CE2-CD2 4.48Å; Y209-F260 AromaticContact CE2-CE2 3.9Å; Y209-F260 HydrophobicContact CE2-CE2 3.9Å; Y209-F260 AromaticContact CG-CD2 3.84Å; Y209-F260 HydrophobicContact CG-CD2 3.84Å; Y209-F260 AromaticContact CG-CE2 3.9Å; Y209-F260 HydrophobicContact CG-CE2 3.9Å; Y209-F260 AromaticContact CZ-CE2 3.88Å
210	R	96.2	Very high	96.7	Very high	80 Å²	80	66.8 Å²	66.8	30%	0.302	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-29.5	-178.7	-174.5	172.1	65.3	-146.4	1.2	112.8	A206 K207 Q208 I212 E264	A206-R210 PolarHBondContact O-N 3.29Å; K207-R210 PolarHBondContact O-N 3.16Å; Q208-R210 VanDerWaalsContact C-N 3.28Å; Q208-R210 PolarHBondContact O-N 3.4Å; R210-I212 VanDerWaalsContact C-N 3.34Å; R210-E264 IonicContact NH1-OE1 2.96Å; R210-E264 IonicContact NH1-OE2 3.92Å; R210-E264 PolarHBondContact NH1-OE2 3.43Å
211	E	96.7	Very high	96.8	Very high	126 Å²	126	68 Å²	68	59%	0.589	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.5	-179.2	-51.4	-53.2	132.1	0	0	113.1	Q208 Y209 E213	Q208-E211 PolarHBondContact O-N 3.41Å; Q208-E211 VanDerWaalsContact O-N 3.17Å; Y209-E211 PolarHBondContact O-N 3.32Å; E211-E213 PolarHBondContact O-N 3.07Å
212	I	97.4	Very high	97	Very high	23 Å²	23	64 Å²	64	12%	0.118	31%	0.307	C	S	.	.			trans	-76	115.9	178.9	-56.3	175.5	0	0	0	109.9	Y209 R210 Q217 R218 V221	Y209-I212 WeakPolarHBondContact O-CB 3.38Å; Y209-I212 PolarHBondContact O-N 2.81Å; Y209-I212 VanDerWaalsContact O-N 3.16Å; R210-I212 VanDerWaalsContact C-N 3.34Å; I212-Q217 HydrophobicContact CG2-CB 4Å; I212-Q217 HydrophobicContact CG2-CG 4.01Å; I212-R218 HydrophobicContact CB-CB 4.13Å; I212-R218 HydrophobicContact CB-CG 4.24Å; I212-R218 HydrophobicContact CG2-CB 3.79Å; I212-R218 HydrophobicContact CG2-CG 4.45Å; I212-R218 WeakPolarHBondContact O-CD 3.26Å; I212-R218 PolarHBondContact O-NH1 3.34Å; I212-V221 HydrophobicContact CD1-CB 3.93Å; I212-V221 HydrophobicContact CD1-CG1 4.08Å; I212-V221 HydrophobicContact CD1-CG2 3.69Å
213	E	97.2	Very high	97	Very high	134 Å²	134	66 Å²	66	63%	0.626	32%	0.32	S	S	*	.			trans	-80.6	-43.6	177.6	-66.7	-57.2	149	0	0	113	E211 L215 R218 K257	E211-E213 PolarHBondContact O-N 3.07Å; E213-L215 PolarHBondContact O-N 3.28Å; E213-R218 PolarHBondContact O-NH1 3.41Å; E213-K257 IonicContact OE1-NZ 3.87Å; E213-K257 PolarHBondContact OE1-NZ 3.37Å; E213-K257 IonicContact OE2-NZ 2.78Å; E213-K257 PolarHBondContact OE2-NZ 2.8Å
214	D	97.5	Very high	97	Very high	89 Å²	89	71.1 Å²	71.1	48%	0.476	34%	0.344	S	S	.	.			trans	-67.3	119.6	-178.7	178	62.5	0	0	0	111.6	K216 Q217 R218	D214-K216 VanDerWaalsContact C-N 3.3Å; D214-K216 PolarHBondContact O-N 2.92Å; D214-K216 WeakPolarHBondContact OD2-CB 3.39Å; D214-K216 PolarHBondContact OD2-N 2.79Å; D214-Q217 HydrophobicContact CB-CB 4.14Å; D214-Q217 PolarHBondContact O-N 2.96Å; D214-Q217 WeakPolarHBondContact OD2-CB 3.3Å; D214-Q217 PolarHBondContact OD2-N 2.97Å; D214-R218 VanDerWaalsContact O-CB 3.32Å; D214-R218 WeakPolarHBondContact O-CB 3.41Å; D214-R218 PolarHBondContact O-N 3.48Å
215	L	96.8	Very high	97.1	Very high	71 Å²	71	69.1 Å²	69.1	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-34.8	-175.9	-179.5	63	0	0	0	112.5	E213 R218 R219 A255	E213-L215 PolarHBondContact O-N 3.28Å; L215-R218 PolarHBondContact O-N 3.29Å; L215-R219 HydrophobicContact CD1-CG 4.37Å; L215-R219 WeakPolarHBondContact O-CB 3.31Å; L215-R219 WeakPolarHBondContact O-CG 3.38Å; L215-R219 PolarHBondContact O-N 3.15Å; L215-A255 HydrophobicContact CD1-CB 4.32Å
216	K	96.8	Very high	97.2	Very high	171 Å²	171	67.9 Å²	67.9	74%	0.743	32%	0.323	S	S	*	.	H	α-helix	trans	-68.6	-47.1	-178.5	-176.9	-175.9	177.3	-175.1	0	110.4	D214 R219 A220	D214-K216 VanDerWaalsContact C-N 3.3Å; D214-K216 PolarHBondContact O-N 2.92Å; D214-K216 WeakPolarHBondContact OD2-CB 3.39Å; D214-K216 PolarHBondContact OD2-N 2.79Å; K216-R219 PolarHBondContact O-N 3.35Å; K216-A220 PolarHBondContact O-N 3.41Å; K216-A220 VanDerWaalsContact O-N 3.13Å
217	Q	97.3	Very high	97.1	Very high	113 Å²	113	73.9 Å²	73.9	53%	0.528	35%	0.349	S	S	.	.	H	α-helix	trans	-61.3	-45	173.1	-173.4	178.3	5.2	0	0	110.8	I212 D214 R219 A220 V221	I212-Q217 HydrophobicContact CG2-CB 4Å; I212-Q217 HydrophobicContact CG2-CG 4.01Å; D214-Q217 HydrophobicContact CB-CB 4.14Å; D214-Q217 PolarHBondContact O-N 2.96Å; D214-Q217 WeakPolarHBondContact OD2-CB 3.3Å; D214-Q217 PolarHBondContact OD2-N 2.97Å; Q217-R219 VanDerWaalsContact C-N 3.34Å; Q217-R219 PolarHBondContact O-N 3.48Å; Q217-A220 WeakPolarHBondContact O-CB 3.44Å; Q217-A220 PolarHBondContact O-N 2.99Å; Q217-A220 VanDerWaalsContact O-N 3.13Å; Q217-V221 WeakPolarHBondContact O-CG2 3.29Å; Q217-V221 PolarHBondContact O-N 3.24Å
218	R	97.9	Very high	97.2	Very high	29 Å²	29	73.1 Å²	73.1	11%	0.109	35%	0.35	C	S	.	.	H	α-helix	trans	-61.1	-41.5	179.1	-164.4	165.9	64.2	-130.4	1.1	111.7	Y209 I212 E213 D214 L215 A220 V221 A222 A255 K257	Y209-R218 HydrophobicContact CD2-CG 3.83Å; Y209-R218 HydrophobicContact CE1-CG 4.38Å; Y209-R218 HydrophobicContact CE2-CB 4.41Å; Y209-R218 HydrophobicContact CE2-CG 3.19Å; Y209-R218 WeakPolarHBondContact CE2-O 3.24Å; I212-R218 HydrophobicContact CB-CB 4.13Å; I212-R218 HydrophobicContact CB-CG 4.24Å; I212-R218 HydrophobicContact CG2-CB 3.79Å; I212-R218 HydrophobicContact CG2-CG 4.45Å; I212-R218 WeakPolarHBondContact O-CD 3.26Å; I212-R218 PolarHBondContact O-NH1 3.34Å; E213-R218 PolarHBondContact O-NH1 3.41Å; D214-R218 VanDerWaalsContact O-CB 3.32Å; D214-R218 WeakPolarHBondContact O-CB 3.41Å; D214-R218 PolarHBondContact O-N 3.48Å; L215-R218 PolarHBondContact O-N 3.29Å; R218-A220 PolarHBondContact O-N 2.88Å; R218-V221 PolarHBondContact O-N 3.12Å; R218-A222 WeakPolarHBondContact O-CB 3.42Å; R218-A222 PolarHBondContact O-N 2.6Å; R218-A255 HydrophobicContact CG-CB 4.27Å; R218-A255 PolarHBondContact NE-O 3.22Å; R218-A255 PolarHBondContact NH2-O 3.35Å; R218-K257 VanDerWaalsContact NH1-CE 3.28Å
219	R	97.8	Very high	97.3	Very high	124 Å²	124	68 Å²	68	47%	0.468	33%	0.326	S	S	.	.	H	α-helix	trans	-60.9	-41.5	173	-80.2	179.1	170.6	158.5	3.1	113.5	L215 K216 Q217 T223 E253 A255	L215-R219 HydrophobicContact CD1-CG 4.37Å; L215-R219 WeakPolarHBondContact O-CB 3.31Å; L215-R219 WeakPolarHBondContact O-CG 3.38Å; L215-R219 PolarHBondContact O-N 3.15Å; K216-R219 PolarHBondContact O-N 3.35Å; Q217-R219 VanDerWaalsContact C-N 3.34Å; Q217-R219 PolarHBondContact O-N 3.48Å; R219-T223 WeakPolarHBondContact O-CB 3.25Å; R219-T223 PolarHBondContact O-N 2.9Å; R219-T223 PolarHBondContact O-OG1 2.92Å; R219-E253 PolarHBondContact NE-O 2.93Å; R219-A255 HydrophobicContact CB-CB 4.19Å; R219-A255 HydrophobicContact CG-CB 3.43Å; R219-A255 VanDerWaalsContact CG-CB 3.43Å
220	A	97.6	Very high	97.3	Very high	59 Å²	59	68 Å²	68	49%	0.488	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-48.1	176.7	0	0	0	0	0	110.9	K216 Q217 R218 T223 E224	K216-A220 PolarHBondContact O-N 3.41Å; K216-A220 VanDerWaalsContact O-N 3.13Å; Q217-A220 WeakPolarHBondContact O-CB 3.44Å; Q217-A220 PolarHBondContact O-N 2.99Å; Q217-A220 VanDerWaalsContact O-N 3.13Å; R218-A220 PolarHBondContact O-N 2.88Å; A220-T223 PolarHBondContact O-N 2.69Å; A220-E224 PolarHBondContact O-N 3.33Å
221	V	97.5	Very high	97.2	Very high	29 Å²	29	65 Å²	65	18%	0.176	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-40.1	178.3	178.6	0	0	0	0	111.8	Y209 I212 Q217 R218 T223 E224 I225	Y209-V221 HydrophobicContact CD2-CB 4.2Å; Y209-V221 HydrophobicContact CD2-CG1 3.9Å; I212-V221 HydrophobicContact CD1-CB 3.93Å; I212-V221 HydrophobicContact CD1-CG1 4.08Å; I212-V221 HydrophobicContact CD1-CG2 3.69Å; Q217-V221 WeakPolarHBondContact O-CG2 3.29Å; Q217-V221 PolarHBondContact O-N 3.24Å; R218-V221 PolarHBondContact O-N 3.12Å; V221-T223 VanDerWaalsContact C-N 3.29Å; V221-T223 PolarHBondContact O-N 3.02Å; V221-E224 PolarHBondContact O-N 2.98Å; V221-I225 HydrophobicContact CG1-CD1 3.73Å; V221-I225 HydrophobicContact CG1-CG1 4.17Å; V221-I225 WeakPolarHBondContact O-CB 3.42Å; V221-I225 WeakPolarHBondContact O-CG1 3.3Å; V221-I225 PolarHBondContact O-N 3.36Å
222	A	98.2	Very high	96.8	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-45.1	173.8	0	0	0	0	0	111.6	Y209 R218 Y226 A255 L259 F260	Y209-A222 HydrophobicContact CE2-CB 3.65Å; R218-A222 WeakPolarHBondContact O-CB 3.42Å; R218-A222 PolarHBondContact O-N 2.6Å; A222-Y226 VanDerWaalsContact O-CB 3.27Å; A222-Y226 WeakPolarHBondContact O-CB 3.37Å; A222-Y226 PolarHBondContact O-N 3.12Å; A222-A255 HydrophobicContact CB-CB 4.2Å; A222-L259 HydrophobicContact CB-CD2 4.09Å; A222-F260 HydrophobicContact CB-CE2 4.39Å; A222-F260 HydrophobicContact CB-CZ 4.38Å
223	T	97.5	Very high	96.5	Very high	42 Å²	42	69.4 Å²	69.4	26%	0.258	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-41.6	178.9	-57	0	0	0	0	111.3	R219 A220 V221 K227 Y252	R219-T223 WeakPolarHBondContact O-CB 3.25Å; R219-T223 PolarHBondContact O-N 2.9Å; R219-T223 PolarHBondContact O-OG1 2.92Å; A220-T223 PolarHBondContact O-N 2.69Å; V221-T223 VanDerWaalsContact C-N 3.29Å; V221-T223 PolarHBondContact O-N 3.02Å; T223-K227 HydrophobicContact CG2-CD 4.01Å; T223-K227 HydrophobicContact CG2-CG 4.5Å; T223-K227 WeakPolarHBondContact O-CB 3.37Å; T223-K227 VanDerWaalsContact O-CG 3.31Å; T223-K227 WeakPolarHBondContact O-CG 3.35Å; T223-K227 PolarHBondContact O-N 2.88Å; T223-Y252 HydrophobicContact CG2-CE2 4.35Å
224	E	96.8	Very high	96.3	Very high	120 Å²	120	63.6 Å²	63.6	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-63.8	-49.8	177	-174.8	-179.6	171.6	0	0	111.8	A220 V221 Y226 K227 T228	A220-E224 PolarHBondContact O-N 3.33Å; V221-E224 PolarHBondContact O-N 2.98Å; E224-Y226 VanDerWaalsContact C-N 3.34Å; E224-Y226 PolarHBondContact O-N 3.2Å; E224-K227 PolarHBondContact O-N 3.42Å; E224-T228 VanDerWaalsContact O-CB 3.24Å; E224-T228 WeakPolarHBondContact O-CB 3.34Å; E224-T228 PolarHBondContact O-N 3.48Å; E224-T228 PolarHBondContact O-OG1 3.18Å
225	I	97.6	Very high	95.8	Very high	2 Å²	2	69.3 Å²	69.3	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-58.8	-47.5	177.1	-68.8	172.7	0	0	0	110.1	F202 L205 Y209 V221 K227 T228 F229 F260	F202-I225 HydrophobicContact CD2-CG2 3.97Å; F202-I225 HydrophobicContact CE2-CG2 3.7Å; L205-I225 HydrophobicContact CB-CD1 4.07Å; L205-I225 HydrophobicContact CB-CG1 4.21Å; Y209-I225 HydrophobicContact CD2-CD1 4.32Å; Y209-I225 HydrophobicContact CG-CD1 4.25Å; V221-I225 HydrophobicContact CG1-CD1 3.73Å; V221-I225 HydrophobicContact CG1-CG1 4.17Å; V221-I225 WeakPolarHBondContact O-CB 3.42Å; V221-I225 WeakPolarHBondContact O-CG1 3.3Å; V221-I225 PolarHBondContact O-N 3.36Å; I225-K227 PolarHBondContact O-N 2.9Å; I225-T228 PolarHBondContact O-N 3.29Å; I225-F229 HydrophobicContact CG2-CD2 4.31Å; I225-F229 PolarHBondContact O-N 3.03Å; I225-F260 HydrophobicContact CB-CE1 4.31Å; I225-F260 HydrophobicContact CB-CE2 4.13Å; I225-F260 HydrophobicContact CB-CZ 3.79Å; I225-F260 HydrophobicContact CD1-CD2 4.19Å; I225-F260 HydrophobicContact CD1-CE2 3.84Å; I225-F260 HydrophobicContact CD1-CZ 4.4Å; I225-F260 HydrophobicContact CG2-CD1 4.05Å; I225-F260 HydrophobicContact CG2-CD2 4.4Å; I225-F260 HydrophobicContact CG2-CE1 3.59Å; I225-F260 HydrophobicContact CG2-CE2 3.98Å; I225-F260 HydrophobicContact CG2-CG 4.43Å; I225-F260 HydrophobicContact CG2-CZ 3.56Å
226	Y	97.7	Very high	95.6	Very high	29 Å²	29	68.8 Å²	68.8	11%	0.114	35%	0.345	C	S	.	.	I	π-helix	trans	-58.3	-51.8	179.2	176	-105.3	0	0	0	111.9	A222 E224 T228 I230 S231 I248 S249 Y252	A222-Y226 VanDerWaalsContact O-CB 3.27Å; A222-Y226 WeakPolarHBondContact O-CB 3.37Å; A222-Y226 PolarHBondContact O-N 3.12Å; E224-Y226 VanDerWaalsContact C-N 3.34Å; E224-Y226 PolarHBondContact O-N 3.2Å; Y226-T228 VanDerWaalsContact C-N 3.29Å; Y226-T228 PolarHBondContact O-N 2.9Å; Y226-I230 HydrophobicContact CD2-CB 3.72Å; Y226-I230 HydrophobicContact CD2-CG2 3.81Å; Y226-I230 HydrophobicContact CE2-CB 4.14Å; Y226-I230 HydrophobicContact CE2-CG2 3.86Å; Y226-I230 WeakPolarHBondContact O-CA 3.3Å; Y226-I230 PolarHBondContact O-N 3.44Å; Y226-S231 PolarHBondContact O-N 3.37Å; Y226-I248 HydrophobicContact CD2-CG2 3.96Å; Y226-S249 WeakPolarHBondContact CE2-OG 3.27Å; Y226-S249 PolarHBondContact OH-OG 2.79Å; Y226-Y252 HydrophobicContact CD1-CD1 4.18Å; Y226-Y252 HydrophobicContact CD1-CD2 4.12Å; Y226-Y252 HydrophobicContact CD1-CE1 4.13Å; Y226-Y252 HydrophobicContact CD1-CE2 4.04Å; Y226-Y252 HydrophobicContact CD1-CG 4.19Å; Y226-Y252 HydrophobicContact CD2-CD1 4.34Å; Y226-Y252 HydrophobicContact CD2-CG 4.31Å; Y226-Y252 HydrophobicContact CE1-CD1 4.33Å; Y226-Y252 HydrophobicContact CE1-CE1 4.06Å; Y226-Y252 HydrophobicContact CE2-CD1 4.49Å; Y226-Y252 HydrophobicContact CG-CD1 4.18Å; Y226-Y252 HydrophobicContact CG-CD2 4.08Å; Y226-Y252 HydrophobicContact CG-CE2 4.47Å; Y226-Y252 AromaticContact CG-CG 3.93Å; Y226-Y252 HydrophobicContact CG-CG 3.93Å
227	K	96.7	Very high	95.4	Very high	128 Å²	128	64.8 Å²	64.8	56%	0.557	33%	0.329	S	S	*	.	I	π-helix	trans	-66.8	-29.4	-178.5	-72.5	179.8	178.7	-179.9	0	113.3	T223 E224 I225	T223-K227 HydrophobicContact CG2-CD 4.01Å; T223-K227 HydrophobicContact CG2-CG 4.5Å; T223-K227 WeakPolarHBondContact O-CB 3.37Å; T223-K227 VanDerWaalsContact O-CG 3.31Å; T223-K227 WeakPolarHBondContact O-CG 3.35Å; T223-K227 PolarHBondContact O-N 2.88Å; E224-K227 PolarHBondContact O-N 3.42Å; I225-K227 PolarHBondContact O-N 2.9Å
228	T	97	Very high	95.3	Very high	50 Å²	50	59.5 Å²	59.5	31%	0.307	31%	0.305	S	S	.	.	I	π-helix	trans	-85.3	-36.1	-175.4	-54.5	0	0	0	0	112.6	E224 I225 Y226 A234 T236	E224-T228 VanDerWaalsContact O-CB 3.24Å; E224-T228 WeakPolarHBondContact O-CB 3.34Å; E224-T228 PolarHBondContact O-N 3.48Å; E224-T228 PolarHBondContact O-OG1 3.18Å; I225-T228 PolarHBondContact O-N 3.29Å; Y226-T228 VanDerWaalsContact C-N 3.29Å; Y226-T228 PolarHBondContact O-N 2.9Å; T228-A234 WeakPolarHBondContact O-CB 3.34Å; T228-T236 CarbonylContact O-C 3.47Å; T228-T236 PolarHBondContact O-OG1 2.85Å
229	F	97.5	Very high	95.1	Very high	9 Å²	9	62 Å²	62	4%	0.039	33%	0.327	C	S	.	.	I	π-helix	trans	-122.7	-24.4	-169.2	-59.3	-73.7	0	0	0	115	E198 K201 F202 L205 I225 T236 E237 I238	E198-F229 HydrophobicContact CB-CD1 4.43Å; E198-F229 HydrophobicContact CB-CE1 4.3Å; K201-F229 HydrophobicContact CB-CE1 4.16Å; K201-F229 HydrophobicContact CB-CZ 4.01Å; F202-F229 HydrophobicContact CB-CD1 4.02Å; F202-F229 HydrophobicContact CB-CD2 4.38Å; F202-F229 HydrophobicContact CB-CE1 4.31Å; F202-F229 HydrophobicContact CB-CG 4.05Å; F202-F229 HydrophobicContact CD2-CB 3.81Å; F202-F229 HydrophobicContact CD2-CD2 4.03Å; F202-F229 AromaticContact CD2-CG 3.95Å; F202-F229 HydrophobicContact CD2-CG 3.95Å; F202-F229 HydrophobicContact CG-CG 4.45Å; L205-F229 HydrophobicContact CD1-CE2 3.58Å; L205-F229 HydrophobicContact CD1-CZ 3.98Å; I225-F229 HydrophobicContact CG2-CD2 4.31Å; I225-F229 PolarHBondContact O-N 3.03Å; F229-T236 WeakPolarHBondContact CD1-O 3.19Å; F229-E237 WeakPolarHBondContact O-CA 3.46Å; F229-I238 HydrophobicContact CB-CD1 4.4Å; F229-I238 HydrophobicContact CB-CG1 4.39Å; F229-I238 HydrophobicContact CB-CG2 4.06Å; F229-I238 HydrophobicContact CD1-CG2 3.94Å; F229-I238 HydrophobicContact CG-CG2 4.39Å; F229-I238 WeakPolarHBondContact O-CG1 3.42Å; F229-I238 PolarHBondContact O-N 2.91Å
230	I	96.8	Very high	94.9	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	I	π-helix	trans	-115.7	-35.7	-165.5	-51.1	-66.9	0	0	0	113.3	F202 Y226 I238 I240 R245 I248	F202-I230 HydrophobicContact CE2-CD1 3.9Å; F202-I230 HydrophobicContact CE2-CG1 4.44Å; F202-I230 HydrophobicContact CZ-CD1 4.31Å; Y226-I230 HydrophobicContact CD2-CB 3.72Å; Y226-I230 HydrophobicContact CD2-CG2 3.81Å; Y226-I230 HydrophobicContact CE2-CB 4.14Å; Y226-I230 HydrophobicContact CE2-CG2 3.86Å; Y226-I230 WeakPolarHBondContact O-CA 3.3Å; Y226-I230 PolarHBondContact O-N 3.44Å; I230-I238 HydrophobicContact CD1-CD1 3.42Å; I230-I238 VanDerWaalsContact CD1-CD1 3.42Å; I230-I238 HydrophobicContact CD1-CG1 3.87Å; I230-I240 HydrophobicContact CD1-CD1 3.73Å; I230-I240 HydrophobicContact CG2-CD1 4.37Å; I230-R245 HydrophobicContact CG2-CG 3.94Å; I230-R245 PolarHBondContact O-NH1 2.96Å; I230-I248 HydrophobicContact CD1-CD1 4.3Å; I230-I248 HydrophobicContact CG1-CG2 4.48Å; I230-I248 HydrophobicContact CG2-CB 4.3Å; I230-I248 HydrophobicContact CG2-CG2 4.05Å
231	S	94.6	Very high	94.8	Very high	18 Å²	18	57.9 Å²	57.9	13%	0.126	31%	0.305	C	S	.	.	S	Bend	trans	-56.8	144.4	-179.5	-178.1	0	0	0	0	110.5	Y226 D233 A234	Y226-S231 PolarHBondContact O-N 3.37Å; S231-D233 PolarHBondContact O-N 3.1Å; S231-D233 VanDerWaalsContact O-N 3.1Å; S231-D233 PolarHBondContact OG-N 3.2Å; S231-A234 WeakPolarHBondContact O-CB 3.46Å; S231-A234 PolarHBondContact O-N 3.14Å
232	P	89.1	Confident	94.6	Very high	91 Å²	91	58.9 Å²	58.9	59%	0.591	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.8	172.4	-25.3	35.1	0	0	0	113.8
233	D	90.8	Very high	94.6	Very high	149 Å²	149	62.5 Å²	62.5	80%	0.797	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	11.8	177.4	-56.9	-49.4	0	0	0	112.6	S231 K235	S231-D233 PolarHBondContact O-N 3.1Å; S231-D233 VanDerWaalsContact O-N 3.1Å; S231-D233 PolarHBondContact OG-N 3.2Å; D233-K235 PolarHBondContact O-N 3.33Å
234	A	92.7	Very high	94.6	Very high	13 Å²	13	61.5 Å²	61.5	11%	0.107	34%	0.34	C	S	.	.			trans	-65.1	130.3	-179.6	0	0	0	0	0	110.9	T228 S231 T236 E237	T228-A234 WeakPolarHBondContact O-CB 3.34Å; S231-A234 WeakPolarHBondContact O-CB 3.46Å; S231-A234 PolarHBondContact O-N 3.14Å; A234-T236 PolarHBondContact O-N 2.97Å; A234-E237 HydrophobicContact CB-CB 4.17Å
235	K	87.8	Confident	94.6	Very high	208 Å²	208	57.6 Å²	57.6	90%	0.904	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.4	177.5	-68.8	-176.5	178.9	-178.3	0	113.2	D233	D233-K235 PolarHBondContact O-N 3.33Å
236	T	91.4	Very high	94.5	Very high	60 Å²	60	59.6 Å²	59.6	37%	0.368	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.8	58.2	-176.5	47.9	0	0	0	0	109.2	T228 F229 A234 I238	T228-T236 CarbonylContact O-C 3.47Å; T228-T236 PolarHBondContact O-OG1 2.85Å; F229-T236 WeakPolarHBondContact CD1-O 3.19Å; A234-T236 PolarHBondContact O-N 2.97Å; T236-I238 PolarHBondContact O-N 3.21Å
237	E	93.2	Very high	94.5	Very high	88 Å²	88	62 Å²	62	41%	0.411	35%	0.349	S	S	.	.			trans	-63.8	128.7	-176.8	-169.6	-174.2	-177.8	0	0	111.8	F229 A234 R245	F229-E237 WeakPolarHBondContact O-CA 3.46Å; A234-E237 HydrophobicContact CB-CB 4.17Å; E237-R245 IonicContact OE1-CZ 2.87Å; E237-R245 IonicContact OE1-NE 2.68Å; E237-R245 IonicContact OE1-NH1 3.1Å; E237-R245 PolarHBondContact OE1-NH1 3.48Å; E237-R245 IonicContact OE1-NH2 2.98Å; E237-R245 PolarHBondContact OE1-NH2 3.4Å
238	I	95.4	Very high	94.6	Very high	1 Å²	1	56 Å²	56	1%	0.005	32%	0.323	C	S	.	.			trans	-83.3	150.1	173	64.9	179.3	0	0	0	111.2	E198 F202 F229 I230 T236 I240 R245 I267	E198-I238 HydrophobicContact CB-CG2 4.44Å; E198-I238 HydrophobicContact CG-CG2 4.11Å; F202-I238 HydrophobicContact CB-CD1 4.36Å; F202-I238 HydrophobicContact CB-CG2 3.9Å; F202-I238 HydrophobicContact CD1-CD1 3.53Å; F202-I238 HydrophobicContact CD2-CD1 3.66Å; F202-I238 HydrophobicContact CE1-CD1 3.63Å; F202-I238 HydrophobicContact CE2-CD1 3.76Å; F202-I238 HydrophobicContact CG-CD1 3.55Å; F202-I238 HydrophobicContact CG-CG2 4.23Å; F202-I238 HydrophobicContact CZ-CD1 3.75Å; F229-I238 HydrophobicContact CB-CD1 4.4Å; F229-I238 HydrophobicContact CB-CG1 4.39Å; F229-I238 HydrophobicContact CB-CG2 4.06Å; F229-I238 HydrophobicContact CD1-CG2 3.94Å; F229-I238 HydrophobicContact CG-CG2 4.39Å; F229-I238 WeakPolarHBondContact O-CG1 3.42Å; F229-I238 PolarHBondContact O-N 2.91Å; I230-I238 HydrophobicContact CD1-CD1 3.42Å; I230-I238 VanDerWaalsContact CD1-CD1 3.42Å; I230-I238 HydrophobicContact CD1-CG1 3.87Å; T236-I238 PolarHBondContact O-N 3.21Å; I238-I240 HydrophobicContact CD1-CG2 3.78Å; I238-I240 HydrophobicContact CG1-CG1 4.36Å; I238-I240 HydrophobicContact CG1-CG2 3.97Å; I238-I240 PolarHBondContact O-N 3.04Å; I238-R245 PolarHBondContact O-NH2 3.36Å; I238-I267 HydrophobicContact CB-CD1 3.9Å; I238-I267 HydrophobicContact CD1-CD1 4.09Å; I238-I267 HydrophobicContact CD1-CG1 3.91Å; I238-I267 HydrophobicContact CG1-CD1 4.27Å
239	S	93.6	Very high	94.6	Very high	83 Å²	83	55.4 Å²	55.4	58%	0.58	32%	0.321	S	S	*	.			trans	-84.6	88.6	177.9	-68.4	0	0	0	0	111.4	F266	S239-F266 VanDerWaalsContact O-CE1 3.23Å; S239-F266 WeakPolarHBondContact O-CE1 3.44Å
240	I	94.6	Very high	94.5	Very high	17 Å²	17	62.3 Å²	62.3	9%	0.087	35%	0.354	C	S	.	.			trans	-116.9	158.5	173.6	57.2	168.7	0	0	0	112.4	I230 I238 I244 R245 I248 A263 F266 I267	I230-I240 HydrophobicContact CD1-CD1 3.73Å; I230-I240 HydrophobicContact CG2-CD1 4.37Å; I238-I240 HydrophobicContact CD1-CG2 3.78Å; I238-I240 HydrophobicContact CG1-CG1 4.36Å; I238-I240 HydrophobicContact CG1-CG2 3.97Å; I238-I240 PolarHBondContact O-N 3.04Å; I240-I244 HydrophobicContact CD1-CB 4.41Å; I240-I244 HydrophobicContact CD1-CG2 4.05Å; I240-R245 HydrophobicContact CD1-CB 3.96Å; I240-R245 HydrophobicContact CG1-CB 4.29Å; I240-I248 HydrophobicContact CD1-CD1 4.43Å; I240-A263 HydrophobicContact CD1-CB 4.41Å; I240-A263 HydrophobicContact CG2-CB 4.29Å; I240-F266 HydrophobicContact CB-CD1 4.41Å; I240-F266 HydrophobicContact CG2-CD1 4.02Å; I240-I267 HydrophobicContact CG2-CD1 3.7Å; I240-I267 HydrophobicContact CG2-CG1 3.85Å
241	D	94.1	Very high	94.5	Very high	78 Å²	78	64.8 Å²	64.8	42%	0.417	37%	0.367	S	S	.	.			trans	-57.4	142.8	174.7	-173.4	-91.7	0	0	0	112.4	S243 I244 R245 F266	D241-S243 PolarHBondContact O-N 2.73Å; D241-S243 VanDerWaalsContact OD1-CB 3.23Å; D241-S243 WeakPolarHBondContact OD1-CB 3.43Å; D241-S243 PolarHBondContact OD1-N 3.29Å; D241-S243 PolarHBondContact OD1-OG 2.99Å; D241-I244 HydrophobicContact CB-CD1 4.12Å; D241-I244 HydrophobicContact CB-CG1 4.21Å; D241-I244 PolarHBondContact O-N 3.01Å; D241-I244 VanDerWaalsContact O-N 3.13Å; D241-R245 PolarHBondContact O-N 3.41Å; D241-F266 HydrophobicContact CB-CE2 4.19Å
242	G	94.7	Very high	94.6	Very high	51 Å²	51	65.8 Å²	65.8	53%	0.526	37%	0.368	S	S	.	.	H	α-helix	trans	-59.1	-31.8	-178	0	0	0	0	0	113.7	A246	G242-A246 WeakPolarHBondContact O-CB 3.03Å; G242-A246 PolarHBondContact O-N 3.13Å
243	S	96.7	Very high	94.9	Very high	76 Å²	76	67.6 Å²	67.6	53%	0.531	37%	0.369	S	S	.	.	H	α-helix	trans	-68.4	-42.7	176.5	67.4	0	0	0	0	112.3	D241 R245 A246 E247	D241-S243 PolarHBondContact O-N 2.73Å; D241-S243 VanDerWaalsContact OD1-CB 3.23Å; D241-S243 WeakPolarHBondContact OD1-CB 3.43Å; D241-S243 PolarHBondContact OD1-N 3.29Å; D241-S243 PolarHBondContact OD1-OG 2.99Å; S243-R245 VanDerWaalsContact C-N 3.34Å; S243-A246 PolarHBondContact O-N 3.23Å; S243-E247 PolarHBondContact O-N 3.36Å
244	I	97.1	Very high	95.1	Very high	20 Å²	20	66.2 Å²	66.2	10%	0.103	36%	0.357	C	S	.	.	H	α-helix	trans	-63.6	-44	176.7	-59.2	175.4	0	0	0	109.6	I240 D241 A246 E247 I248 K262 A263 F266	I240-I244 HydrophobicContact CD1-CB 4.41Å; I240-I244 HydrophobicContact CD1-CG2 4.05Å; D241-I244 HydrophobicContact CB-CD1 4.12Å; D241-I244 HydrophobicContact CB-CG1 4.21Å; D241-I244 PolarHBondContact O-N 3.01Å; D241-I244 VanDerWaalsContact O-N 3.13Å; I244-A246 PolarHBondContact O-N 3.02Å; I244-E247 PolarHBondContact O-N 3.38Å; I244-I248 HydrophobicContact CG2-CD1 3.96Å; I244-I248 WeakPolarHBondContact O-CG1 3.22Å; I244-I248 PolarHBondContact O-N 2.92Å; I244-K262 HydrophobicContact CD1-CB 4.44Å; I244-K262 HydrophobicContact CG1-CB 4.43Å; I244-K262 HydrophobicContact CG2-CB 4.17Å; I244-A263 HydrophobicContact CG2-CB 3.77Å; I244-F266 HydrophobicContact CD1-CB 4.08Å; I244-F266 HydrophobicContact CD1-CD2 3.91Å; I244-F266 HydrophobicContact CD1-CG 4.19Å
245	R	97.2	Very high	95.3	Very high	39 Å²	39	65.6 Å²	65.6	15%	0.147	35%	0.352	C	S	.	.	H	α-helix	trans	-61	-43.9	177.3	-171.7	-177.9	-55.1	-87.3	1.7	112.2	I230 E237 I238 I240 D241 S243 S249	I230-R245 HydrophobicContact CG2-CG 3.94Å; I230-R245 PolarHBondContact O-NH1 2.96Å; E237-R245 IonicContact OE1-CZ 2.87Å; E237-R245 IonicContact OE1-NE 2.68Å; E237-R245 IonicContact OE1-NH1 3.1Å; E237-R245 PolarHBondContact OE1-NH1 3.48Å; E237-R245 IonicContact OE1-NH2 2.98Å; E237-R245 PolarHBondContact OE1-NH2 3.4Å; I238-R245 PolarHBondContact O-NH2 3.36Å; I240-R245 HydrophobicContact CD1-CB 3.96Å; I240-R245 HydrophobicContact CG1-CB 4.29Å; D241-R245 PolarHBondContact O-N 3.41Å; S243-R245 VanDerWaalsContact C-N 3.34Å; R245-S249 WeakPolarHBondContact O-CB 3.28Å; R245-S249 PolarHBondContact O-N 2.61Å; R245-S249 PolarHBondContact O-OG 3.22Å
246	A	96.9	Very high	95.7	Very high	44 Å²	44	59.8 Å²	59.8	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-44.1	178.5	0	0	0	0	0	111.7	G242 S243 I244 I248 S249 Q250	G242-A246 WeakPolarHBondContact O-CB 3.03Å; G242-A246 PolarHBondContact O-N 3.13Å; S243-A246 PolarHBondContact O-N 3.23Å; I244-A246 PolarHBondContact O-N 3.02Å; A246-I248 PolarHBondContact O-N 3.02Å; A246-S249 PolarHBondContact O-N 3.09Å; A246-Q250 WeakPolarHBondContact O-CG 3.35Å; A246-Q250 PolarHBondContact O-N 2.97Å
247	E	96.9	Very high	96	Very high	78 Å²	78	60 Å²	60	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-59.2	-46.6	177	-178.1	178.5	168.2	0	0	111.9	S243 I244 Q250 N251 K262	S243-E247 PolarHBondContact O-N 3.36Å; I244-E247 PolarHBondContact O-N 3.38Å; E247-Q250 PolarHBondContact O-N 3.2Å; E247-N251 WeakPolarHBondContact O-CB 3.38Å; E247-N251 PolarHBondContact O-N 2.77Å; E247-N251 PolarHBondContact O-ND2 3.31Å; E247-K262 IonicContact OE1-NZ 3.69Å; E247-K262 PolarHBondContact OE1-NZ 3.48Å; E247-K262 WeakPolarHBondContact OE2-CD 3.04Å; E247-K262 IonicContact OE2-NZ 2.68Å; E247-K262 PolarHBondContact OE2-NZ 3.35Å
248	I	97.7	Very high	96.2	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-46.3	177.1	-66	166.7	0	0	0	110.4	Y226 I230 I240 I244 A246 Q250 N251 Y252 L259 F260 A263	Y226-I248 HydrophobicContact CD2-CG2 3.96Å; I230-I248 HydrophobicContact CD1-CD1 4.3Å; I230-I248 HydrophobicContact CG1-CG2 4.48Å; I230-I248 HydrophobicContact CG2-CB 4.3Å; I230-I248 HydrophobicContact CG2-CG2 4.05Å; I240-I248 HydrophobicContact CD1-CD1 4.43Å; I244-I248 HydrophobicContact CG2-CD1 3.96Å; I244-I248 WeakPolarHBondContact O-CG1 3.22Å; I244-I248 PolarHBondContact O-N 2.92Å; A246-I248 PolarHBondContact O-N 3.02Å; I248-Q250 PolarHBondContact O-N 2.85Å; I248-N251 PolarHBondContact O-N 3.26Å; I248-Y252 WeakPolarHBondContact O-CB 3.44Å; I248-Y252 PolarHBondContact O-N 2.81Å; I248-L259 HydrophobicContact CG2-CD1 4.39Å; I248-F260 HydrophobicContact CD1-CD1 4.05Å; I248-F260 HydrophobicContact CG1-CD1 4.46Å; I248-F260 HydrophobicContact CG2-CD1 4.24Å; I248-F260 HydrophobicContact CG2-CE1 3.73Å; I248-A263 HydrophobicContact CD1-CB 3.77Å
249	S	96.9	Very high	96.3	Very high	37 Å²	37	61.5 Å²	61.5	26%	0.259	34%	0.338	S	S	.	.	H	α-helix	trans	-58.7	-32.7	-178.7	-59.6	0	0	0	0	113	Y226 R245 A246 Y252	Y226-S249 WeakPolarHBondContact CE2-OG 3.27Å; Y226-S249 PolarHBondContact OH-OG 2.79Å; R245-S249 WeakPolarHBondContact O-CB 3.28Å; R245-S249 PolarHBondContact O-N 2.61Å; R245-S249 PolarHBondContact O-OG 3.22Å; A246-S249 PolarHBondContact O-N 3.09Å; S249-Y252 WeakPolarHBondContact O-CD1 3.35Å
250	Q	96.7	Very high	96.5	Very high	155 Å²	155	57.6 Å²	57.6	72%	0.724	31%	0.31	S	S	*	.	H	α-helix	trans	-79.8	-26.9	178	-71.1	174.6	7	0	0	113.4	A246 E247 I248	A246-Q250 WeakPolarHBondContact O-CG 3.35Å; A246-Q250 PolarHBondContact O-N 2.97Å; E247-Q250 PolarHBondContact O-N 3.2Å; I248-Q250 PolarHBondContact O-N 2.85Å
251	N	96.9	Very high	96.6	Very high	52 Å²	52	58.2 Å²	58.2	28%	0.278	32%	0.315	S	S	.	.	H	α-helix	trans	-116.5	-7.1	-166.9	-64.3	-62.6	0	0	0	114.8	E247 I248 E253 Q254 L259	E247-N251 WeakPolarHBondContact O-CB 3.38Å; E247-N251 PolarHBondContact O-N 2.77Å; E247-N251 PolarHBondContact O-ND2 3.31Å; I248-N251 PolarHBondContact O-N 3.26Å; N251-E253 PolarHBondContact O-N 3.48Å; N251-E253 VanDerWaalsContact O-N 3.11Å; N251-Q254 WeakPolarHBondContact O-CB 3.34Å; N251-Q254 PolarHBondContact O-N 3.32Å; N251-Q254 PolarHBondContact OD1-NE2 3.25Å; N251-L259 HydrophobicContact CB-CD1 4.04Å
252	Y	96.4	Very high	96.8	Very high	39 Å²	39	59.8 Å²	59.8	15%	0.153	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-59.6	-31.3	-169.9	79.3	-79.8	0	0	0	114.3	T223 Y226 I248 S249 Q254 A255	T223-Y252 HydrophobicContact CG2-CE2 4.35Å; Y226-Y252 HydrophobicContact CD1-CD1 4.18Å; Y226-Y252 HydrophobicContact CD1-CD2 4.12Å; Y226-Y252 HydrophobicContact CD1-CE1 4.13Å; Y226-Y252 HydrophobicContact CD1-CE2 4.04Å; Y226-Y252 HydrophobicContact CD1-CG 4.19Å; Y226-Y252 HydrophobicContact CD2-CD1 4.34Å; Y226-Y252 HydrophobicContact CD2-CG 4.31Å; Y226-Y252 HydrophobicContact CE1-CD1 4.33Å; Y226-Y252 HydrophobicContact CE1-CE1 4.06Å; Y226-Y252 HydrophobicContact CE2-CD1 4.49Å; Y226-Y252 HydrophobicContact CG-CD1 4.18Å; Y226-Y252 HydrophobicContact CG-CD2 4.08Å; Y226-Y252 HydrophobicContact CG-CE2 4.47Å; Y226-Y252 AromaticContact CG-CG 3.93Å; Y226-Y252 HydrophobicContact CG-CG 3.93Å; I248-Y252 WeakPolarHBondContact O-CB 3.44Å; I248-Y252 PolarHBondContact O-N 2.81Å; S249-Y252 WeakPolarHBondContact O-CD1 3.35Å; Y252-Q254 VanDerWaalsContact C-N 3.27Å; Y252-Q254 PolarHBondContact O-N 3.16Å; Y252-A255 PolarHBondContact O-N 2.88Å; Y252-A255 VanDerWaalsContact O-N 3.16Å
253	E	94.8	Very high	96.9	Very high	129 Å²	129	57.4 Å²	57.4	60%	0.603	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-68	-24.8	178.1	-61.3	-175.5	-179.4	0	0	113.5	R219 N251 A255	R219-E253 PolarHBondContact NE-O 2.93Å; N251-E253 PolarHBondContact O-N 3.48Å; N251-E253 VanDerWaalsContact O-N 3.11Å; E253-A255 PolarHBondContact O-N 3.03Å
254	Q	95.5	Very high	96.9	Very high	119 Å²	119	54.7 Å²	54.7	56%	0.556	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-70.7	-26.2	176.1	-59.2	174.4	31.8	0	0	111.2	N251 Y252 D256	N251-Q254 WeakPolarHBondContact O-CB 3.34Å; N251-Q254 PolarHBondContact O-N 3.32Å; N251-Q254 PolarHBondContact OD1-NE2 3.25Å; Y252-Q254 VanDerWaalsContact C-N 3.27Å; Y252-Q254 PolarHBondContact O-N 3.16Å; Q254-D256 VanDerWaalsContact C-N 3.35Å; Q254-D256 PolarHBondContact O-N 3.01Å
255	A	96.2	Very high	96.9	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.296	C	S	.	.			trans	51.7	50.2	-179	0	0	0	0	0	112.8	Y209 L215 R218 R219 A222 Y252 E253	Y209-A255 WeakPolarHBondContact OH-CA 3.14Å; Y209-A255 PolarHBondContact OH-O 2.64Å; L215-A255 HydrophobicContact CD1-CB 4.32Å; R218-A255 HydrophobicContact CG-CB 4.27Å; R218-A255 PolarHBondContact NE-O 3.22Å; R218-A255 PolarHBondContact NH2-O 3.35Å; R219-A255 HydrophobicContact CB-CB 4.19Å; R219-A255 HydrophobicContact CG-CB 3.43Å; R219-A255 VanDerWaalsContact CG-CB 3.43Å; A222-A255 HydrophobicContact CB-CB 4.2Å; Y252-A255 PolarHBondContact O-N 2.88Å; Y252-A255 VanDerWaalsContact O-N 3.16Å; E253-A255 PolarHBondContact O-N 3.03Å
256	D	97.4	Very high	97	Very high	87 Å²	87	62.3 Å²	62.3	47%	0.465	31%	0.305	S	S	.	.			trans	-63.7	143.2	170.3	-173.6	-93.9	0	0	0	110.4	Y209 Q254 N258 L259	Y209-D256 VanDerWaalsContact CE1-O 3.23Å; Y209-D256 WeakPolarHBondContact CE1-O 3.46Å; Y209-D256 PolarHBondContact OH-O 2.75Å; Q254-D256 VanDerWaalsContact C-N 3.35Å; Q254-D256 PolarHBondContact O-N 3.01Å; D256-N258 PolarHBondContact O-N 2.75Å; D256-N258 WeakPolarHBondContact OD1-CA 3.35Å; D256-N258 WeakPolarHBondContact OD1-CB 3.29Å; D256-N258 PolarHBondContact OD1-N 3.1Å; D256-L259 WeakPolarHBondContact O-CB 3.23Å; D256-L259 PolarHBondContact O-N 3.13Å; D256-L259 VanDerWaalsContact O-N 3.17Å
257	K	97.1	Very high	97	Very high	65 Å²	65	60.2 Å²	60.2	28%	0.283	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.5	-179.2	-72.9	-167.9	177.1	-173.9	0	112.7	E213 R218	E213-K257 IonicContact OE1-NZ 3.87Å; E213-K257 PolarHBondContact OE1-NZ 3.37Å; E213-K257 IonicContact OE2-NZ 2.78Å; E213-K257 PolarHBondContact OE2-NZ 2.8Å; R218-K257 VanDerWaalsContact NH1-CE 3.28Å
258	N	96.7	Very high	97	Very high	100 Å²	100	58.2 Å²	58.2	54%	0.535	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	5	-177.3	-57.8	-55.6	0	0	0	113.8	D256 F260 V261	D256-N258 PolarHBondContact O-N 2.75Å; D256-N258 WeakPolarHBondContact OD1-CA 3.35Å; D256-N258 WeakPolarHBondContact OD1-CB 3.29Å; D256-N258 PolarHBondContact OD1-N 3.1Å; N258-F260 PolarHBondContact O-N 3.41Å; N258-F260 VanDerWaalsContact O-N 3.09Å; N258-V261 HydrophobicContact CB-CG2 4.02Å; N258-V261 WeakPolarHBondContact O-CB 3.5Å; N258-V261 PolarHBondContact O-N 3.15Å
259	L	97.9	Very high	97	Very high	19 Å²	19	63.2 Å²	63.2	10%	0.099	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-43	-175.1	176	65.7	0	0	0	113.7	Y209 A222 I248 N251 D256	Y209-L259 HydrophobicContact CE1-CB 4.15Å; A222-L259 HydrophobicContact CB-CD2 4.09Å; I248-L259 HydrophobicContact CG2-CD1 4.39Å; N251-L259 HydrophobicContact CB-CD1 4.04Å; D256-L259 WeakPolarHBondContact O-CB 3.23Å; D256-L259 PolarHBondContact O-N 3.13Å; D256-L259 VanDerWaalsContact O-N 3.17Å
260	F	98	Very high	96.9	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.009	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-0.6	-175.2	-58	-65.6	0	0	0	114.4	F202 A206 Y209 A222 I225 I248 N258 K262 A263 E264	F202-F260 HydrophobicContact CE2-CD1 4.27Å; F202-F260 HydrophobicContact CZ-CB 4.34Å; F202-F260 HydrophobicContact CZ-CD1 4.39Å; A206-F260 HydrophobicContact CB-CB 3.91Å; Y209-F260 AromaticContact CD1-CD2 3.49Å; Y209-F260 HydrophobicContact CD1-CD2 3.49Å; Y209-F260 VanDerWaalsContact CD1-CD2 3.49Å; Y209-F260 AromaticContact CD1-CE2 3.89Å; Y209-F260 HydrophobicContact CD1-CE2 3.89Å; Y209-F260 HydrophobicContact CD2-CD2 4.33Å; Y209-F260 AromaticContact CD2-CE2 3.92Å; Y209-F260 HydrophobicContact CD2-CE2 3.92Å; Y209-F260 AromaticContact CE1-CD2 3.69Å; Y209-F260 HydrophobicContact CE1-CD2 3.69Å; Y209-F260 AromaticContact CE1-CE2 3.88Å; Y209-F260 HydrophobicContact CE1-CE2 3.88Å; Y209-F260 HydrophobicContact CE2-CD2 4.48Å; Y209-F260 AromaticContact CE2-CE2 3.9Å; Y209-F260 HydrophobicContact CE2-CE2 3.9Å; Y209-F260 AromaticContact CG-CD2 3.84Å; Y209-F260 HydrophobicContact CG-CD2 3.84Å; Y209-F260 AromaticContact CG-CE2 3.9Å; Y209-F260 HydrophobicContact CG-CE2 3.9Å; Y209-F260 AromaticContact CZ-CE2 3.88Å; A222-F260 HydrophobicContact CB-CE2 4.39Å; A222-F260 HydrophobicContact CB-CZ 4.38Å; I225-F260 HydrophobicContact CB-CE1 4.31Å; I225-F260 HydrophobicContact CB-CE2 4.13Å; I225-F260 HydrophobicContact CB-CZ 3.79Å; I225-F260 HydrophobicContact CD1-CD2 4.19Å; I225-F260 HydrophobicContact CD1-CE2 3.84Å; I225-F260 HydrophobicContact CD1-CZ 4.4Å; I225-F260 HydrophobicContact CG2-CD1 4.05Å; I225-F260 HydrophobicContact CG2-CD2 4.4Å; I225-F260 HydrophobicContact CG2-CE1 3.59Å; I225-F260 HydrophobicContact CG2-CE2 3.98Å; I225-F260 HydrophobicContact CG2-CG 4.43Å; I225-F260 HydrophobicContact CG2-CZ 3.56Å; I248-F260 HydrophobicContact CD1-CD1 4.05Å; I248-F260 HydrophobicContact CG1-CD1 4.46Å; I248-F260 HydrophobicContact CG2-CD1 4.24Å; I248-F260 HydrophobicContact CG2-CE1 3.73Å; N258-F260 PolarHBondContact O-N 3.41Å; N258-F260 VanDerWaalsContact O-N 3.09Å; F260-K262 VanDerWaalsContact C-N 3.31Å; F260-K262 PolarHBondContact O-N 2.82Å; F260-A263 PolarHBondContact O-N 2.92Å; F260-A263 VanDerWaalsContact O-N 3.1Å; F260-E264 WeakPolarHBondContact O-CB 3.41Å; F260-E264 PolarHBondContact O-N 3.45Å
261	V	97.4	Very high	96.9	Very high	29 Å²	29	55.5 Å²	55.5	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-38.1	-170.3	170.7	0	0	0	0	112.7	N258 K265	N258-V261 HydrophobicContact CB-CG2 4.02Å; N258-V261 WeakPolarHBondContact O-CB 3.5Å; N258-V261 PolarHBondContact O-N 3.15Å; V261-K265 HydrophobicContact CG1-CD 4.42Å; V261-K265 WeakPolarHBondContact O-CG 3.44Å; V261-K265 PolarHBondContact O-N 2.94Å; V261-K265 VanDerWaalsContact O-N 3.14Å
262	K	97.2	Very high	97	Very high	112 Å²	112	55.9 Å²	55.9	49%	0.487	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-45	176.8	-72.3	174.9	177.9	162.4	0	111.8	I244 E247 F260 F266	I244-K262 HydrophobicContact CD1-CB 4.44Å; I244-K262 HydrophobicContact CG1-CB 4.43Å; I244-K262 HydrophobicContact CG2-CB 4.17Å; E247-K262 IonicContact OE1-NZ 3.69Å; E247-K262 PolarHBondContact OE1-NZ 3.48Å; E247-K262 WeakPolarHBondContact OE2-CD 3.04Å; E247-K262 IonicContact OE2-NZ 2.68Å; E247-K262 PolarHBondContact OE2-NZ 3.35Å; F260-K262 VanDerWaalsContact C-N 3.31Å; F260-K262 PolarHBondContact O-N 2.82Å; K262-F266 WeakPolarHBondContact O-CB 3.49Å; K262-F266 PolarHBondContact O-N 2.92Å
263	A	97.7	Very high	97	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-41.4	177.3	0	0	0	0	0	111.7	F202 I240 I244 I248 F260 K265 F266 I267	F202-A263 HydrophobicContact CE1-CB 3.85Å; F202-A263 HydrophobicContact CZ-CB 3.56Å; I240-A263 HydrophobicContact CD1-CB 4.41Å; I240-A263 HydrophobicContact CG2-CB 4.29Å; I244-A263 HydrophobicContact CG2-CB 3.77Å; I248-A263 HydrophobicContact CD1-CB 3.77Å; F260-A263 PolarHBondContact O-N 2.92Å; F260-A263 VanDerWaalsContact O-N 3.1Å; A263-K265 PolarHBondContact O-N 3.45Å; A263-F266 PolarHBondContact O-N 3.03Å; A263-I267 WeakPolarHBondContact O-CB 3.31Å; A263-I267 WeakPolarHBondContact O-CG1 3.36Å; A263-I267 PolarHBondContact O-N 3.33Å
264	E	97.2	Very high	97	Very high	20 Å²	20	60.6 Å²	60.6	9%	0.093	28%	0.279	C	S	.	.	H	α-helix	trans	-54.8	-50.2	175.6	-176.6	-165	155.5	0	0	110.8	A206 K207 R210 F260 I267 Y268	A206-E264 HydrophobicContact CB-CB 4.17Å; A206-E264 HydrophobicContact CB-CG 4.28Å; K207-E264 HydrophobicContact CG-CG 4.48Å; K207-E264 WeakPolarHBondContact CG-OE1 3.43Å; R210-E264 IonicContact NH1-OE1 2.96Å; R210-E264 IonicContact NH1-OE2 3.92Å; R210-E264 PolarHBondContact NH1-OE2 3.43Å; F260-E264 WeakPolarHBondContact O-CB 3.41Å; F260-E264 PolarHBondContact O-N 3.45Å; E264-I267 PolarHBondContact O-N 3.31Å; E264-Y268 WeakPolarHBondContact O-CB 3.3Å; E264-Y268 PolarHBondContact O-N 3.23Å
265	K	97.2	Very high	97	Very high	141 Å²	141	55 Å²	55	61%	0.613	25%	0.253	S	S	*	.	H	α-helix	trans	-63.4	-44.1	176.7	-72.1	178.5	-179.3	-175.7	0	112.4	V261 A263 I267 Y268 E269	V261-K265 HydrophobicContact CG1-CD 4.42Å; V261-K265 WeakPolarHBondContact O-CG 3.44Å; V261-K265 PolarHBondContact O-N 2.94Å; V261-K265 VanDerWaalsContact O-N 3.14Å; A263-K265 PolarHBondContact O-N 3.45Å; K265-I267 PolarHBondContact O-N 3.42Å; K265-Y268 PolarHBondContact O-N 3.2Å; K265-E269 WeakPolarHBondContact O-CG 3.38Å; K265-E269 PolarHBondContact O-N 2.96Å
266	F	97.5	Very high	97.1	Very high	77 Å²	77	55.9 Å²	55.9	34%	0.338	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-46.5	179.4	-170.9	-80	0	0	0	111.5	S239 I240 D241 I244 K262 A263 E269 L270	S239-F266 VanDerWaalsContact O-CE1 3.23Å; S239-F266 WeakPolarHBondContact O-CE1 3.44Å; I240-F266 HydrophobicContact CB-CD1 4.41Å; I240-F266 HydrophobicContact CG2-CD1 4.02Å; D241-F266 HydrophobicContact CB-CE2 4.19Å; I244-F266 HydrophobicContact CD1-CB 4.08Å; I244-F266 HydrophobicContact CD1-CD2 3.91Å; I244-F266 HydrophobicContact CD1-CG 4.19Å; K262-F266 WeakPolarHBondContact O-CB 3.49Å; K262-F266 PolarHBondContact O-N 2.92Å; A263-F266 PolarHBondContact O-N 3.03Å; F266-E269 PolarHBondContact O-N 2.82Å; F266-L270 HydrophobicContact CE1-CD1 4.26Å; F266-L270 WeakPolarHBondContact O-CB 3.37Å; F266-L270 PolarHBondContact O-N 3.32Å
267	I	96.9	Very high	97.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.5	-37.4	179.7	-67.7	-62.3	0	0	0	111.9	N199 F202 I238 I240 A263 E264 K265 L270 M271	N199-I267 HydrophobicContact CB-CG2 3.77Å; N199-I267 WeakPolarHBondContact O-CG2 3.44Å; F202-I267 HydrophobicContact CD1-CB 4.22Å; F202-I267 HydrophobicContact CD1-CG1 3.88Å; F202-I267 HydrophobicContact CD1-CG2 4.31Å; F202-I267 HydrophobicContact CE1-CB 4.49Å; F202-I267 HydrophobicContact CE1-CG1 4.03Å; I238-I267 HydrophobicContact CB-CD1 3.9Å; I238-I267 HydrophobicContact CD1-CD1 4.09Å; I238-I267 HydrophobicContact CD1-CG1 3.91Å; I238-I267 HydrophobicContact CG1-CD1 4.27Å; I240-I267 HydrophobicContact CG2-CD1 3.7Å; I240-I267 HydrophobicContact CG2-CG1 3.85Å; A263-I267 WeakPolarHBondContact O-CB 3.31Å; A263-I267 WeakPolarHBondContact O-CG1 3.36Å; A263-I267 PolarHBondContact O-N 3.33Å; E264-I267 PolarHBondContact O-N 3.31Å; K265-I267 PolarHBondContact O-N 3.42Å; I267-L270 PolarHBondContact O-N 2.73Å; I267-M271 HydrophobicContact CG2-CE 4.17Å; I267-M271 HydrophobicContact CG2-CG 4.44Å; I267-M271 WeakPolarHBondContact O-CG 3.43Å; I267-M271 PolarHBondContact O-N 3.28Å
268	Y	97.4	Very high	97.1	Very high	36 Å²	36	56 Å²	56	14%	0.141	26%	0.256	C	S	.	.	H	α-helix	trans	-58.9	-47.8	173.9	-172.4	-92.5	0	0	0	111.8	F174 D175 M178 W203 E264 K265 L270 M271 K272	F174-Y268 AromaticContact CD1-CE1 3.97Å; F174-Y268 HydrophobicContact CD1-CE1 3.97Å; F174-Y268 HydrophobicContact CD1-CE2 4.29Å; F174-Y268 AromaticContact CD1-CZ 3.74Å; F174-Y268 HydrophobicContact CE1-CD1 4.27Å; F174-Y268 HydrophobicContact CE1-CD2 4.04Å; F174-Y268 AromaticContact CE1-CE1 3.88Å; F174-Y268 HydrophobicContact CE1-CE1 3.88Å; F174-Y268 AromaticContact CE1-CE2 3.65Å; F174-Y268 HydrophobicContact CE1-CE2 3.65Å; F174-Y268 HydrophobicContact CE1-CG 4.35Å; F174-Y268 AromaticContact CE1-CZ 3.55Å; F174-Y268 HydrophobicContact CZ-CE2 4.44Å; D175-Y268 WeakPolarHBondContact CA-OH 3.47Å; D175-Y268 VanDerWaalsContact OD1-CE1 3.26Å; D175-Y268 WeakPolarHBondContact OD1-CE1 3.43Å; D175-Y268 PolarHBondContact OD1-OH 2.94Å; M178-Y268 HydrophobicContact CB-CE2 3.96Å; M178-Y268 HydrophobicContact CG-CE2 4.08Å; W203-Y268 AromaticContact CE2-CD2 3.77Å; W203-Y268 HydrophobicContact CZ2-CD2 4.08Å; W203-Y268 HydrophobicContact CZ2-CE2 4.05Å; W203-Y268 AromaticContact NE1-CD2 3.4Å; E264-Y268 WeakPolarHBondContact O-CB 3.3Å; E264-Y268 PolarHBondContact O-N 3.23Å; K265-Y268 PolarHBondContact O-N 3.2Å; Y268-L270 VanDerWaalsContact C-N 3.35Å; Y268-L270 PolarHBondContact O-N 2.89Å; Y268-M271 PolarHBondContact O-N 3.36Å; Y268-K272 WeakPolarHBondContact O-CB 3.45Å; Y268-K272 PolarHBondContact O-N 3.23Å
269	E	97.5	Very high	97.1	Very high	109 Å²	109	51.2 Å²	51.2	51%	0.509	23%	0.231	S	C	.	.	H	α-helix	trans	-66.5	-34.8	176.1	-68	-57.2	141.9	0	0	112.8	K265 F266 K272 R273	K265-E269 WeakPolarHBondContact O-CG 3.38Å; K265-E269 PolarHBondContact O-N 2.96Å; F266-E269 PolarHBondContact O-N 2.82Å; E269-K272 PolarHBondContact O-N 3.44Å; E269-R273 VanDerWaalsContact O-CB 3.29Å; E269-R273 WeakPolarHBondContact O-CB 3.49Å; E269-R273 PolarHBondContact O-N 3.48Å
270	L	95.9	Very high	97.1	Very high	29 Å²	29	51.9 Å²	51.9	15%	0.152	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-48.9	173.8	-178.2	123.6	0	0	0	111.1	F266 I267 Y268 K272 R273 D274	F266-L270 HydrophobicContact CE1-CD1 4.26Å; F266-L270 WeakPolarHBondContact O-CB 3.37Å; F266-L270 PolarHBondContact O-N 3.32Å; I267-L270 PolarHBondContact O-N 2.73Å; Y268-L270 VanDerWaalsContact C-N 3.35Å; Y268-L270 PolarHBondContact O-N 2.89Å; L270-K272 VanDerWaalsContact C-N 3.33Å; L270-K272 PolarHBondContact O-N 3.09Å; L270-R273 PolarHBondContact O-N 3.08Å; L270-D274 WeakPolarHBondContact O-CB 3.42Å; L270-D274 PolarHBondContact O-N 3.29Å
271	M	96.7	Very high	97	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-59.5	-44.3	175.6	-71.5	-171.8	-62.9	0	0	111.3	F174 F187 L191 N199 V200 W203 I267 Y268 R273 C275 F276	F174-M271 HydrophobicContact CZ-CB 3.88Å; F187-M271 HydrophobicContact CE1-CB 4.2Å; F187-M271 HydrophobicContact CE1-CG 4.49Å; F187-M271 HydrophobicContact CE1-SD 4.08Å; F187-M271 HydrophobicContact CZ-CB 4.41Å; L191-M271 HydrophobicContact CD1-SD 4.17Å; N199-M271 HydrophobicContact CB-CG 3.7Å; N199-M271 HydrophobicContact CB-SD 3.7Å; V200-M271 HydrophobicContact CB-SD 4.03Å; W203-M271 HydrophobicContact CB-CE 4.04Å; W203-M271 HydrophobicContact CG-CE 4.14Å; I267-M271 HydrophobicContact CG2-CE 4.17Å; I267-M271 HydrophobicContact CG2-CG 4.44Å; I267-M271 WeakPolarHBondContact O-CG 3.43Å; I267-M271 PolarHBondContact O-N 3.28Å; Y268-M271 PolarHBondContact O-N 3.36Å; M271-R273 VanDerWaalsContact C-N 3.34Å; M271-R273 PolarHBondContact O-N 3.24Å; M271-C275 WeakPolarHBondContact O-CA 3.16Å; M271-C275 WeakPolarHBondContact O-CB 3.24Å; M271-C275 PolarHBondContact O-N 2.75Å; M271-F276 PolarHBondContact O-N 3.24Å
272	K	97.7	Very high	97	Very high	60 Å²	60	55.6 Å²	55.6	26%	0.261	26%	0.259	S	S	.	.	I	π-helix	trans	-60.6	-39.7	177.7	-171.9	170.9	-170	163.5	0	113	F174 D175 Y268 E269 L270 P277	F174-K272 HydrophobicContact CB-CD 4.32Å; F174-K272 HydrophobicContact CB-CG 3.89Å; F174-K272 HydrophobicContact CD1-CB 3.51Å; F174-K272 HydrophobicContact CD1-CD 3.86Å; F174-K272 HydrophobicContact CD1-CG 3.6Å; F174-K272 HydrophobicContact CE1-CB 3.75Å; F174-K272 HydrophobicContact CE1-CG 4.36Å; F174-K272 HydrophobicContact CG-CB 4.1Å; F174-K272 HydrophobicContact CG-CD 4.46Å; F174-K272 HydrophobicContact CG-CG 3.92Å; D175-K272 IonicContact OD1-NZ 3.87Å; D175-K272 PolarHBondContact OD1-NZ 2.99Å; D175-K272 IonicContact OD2-NZ 2.76Å; D175-K272 PolarHBondContact OD2-NZ 3.01Å; Y268-K272 WeakPolarHBondContact O-CB 3.45Å; Y268-K272 PolarHBondContact O-N 3.23Å; E269-K272 PolarHBondContact O-N 3.44Å; L270-K272 VanDerWaalsContact C-N 3.33Å; L270-K272 PolarHBondContact O-N 3.09Å; K272-P277 WeakPolarHBondContact O-CD 3.21Å
273	R	96.6	Very high	96.9	Very high	188 Å²	188	56 Å²	56	71%	0.709	26%	0.263	S	S	*	.	I	π-helix	trans	-84.4	-36.2	-176	-172.6	-175.7	67.6	-164.3	-2.8	113.6	E269 L270 M271 P277	E269-R273 VanDerWaalsContact O-CB 3.29Å; E269-R273 WeakPolarHBondContact O-CB 3.49Å; E269-R273 PolarHBondContact O-N 3.48Å; L270-R273 PolarHBondContact O-N 3.08Å; M271-R273 VanDerWaalsContact C-N 3.34Å; M271-R273 PolarHBondContact O-N 3.24Å; R273-P277 WeakPolarHBondContact O-CG 3.19Å
274	D	94.4	Very high	96.7	Very high	80 Å²	80	59.4 Å²	59.4	43%	0.428	28%	0.278	S	S	.	.	I	π-helix	trans	-109.9	-44.4	-169.2	-174.5	65.3	0	0	0	113.6	L270 R278	L270-D274 WeakPolarHBondContact O-CB 3.42Å; L270-D274 PolarHBondContact O-N 3.29Å; D274-R278 PolarHBondContact O-NE 3.42Å; D274-R278 VanDerWaalsContact O-NE 3.16Å; D274-R278 IonicContact OD2-CZ 2.87Å; D274-R278 IonicContact OD2-NH2 2.66Å; D274-R278 PolarHBondContact OD2-NH2 3.49Å
275	C	96.5	Very high	96.6	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.007	27%	0.274	C	S	.	.	I	π-helix	trans	-85.8	-43.3	-174.3	-62.4	0	0	0	0	111.8	F187 L191 M271 R278 F279	F187-C275 HydrophobicContact CE2-CB 4.36Å; F187-C275 HydrophobicContact CZ-CB 3.72Å; L191-C275 HydrophobicContact CD2-CB 3.71Å; M271-C275 WeakPolarHBondContact O-CA 3.16Å; M271-C275 WeakPolarHBondContact O-CB 3.24Å; M271-C275 PolarHBondContact O-N 2.75Å; C275-R278 PolarHBondContact O-N 3.31Å; C275-F279 PolarHBondContact O-N 3.43Å
276	F	97.8	Very high	96.5	Very high	19 Å²	19	56.4 Å²	56.4	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-42.2	-176.2	179.3	-114.5	0	0	0	114.1	W170 F174 M177 F187 M271 R278 F279 V280	W170-F276 VanDerWaalsContact O-CE2 3.28Å; W170-F276 WeakPolarHBondContact O-CE2 3.43Å; W170-F276 WeakPolarHBondContact O-CZ 3.37Å; F174-F276 HydrophobicContact CB-CD1 3.76Å; F174-F276 HydrophobicContact CB-CD2 4.27Å; F174-F276 HydrophobicContact CB-CE1 3.8Å; F174-F276 HydrophobicContact CB-CE2 4.28Å; F174-F276 HydrophobicContact CB-CG 3.98Å; F174-F276 HydrophobicContact CB-CZ 4.05Å; F174-F276 HydrophobicContact CD2-CB 3.65Å; F174-F276 HydrophobicContact CD2-CD1 4.17Å; F174-F276 AromaticContact CD2-CD2 3.45Å; F174-F276 HydrophobicContact CD2-CD2 3.45Å; F174-F276 VanDerWaalsContact CD2-CD2 3.45Å; F174-F276 HydrophobicContact CD2-CE2 4.04Å; F174-F276 AromaticContact CD2-CG 3.49Å; F174-F276 HydrophobicContact CD2-CG 3.49Å; F174-F276 VanDerWaalsContact CD2-CG 3.49Å; F174-F276 HydrophobicContact CE2-CB 4.06Å; F174-F276 HydrophobicContact CE2-CD2 4.25Å; F174-F276 HydrophobicContact CE2-CG 4.33Å; F174-F276 HydrophobicContact CG-CB 4.34Å; F174-F276 HydrophobicContact CG-CD1 4.33Å; F174-F276 HydrophobicContact CG-CD2 4.31Å; F174-F276 HydrophobicContact CG-CG 4.08Å; M177-F276 HydrophobicContact CE-CD2 3.73Å; M177-F276 HydrophobicContact CE-CE2 3.8Å; M177-F276 HydrophobicContact SD-CE2 4.2Å; F187-F276 HydrophobicContact CE2-CB 4.39Å; F187-F276 HydrophobicContact CZ-CB 4.49Å; M271-F276 PolarHBondContact O-N 3.24Å; F276-R278 VanDerWaalsContact C-N 3.26Å; F276-R278 PolarHBondContact O-N 2.92Å; F276-F279 AromaticContact CD2-CD1 3.94Å; F276-F279 HydrophobicContact CD2-CD1 3.94Å; F276-F279 HydrophobicContact CE2-CD1 4.08Å; F276-F279 WeakPolarHBondContact O-CB 3.26Å; F276-F279 PolarHBondContact O-N 3.12Å; F276-F279 VanDerWaalsContact O-N 3.13Å; F276-V280 HydrophobicContact CD1-CG1 4.45Å; F276-V280 HydrophobicContact CD2-CG1 3.88Å; F276-V280 HydrophobicContact CE1-CG1 4.03Å; F276-V280 HydrophobicContact CE2-CG1 3.41Å; F276-V280 VanDerWaalsContact CE2-CG1 3.41Å; F276-V280 HydrophobicContact CG-CG1 4.4Å; F276-V280 HydrophobicContact CZ-CG1 3.5Å; F276-V280 PolarHBondContact O-N 3.21Å
277	P	97.5	Very high	96.2	Very high	60 Å²	60	56.6 Å²	56.6	39%	0.39	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-33.5	175.2	-26.7	37.8	0	0	0	113.6	K272 R273 V280 T281	K272-P277 WeakPolarHBondContact O-CD 3.21Å; R273-P277 WeakPolarHBondContact O-CG 3.19Å; P277-V280 WeakPolarHBondContact O-CG2 3.5Å; P277-T281 WeakPolarHBondContact O-CG2 3.39Å; P277-T281 PolarHBondContact O-N 3.33Å; P277-T281 PolarHBondContact O-OG1 2.71Å
278	R	96.9	Very high	96	Very high	93 Å²	93	57.4 Å²	57.4	35%	0.351	27%	0.274	S	S	.	.	H	α-helix	trans	-71.5	-41	173.9	-66.2	-172.1	-78.8	156.8	-13.7	111.3	Y190 E194 D274 C275 F276 T281 S282	Y190-R278 VanDerWaalsContact OH-CB 3.28Å; Y190-R278 WeakPolarHBondContact OH-CB 3.5Å; E194-R278 IonicContact OE2-CZ 2.67Å; E194-R278 IonicContact OE2-NH1 3.16Å; E194-R278 PolarHBondContact OE2-NH1 2.94Å; D274-R278 PolarHBondContact O-NE 3.42Å; D274-R278 VanDerWaalsContact O-NE 3.16Å; D274-R278 IonicContact OD2-CZ 2.87Å; D274-R278 IonicContact OD2-NH2 2.66Å; D274-R278 PolarHBondContact OD2-NH2 3.49Å; C275-R278 PolarHBondContact O-N 3.31Å; F276-R278 VanDerWaalsContact C-N 3.26Å; F276-R278 PolarHBondContact O-N 2.92Å; R278-T281 PolarHBondContact O-N 2.99Å; R278-T281 PolarHBondContact O-OG1 2.75Å; R278-S282 WeakPolarHBondContact O-CB 3.09Å; R278-S282 PolarHBondContact O-N 3.23Å
279	F	97.7	Very high	95.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-54.5	174.7	170.1	-105.3	0	0	0	112.3	M177 L186 F187 Y190 C275 F276 T281 S282 F284 F285	M177-F279 HydrophobicContact CE-CD1 4.44Å; M177-F279 HydrophobicContact CE-CE1 4.3Å; M177-F279 HydrophobicContact SD-CD1 4.12Å; M177-F279 HydrophobicContact SD-CE1 3.43Å; M177-F279 WeakPolarHBondContact SD-CE1 3.35Å; M177-F279 HydrophobicContact SD-CZ 3.94Å; L186-F279 HydrophobicContact CD2-CZ 4.02Å; L186-F279 HydrophobicContact CG-CE2 4.34Å; L186-F279 HydrophobicContact CG-CZ 4.14Å; F187-F279 HydrophobicContact CD2-CB 4.05Å; F187-F279 HydrophobicContact CD2-CD1 4.09Å; F187-F279 HydrophobicContact CD2-CD2 4.04Å; F187-F279 HydrophobicContact CD2-CE2 4.49Å; F187-F279 AromaticContact CD2-CG 3.79Å; F187-F279 HydrophobicContact CD2-CG 3.79Å; F187-F279 HydrophobicContact CE2-CB 3.81Å; F187-F279 HydrophobicContact CE2-CD1 4.49Å; F187-F279 HydrophobicContact CE2-CG 4.07Å; Y190-F279 HydrophobicContact CD1-CB 3.65Å; Y190-F279 AromaticContact CD1-CD2 3.61Å; Y190-F279 HydrophobicContact CD1-CD2 3.61Å; Y190-F279 HydrophobicContact CD1-CG 4.08Å; Y190-F279 HydrophobicContact CD2-CD2 4.16Å; Y190-F279 HydrophobicContact CE1-CB 3.55Å; Y190-F279 HydrophobicContact CE1-CD2 4.29Å; Y190-F279 HydrophobicContact CE1-CG 4.43Å; Y190-F279 HydrophobicContact CG-CB 4.35Å; Y190-F279 AromaticContact CG-CD2 3.53Å; Y190-F279 HydrophobicContact CG-CD2 3.53Å; Y190-F279 HydrophobicContact CG-CE2 4.34Å; Y190-F279 HydrophobicContact CG-CG 4.42Å; C275-F279 PolarHBondContact O-N 3.43Å; F276-F279 AromaticContact CD2-CD1 3.94Å; F276-F279 HydrophobicContact CD2-CD1 3.94Å; F276-F279 HydrophobicContact CE2-CD1 4.08Å; F276-F279 WeakPolarHBondContact O-CB 3.26Å; F276-F279 PolarHBondContact O-N 3.12Å; F276-F279 VanDerWaalsContact O-N 3.13Å; F279-T281 PolarHBondContact O-N 3.45Å; F279-T281 VanDerWaalsContact O-N 3.15Å; F279-S282 VanDerWaalsContact O-CB 3.27Å; F279-S282 WeakPolarHBondContact O-CB 3.48Å; F279-S282 PolarHBondContact O-N 3.45Å; F279-S282 PolarHBondContact O-OG 3.29Å; F279-F284 HydrophobicContact CD2-CD1 4.43Å; F279-F284 AromaticContact CE2-CD1 3.88Å; F279-F284 HydrophobicContact CE2-CD1 3.88Å; F279-F284 HydrophobicContact CE2-CE1 4.03Å; F279-F285 HydrophobicContact CD1-CG 4.43Å; F279-F285 HydrophobicContact CD2-CB 4.4Å; F279-F285 HydrophobicContact CE1-CB 4.3Å; F279-F285 HydrophobicContact CE1-CD1 4.41Å; F279-F285 AromaticContact CE1-CD2 3.51Å; F279-F285 HydrophobicContact CE1-CD2 3.51Å; F279-F285 AromaticContact CE1-CE2 3.83Å; F279-F285 HydrophobicContact CE1-CE2 3.83Å; F279-F285 AromaticContact CE1-CG 3.82Å; F279-F285 HydrophobicContact CE1-CG 3.82Å; F279-F285 HydrophobicContact CE1-CZ 4.4Å; F279-F285 HydrophobicContact CE2-CB 4.1Å; F279-F285 HydrophobicContact CE2-CD2 4.05Å; F279-F285 HydrophobicContact CE2-CG 4.35Å; F279-F285 HydrophobicContact CZ-CB 4.05Å; F279-F285 AromaticContact CZ-CD2 3.24Å; F279-F285 HydrophobicContact CZ-CD2 3.24Å; F279-F285 AromaticContact CZ-CE2 3.83Å; F279-F285 HydrophobicContact CZ-CE2 3.83Å; F279-F285 AromaticContact CZ-CG 3.8Å; F279-F285 HydrophobicContact CZ-CG 3.8Å; F279-F285 WeakPolarHBondContact O-CB 3.5Å
280	V	97.3	Very high	95.4	Very high	33 Å²	33	55 Å²	55	20%	0.2	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-20.3	-175.4	-58.7	0	0	0	0	113.5	F276 P277 F285	F276-V280 HydrophobicContact CD1-CG1 4.45Å; F276-V280 HydrophobicContact CD2-CG1 3.88Å; F276-V280 HydrophobicContact CE1-CG1 4.03Å; F276-V280 HydrophobicContact CE2-CG1 3.41Å; F276-V280 VanDerWaalsContact CE2-CG1 3.41Å; F276-V280 HydrophobicContact CG-CG1 4.4Å; F276-V280 HydrophobicContact CZ-CG1 3.5Å; F276-V280 PolarHBondContact O-N 3.21Å; P277-V280 WeakPolarHBondContact O-CG2 3.5Å; V280-F285 HydrophobicContact CB-CD1 4.44Å
281	T	96.1	Very high	94.8	Very high	90 Å²	90	57 Å²	57	55%	0.552	28%	0.282	S	S	*	.	H	α-helix	trans	-96.6	-10.6	176.5	55.9	0	0	0	0	113.6	P277 R278 F279 K286	P277-T281 WeakPolarHBondContact O-CG2 3.39Å; P277-T281 PolarHBondContact O-N 3.33Å; P277-T281 PolarHBondContact O-OG1 2.71Å; R278-T281 PolarHBondContact O-N 2.99Å; R278-T281 PolarHBondContact O-OG1 2.75Å; F279-T281 PolarHBondContact O-N 3.45Å; F279-T281 VanDerWaalsContact O-N 3.15Å; T281-K286 WeakPolarHBondContact O-CE 3.44Å; T281-K286 PolarHBondContact O-NZ 2.96Å
282	S	96.9	Very high	94.2	Very high	19 Å²	19	57.2 Å²	57.2	13%	0.133	28%	0.283	C	S	.	.	S	Bend	trans	-66.8	155.8	-177.7	74.1	0	0	0	0	112.6	R278 F279 F284 F285 K286	R278-S282 WeakPolarHBondContact O-CB 3.09Å; R278-S282 PolarHBondContact O-N 3.23Å; F279-S282 VanDerWaalsContact O-CB 3.27Å; F279-S282 WeakPolarHBondContact O-CB 3.48Å; F279-S282 PolarHBondContact O-N 3.45Å; F279-S282 PolarHBondContact O-OG 3.29Å; S282-F284 PolarHBondContact O-N 3.14Å; S282-F284 PolarHBondContact OG-N 3.26Å; S282-F285 PolarHBondContact OG-N 3.09Å; S282-K286 WeakPolarHBondContact O-CG 3.46Å; S282-K286 PolarHBondContact O-N 3.4Å
283	Q	95.1	Very high	93.2	Very high	122 Å²	122	58.7 Å²	58.7	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-63.4	-34.8	170.9	-168.2	59.9	41.9	0	0	111.2	F285 K286 D287	Q283-F285 PolarHBondContact O-N 3.43Å; Q283-K286 PolarHBondContact O-N 3.47Å; Q283-D287 PolarHBondContact NE2-OD1 3.25Å; Q283-D287 VanDerWaalsContact O-CG 3.23Å; Q283-D287 PolarHBondContact O-N 3.21Å
284	F	93.7	Very high	91.9	Very high	70 Å²	70	55.9 Å²	55.9	31%	0.307	29%	0.287	S	S	.	.	H	α-helix	trans	-52.8	-50.1	178	-178.6	-86.9	0	0	0	112.2	L186 E189 Y190 F279 S282 V288	L186-F284 HydrophobicContact CD1-CE1 3.48Å; L186-F284 VanDerWaalsContact CD1-CE1 3.48Å; L186-F284 HydrophobicContact CD1-CZ 3.79Å; L186-F284 HydrophobicContact CG-CE1 3.94Å; E189-F284 HydrophobicContact CB-CZ 4Å; Y190-F284 HydrophobicContact CD2-CB 4.22Å; Y190-F284 HydrophobicContact CD2-CD1 4.41Å; Y190-F284 HydrophobicContact CD2-CG 4.34Å; F279-F284 HydrophobicContact CD2-CD1 4.43Å; F279-F284 AromaticContact CE2-CD1 3.88Å; F279-F284 HydrophobicContact CE2-CD1 3.88Å; F279-F284 HydrophobicContact CE2-CE1 4.03Å; S282-F284 PolarHBondContact O-N 3.14Å; S282-F284 PolarHBondContact OG-N 3.26Å; F284-V288 PolarHBondContact O-N 2.93Å
285	F	95.5	Very high	90.6	Very high	1 Å²	1	55.4 Å²	55.4	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-76	-34.1	179.3	-170.6	-117.2	0	0	0	112.7	I167 W170 L186 F279 V280 S282 Q283 D287 V288 Q289	I167-F285 HydrophobicContact CG2-CE2 4.34Å; I167-F285 HydrophobicContact CG2-CZ 4.24Å; I167-F285 WeakPolarHBondContact O-CZ 3.38Å; W170-F285 HydrophobicContact CB-CZ 4.3Å; L186-F285 HydrophobicContact CD2-CD2 4.26Å; L186-F285 HydrophobicContact CD2-CE2 4.3Å; F279-F285 HydrophobicContact CD1-CG 4.43Å; F279-F285 HydrophobicContact CD2-CB 4.4Å; F279-F285 HydrophobicContact CE1-CB 4.3Å; F279-F285 HydrophobicContact CE1-CD1 4.41Å; F279-F285 AromaticContact CE1-CD2 3.51Å; F279-F285 HydrophobicContact CE1-CD2 3.51Å; F279-F285 AromaticContact CE1-CE2 3.83Å; F279-F285 HydrophobicContact CE1-CE2 3.83Å; F279-F285 AromaticContact CE1-CG 3.82Å; F279-F285 HydrophobicContact CE1-CG 3.82Å; F279-F285 HydrophobicContact CE1-CZ 4.4Å; F279-F285 HydrophobicContact CE2-CB 4.1Å; F279-F285 HydrophobicContact CE2-CD2 4.05Å; F279-F285 HydrophobicContact CE2-CG 4.35Å; F279-F285 HydrophobicContact CZ-CB 4.05Å; F279-F285 AromaticContact CZ-CD2 3.24Å; F279-F285 HydrophobicContact CZ-CD2 3.24Å; F279-F285 AromaticContact CZ-CE2 3.83Å; F279-F285 HydrophobicContact CZ-CE2 3.83Å; F279-F285 AromaticContact CZ-CG 3.8Å; F279-F285 HydrophobicContact CZ-CG 3.8Å; F279-F285 WeakPolarHBondContact O-CB 3.5Å; V280-F285 HydrophobicContact CB-CD1 4.44Å; S282-F285 PolarHBondContact OG-N 3.09Å; Q283-F285 PolarHBondContact O-N 3.43Å; F285-D287 VanDerWaalsContact C-N 3.31Å; F285-D287 PolarHBondContact O-N 3.03Å; F285-V288 WeakPolarHBondContact O-CB 3.4Å; F285-V288 PolarHBondContact O-N 3.37Å; F285-Q289 HydrophobicContact CD1-CG 4.17Å; F285-Q289 HydrophobicContact CE1-CG 3.89Å; F285-Q289 HydrophobicContact CZ-CG 4.17Å; F285-Q289 WeakPolarHBondContact O-CG 3.4Å; F285-Q289 PolarHBondContact O-N 2.82Å
286	K	94.5	Very high	88.9	Confident	97 Å²	97	58.7 Å²	58.7	42%	0.422	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-37.7	175.3	-73.5	169.7	178	159.5	0	112.7	T281 S282 Q283 V288 Q289 A290	T281-K286 WeakPolarHBondContact O-CE 3.44Å; T281-K286 PolarHBondContact O-NZ 2.96Å; S282-K286 WeakPolarHBondContact O-CG 3.46Å; S282-K286 PolarHBondContact O-N 3.4Å; Q283-K286 PolarHBondContact O-N 3.47Å; K286-V288 VanDerWaalsContact C-N 3.33Å; K286-Q289 PolarHBondContact O-N 3.42Å; K286-A290 WeakPolarHBondContact O-CB 3.3Å; K286-A290 PolarHBondContact O-N 3.4Å
287	D	92.5	Very high	87.1	Confident	81 Å²	81	65.7 Å²	65.7	43%	0.433	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-39.8	175.8	-67.2	-20.6	0	0	0	110.9	Q283 F285 A290 N291	Q283-D287 PolarHBondContact NE2-OD1 3.25Å; Q283-D287 VanDerWaalsContact O-CG 3.23Å; Q283-D287 PolarHBondContact O-N 3.21Å; F285-D287 VanDerWaalsContact C-N 3.31Å; F285-D287 PolarHBondContact O-N 3.03Å; D287-A290 PolarHBondContact O-N 3.17Å; D287-N291 VanDerWaalsContact O-CG 3.28Å; D287-N291 PolarHBondContact O-N 2.62Å; D287-N291 VanDerWaalsContact O-N 3.12Å; D287-N291 PolarHBondContact O-ND2 2.89Å
288	V	92.7	Very high	85.2	Confident	17 Å²	17	66.9 Å²	66.9	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-47.4	173	177.1	0	0	0	0	110.6	V159 I167 L186 F284 F285 K286 N291 H292	V159-V288 HydrophobicContact CG1-CG1 3.81Å; I167-V288 HydrophobicContact CD1-CG1 4.32Å; I167-V288 HydrophobicContact CG2-CG1 4.19Å; L186-V288 HydrophobicContact CD1-CG2 4.1Å; L186-V288 HydrophobicContact CD2-CG1 4.38Å; L186-V288 HydrophobicContact CD2-CG2 4.44Å; F284-V288 PolarHBondContact O-N 2.93Å; F285-V288 WeakPolarHBondContact O-CB 3.4Å; F285-V288 PolarHBondContact O-N 3.37Å; K286-V288 VanDerWaalsContact C-N 3.33Å; V288-N291 PolarHBondContact O-N 2.98Å; V288-H292 PolarHBondContact O-N 3.49Å; V288-H292 PolarHBondContact O-ND1 3.17Å
289	Q	91.9	Very high	83.2	Confident	55 Å²	55	66.7 Å²	66.7	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-45.6	178	-67.8	-179.5	-62.7	0	0	112.1	I167 F285 K286 N291 H292 E293	I167-Q289 HydrophobicContact CG2-CG 3.93Å; F285-Q289 HydrophobicContact CD1-CG 4.17Å; F285-Q289 HydrophobicContact CE1-CG 3.89Å; F285-Q289 HydrophobicContact CZ-CG 4.17Å; F285-Q289 WeakPolarHBondContact O-CG 3.4Å; F285-Q289 PolarHBondContact O-N 2.82Å; K286-Q289 PolarHBondContact O-N 3.42Å; Q289-N291 VanDerWaalsContact C-N 3.31Å; Q289-N291 PolarHBondContact O-N 3.47Å; Q289-H292 PolarHBondContact O-N 3.45Å; Q289-E293 PolarHBondContact O-N 3.14Å
290	A	89.1	Confident	81.2	Confident	39 Å²	39	71.4 Å²	71.4	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-60.7	-38.3	-179.5	0	0	0	0	0	112.7	K286 D287 H292 E293 M294	K286-A290 WeakPolarHBondContact O-CB 3.3Å; K286-A290 PolarHBondContact O-N 3.4Å; D287-A290 PolarHBondContact O-N 3.17Å; A290-H292 VanDerWaalsContact C-N 3.28Å; A290-H292 PolarHBondContact O-N 2.64Å; A290-E293 PolarHBondContact O-N 3.37Å; A290-M294 WeakPolarHBondContact O-CG 3.38Å; A290-M294 PolarHBondContact O-N 2.64Å; A290-M294 VanDerWaalsContact O-N 3.15Å
291	N	84.2	Confident	79.1	Confident	72 Å²	72	74.2 Å²	74.2	39%	0.385	39%	0.394	S	S	.	.	H	α-helix	trans	-62	-36.1	175.6	-71.2	-19.6	0	0	0	112.2	D287 V288 Q289 N295	D287-N291 VanDerWaalsContact O-CG 3.28Å; D287-N291 PolarHBondContact O-N 2.62Å; D287-N291 VanDerWaalsContact O-N 3.12Å; D287-N291 PolarHBondContact O-ND2 2.89Å; V288-N291 PolarHBondContact O-N 2.98Å; Q289-N291 VanDerWaalsContact C-N 3.31Å; Q289-N291 PolarHBondContact O-N 3.47Å; N291-N295 PolarHBondContact O-N 3.45Å
292	H	83.9	Confident	76.6	Confident	5 Å²	5	75.7 Å²	75.7	2%	0.023	40%	0.397	C	S	.	.	H	α-helix	trans	-75.7	-37.3	178.5	-69.8	76.7	0	0	0	112.3	V159 L162 V288 Q289 A290 M294 N295 D296	V159-H292 PolarHBondContact O-CE1 3.14Å; V159-H292 VanDerWaalsContact O-CE1 3.26Å; V159-H292 PolarHBondContact O-NE2 2.69Å; L162-H292 PolarHBondContact O-CD2 2.83Å; L162-H292 VanDerWaalsContact O-CD2 3.27Å; V288-H292 PolarHBondContact O-N 3.49Å; V288-H292 PolarHBondContact O-ND1 3.17Å; Q289-H292 PolarHBondContact O-N 3.45Å; A290-H292 VanDerWaalsContact C-N 3.28Å; A290-H292 PolarHBondContact O-N 2.64Å; H292-M294 VanDerWaalsContact C-N 3.25Å; H292-M294 PolarHBondContact O-N 3.41Å; H292-N295 PolarHBondContact O-N 3.45Å; H292-D296 PolarHBondContact O-N 2.9Å
293	E	75.9	Confident	73.9	Confident	91 Å²	91	80.3 Å²	80.3	43%	0.425	43%	0.426	S	S	.	.	H	α-helix	trans	-61.9	-33.8	173.6	-70.6	-175.3	-164.1	0	0	112.5	Q289 A290 R297	Q289-E293 PolarHBondContact O-N 3.14Å; A290-E293 PolarHBondContact O-N 3.37Å; E293-R297 VanDerWaalsContact O-CG 3.29Å; E293-R297 WeakPolarHBondContact O-CG 3.36Å; E293-R297 PolarHBondContact O-N 3.2Å; E293-R297 IonicContact OE2-NH2 2.82Å
294	M	70.1	Confident	71.1	Confident	128 Å²	128	85.6 Å²	85.6	63%	0.631	46%	0.458	S	S	*	.	H	α-helix	trans	-70.9	-40.7	175.9	-71.2	-169.1	179.1	0	0	112.1	A290 H292 R297 C298	A290-M294 WeakPolarHBondContact O-CG 3.38Å; A290-M294 PolarHBondContact O-N 2.64Å; A290-M294 VanDerWaalsContact O-N 3.15Å; H292-M294 VanDerWaalsContact C-N 3.25Å; H292-M294 PolarHBondContact O-N 3.41Å; M294-R297 PolarHBondContact O-N 3.21Å; M294-C298 PolarHBondContact O-N 3.43Å; M294-C298 VanDerWaalsContact O-N 3.13Å; M294-C298 PolarHBondContact O-SG 3.37Å
295	N	66.2	Low	70	Confident	70 Å²	70	86.4 Å²	86.4	37%	0.374	47%	0.465	S	S	.	.	H	α-helix	trans	-64.5	-45.4	178.9	-70.9	-11.5	0	0	0	111.5	N160 N291 H292 R297 C298 E299	N160-N295 PolarHBondContact O-ND2 3.34Å; N291-N295 PolarHBondContact O-N 3.45Å; H292-N295 PolarHBondContact O-N 3.45Å; N295-R297 VanDerWaalsContact C-N 3.32Å; N295-R297 PolarHBondContact O-N 2.94Å; N295-C298 PolarHBondContact O-N 2.99Å; N295-C298 VanDerWaalsContact O-N 3.13Å; N295-E299 PolarHBondContact O-N 3.12Å
296	D	61.1	Low	68.6	Low	71 Å²	71	90.9 Å²	90.9	38%	0.38	49%	0.489	S	S	.	.	H	α-helix	trans	-60.2	-39	177	-83.6	5.7	0	0	0	112.8	H164 H292 E299 S300	H164-D296 WeakPolarHBondContact CB-OD2 3.37Å; H164-D296 IonicContact CD2-OD2 3.28Å; H164-D296 IonicContact CG-OD2 2.69Å; H164-D296 VanDerWaalsContact CG-OD2 3.31Å; H292-D296 PolarHBondContact O-N 2.9Å; D296-E299 PolarHBondContact O-N 3.18Å; D296-S300 WeakPolarHBondContact O-CB 3.45Å; D296-S300 PolarHBondContact O-N 2.98Å; D296-S300 PolarHBondContact O-OG 3.05Å
297	R	60.2	Low	67.2	Low	165 Å²	165	90.6 Å²	90.6	62%	0.623	49%	0.493	S	S	*	.	H	α-helix	trans	-67.5	-36.7	176.8	-73.3	178.6	-167	-167.4	9.3	112.1	E293 M294 N295 S300 S301	E293-R297 VanDerWaalsContact O-CG 3.29Å; E293-R297 WeakPolarHBondContact O-CG 3.36Å; E293-R297 PolarHBondContact O-N 3.2Å; E293-R297 IonicContact OE2-NH2 2.82Å; M294-R297 PolarHBondContact O-N 3.21Å; N295-R297 VanDerWaalsContact C-N 3.32Å; N295-R297 PolarHBondContact O-N 2.94Å; R297-S300 WeakPolarHBondContact CA-OG 3.41Å; R297-S300 PolarHBondContact O-OG 3.3Å; R297-S301 WeakPolarHBondContact O-CB 3.5Å; R297-S301 PolarHBondContact O-N 3.38Å; R297-S301 PolarHBondContact O-OG 3.28Å
298	C	57.8	Low	65.7	Low	85 Å²	85	91.1 Å²	91.1	57%	0.574	50%	0.497	S	S	*	.	H	α-helix	trans	-68.1	-42.1	176.1	-74.3	0	0	0	0	111.5	M294 N295 S301	M294-C298 PolarHBondContact O-N 3.43Å; M294-C298 VanDerWaalsContact O-N 3.13Å; M294-C298 PolarHBondContact O-SG 3.37Å; N295-C298 PolarHBondContact O-N 2.99Å; N295-C298 VanDerWaalsContact O-N 3.13Å; C298-S301 PolarHBondContact O-N 2.96Å
299	E	55	Low	64	Low	90 Å²	90	95.8 Å²	95.8	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-68.1	-41.8	179.1	-70.8	-170.6	174.4	0	0	113.1	H30 N295 D296 S301 I302	H30-E299 IonicContact CD2-OE1 3.09Å; H30-E299 PolarHBondContact CD2-OE1 2.99Å; H30-E299 IonicContact CE1-OE1 3.35Å; H30-E299 IonicContact CG-OE1 2.79Å; H30-E299 IonicContact NE2-OE1 3.76Å; H30-E299 PolarHBondContact NE2-OE1 3.19Å; H30-E299 VanDerWaalsContact NE2-OE1 3.16Å; N295-E299 PolarHBondContact O-N 3.12Å; D296-E299 PolarHBondContact O-N 3.18Å; E299-S301 PolarHBondContact O-N 2.85Å; E299-I302 PolarHBondContact O-N 3.4Å
300	S	56.6	Low	62.2	Low	98 Å²	98	98.5 Å²	98.5	69%	0.685	54%	0.539	S	S	*	.	H	α-helix	trans	-68.5	-13.8	176.7	53.7	0	0	0	0	114	D296 R297	D296-S300 WeakPolarHBondContact O-CB 3.45Å; D296-S300 PolarHBondContact O-N 2.98Å; D296-S300 PolarHBondContact O-OG 3.05Å; R297-S300 WeakPolarHBondContact CA-OG 3.41Å; R297-S300 PolarHBondContact O-OG 3.3Å
301	S	52.6	Low	60.3	Low	92 Å²	92	102.7 Å²	102.7	64%	0.643	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-3.9	177.4	-59.1	0	0	0	0	113.7	R297 C298 E299 P303	R297-S301 WeakPolarHBondContact O-CB 3.5Å; R297-S301 PolarHBondContact O-N 3.38Å; R297-S301 PolarHBondContact O-OG 3.28Å; C298-S301 PolarHBondContact O-N 2.96Å; E299-S301 PolarHBondContact O-N 2.85Å; S301-P303 WeakPolarHBondContact O-CD 3.44Å
302	I	43.6	Very low	58.4	Low	122 Å²	122	105.1 Å²	105.1	63%	0.626	57%	0.567	S	S	*	*	S	Bend	trans	-82.4	115.1	179.7	-54.7	175.2	0	0	0	108.8	E299 L304	E299-I302 PolarHBondContact O-N 3.4Å; I302-L304 PolarHBondContact O-N 2.96Å
303	P	40.6	Very low	56.3	Low	115 Å²	115	113.4 Å²	113.4	75%	0.747	61%	0.613	S	S	*	*			trans	-63.1	136.7	174.9	-15.2	29.2	0	0	0	110.4	S301	S301-P303 WeakPolarHBondContact O-CD 3.44Å
304	L	35.9	Very low	54.5	Low	234 Å²	234	115.5 Å²	115.5	100%	1.225	63%	0.63	S	S	*	*			trans	-51.4	0	168.5	-81.8	163.8	0	0	0	112.1	I302	I302-L304 PolarHBondContact O-N 2.96Å

Retrieved 304 of 304 residues in 243.3 ms (Link to these results)

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