A0A060VY32_ONCMY Loading...

Tumor necrosis factor alpha-induced protein 8-like protein 1

AlphaFold DB , UniProt , Accession A0A060VY32, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tnfaip8l1, Length 186 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	72.4	Confident	245 Å²	245	115.5 Å²	115.5	100%	1.207	64%	0.635	S	S	*	*				0	112.2	0	-81.9	-179.5	175	0	0	107.1	S3	M1-S3 PolarHBondContact O-N 3.39Å; M1-S3 VanDerWaalsContact O-N 3.16Å
2	D	51.2	Low	73.1	Confident	167 Å²	167	116.8 Å²	116.8	89%	0.893	63%	0.633	S	S	*	*			trans	-64.9	113.1	175.7	-74.5	-43.1	0	0	0	109.2	F4	D2-F4 PolarHBondContact O-N 3.43Å
3	S	62.6	Low	73.5	Confident	118 Å²	118	111.8 Å²	111.8	83%	0.825	62%	0.618	S	S	*	*			trans	-76.2	78.2	174.5	-178.3	0	0	0	0	108.7	M1 S5	M1-S3 PolarHBondContact O-N 3.39Å; M1-S3 VanDerWaalsContact O-N 3.16Å; S3-S5 PolarHBondContact O-N 3.19Å; S3-S5 VanDerWaalsContact O-N 3.17Å
4	F	73.5	Confident	73.1	Confident	149 Å²	149	111.4 Å²	111.4	65%	0.654	61%	0.609	S	S	*	*			trans	-64.7	113	168.7	179.5	-97.2	0	0	0	108.5	D2 T6 L9	D2-F4 PolarHBondContact O-N 3.43Å; F4-T6 HydrophobicContact CD1-CG2 4.39Å; F4-T6 HydrophobicContact CE1-CG2 3.74Å; F4-L9 HydrophobicContact CE2-CD1 3.77Å; F4-L9 HydrophobicContact CZ-CD1 4.14Å; F4-L9 HydrophobicContact CZ-CD2 4.32Å
5	S	80.8	Confident	73.3	Confident	45 Å²	45	114.3 Å²	114.3	32%	0.315	61%	0.613	S	S	.	*			trans	-108.1	111.3	177.6	-174.5	0	0	0	0	110.1	S3 K7 S8 L9	S3-S5 PolarHBondContact O-N 3.19Å; S3-S5 VanDerWaalsContact O-N 3.17Å; S5-K7 PolarHBondContact O-N 3.27Å; S5-K7 VanDerWaalsContact O-N 3.15Å; S5-K7 PolarHBondContact OG-N 3.17Å; S5-S8 PolarHBondContact O-N 2.78Å; S5-S8 PolarHBondContact O-OG 2.95Å; S5-L9 PolarHBondContact O-N 3.3Å
6	T	79.1	Confident	73.3	Confident	103 Å²	103	115.9 Å²	115.9	63%	0.632	61%	0.613	S	S	*	*	H	α-helix	trans	-56	-29	170.9	47	0	0	0	0	112.2	F4 L9 A10	F4-T6 HydrophobicContact CD1-CG2 4.39Å; F4-T6 HydrophobicContact CE1-CG2 3.74Å; T6-L9 PolarHBondContact O-N 3.49Å; T6-A10 WeakPolarHBondContact O-CB 3.41Å; T6-A10 PolarHBondContact O-N 3.2Å
7	K	79.4	Confident	72.7	Confident	154 Å²	154	115.9 Å²	115.9	67%	0.67	61%	0.612	S	S	*	*	H	α-helix	trans	-67.1	-40.6	175.3	-168.8	177.3	-178.3	178.7	0	112.6	S5 L11	S5-K7 PolarHBondContact O-N 3.27Å; S5-K7 VanDerWaalsContact O-N 3.15Å; S5-K7 PolarHBondContact OG-N 3.17Å; K7-L11 HydrophobicContact CG-CD1 4.36Å; K7-L11 WeakPolarHBondContact O-CB 3.49Å; K7-L11 VanDerWaalsContact O-CG 3.29Å; K7-L11 WeakPolarHBondContact O-CG 3.38Å; K7-L11 PolarHBondContact O-N 3.36Å
8	S	81.4	Confident	71.9	Confident	55 Å²	55	116.1 Å²	116.1	39%	0.385	61%	0.611	S	S	.	*	H	α-helix	trans	-69.7	-37.5	176.9	68.5	0	0	0	0	111.2	S5 L11 Q12	S5-S8 PolarHBondContact O-N 2.78Å; S5-S8 PolarHBondContact O-OG 2.95Å; S8-L11 PolarHBondContact O-N 2.87Å; S8-Q12 WeakPolarHBondContact O-CG 3.5Å; S8-Q12 PolarHBondContact O-N 3.2Å
9	L	81.7	Confident	71.4	Confident	91 Å²	91	113.1 Å²	113.1	48%	0.476	60%	0.6	S	S	.	*	H	α-helix	trans	-63.2	-46.3	174.5	-135.8	94.5	0	0	0	111.9	F4 S5 T6 L11 Q12 A13	F4-L9 HydrophobicContact CE2-CD1 3.77Å; F4-L9 HydrophobicContact CZ-CD1 4.14Å; F4-L9 HydrophobicContact CZ-CD2 4.32Å; S5-L9 PolarHBondContact O-N 3.3Å; T6-L9 PolarHBondContact O-N 3.49Å; L9-L11 PolarHBondContact O-N 3.47Å; L9-Q12 PolarHBondContact O-N 2.83Å; L9-A13 WeakPolarHBondContact O-CB 3.34Å; L9-A13 PolarHBondContact O-N 2.81Å
10	A	79.5	Confident	70.8	Confident	58 Å²	58	115.1 Å²	115.1	48%	0.479	60%	0.604	S	S	.	*	H	α-helix	trans	-62.5	-41.5	177.1	0	0	0	0	0	112	T6 A13 Q14	T6-A10 WeakPolarHBondContact O-CB 3.41Å; T6-A10 PolarHBondContact O-N 3.2Å; A10-A13 PolarHBondContact O-N 3.03Å; A10-Q14 WeakPolarHBondContact O-CB 3.41Å; A10-Q14 PolarHBondContact O-N 3.37Å
11	L	82.3	Confident	70.2	Confident	86 Å²	86	115 Å²	115	45%	0.45	60%	0.602	S	S	.	*	H	α-helix	trans	-65.6	-37.6	175.7	-76.4	168.6	0	0	0	112.6	K7 S8 L9 K15	K7-L11 HydrophobicContact CG-CD1 4.36Å; K7-L11 WeakPolarHBondContact O-CB 3.49Å; K7-L11 VanDerWaalsContact O-CG 3.29Å; K7-L11 WeakPolarHBondContact O-CG 3.38Å; K7-L11 PolarHBondContact O-N 3.36Å; S8-L11 PolarHBondContact O-N 2.87Å; L9-L11 PolarHBondContact O-N 3.47Å; L11-K15 WeakPolarHBondContact O-CB 3.36Å; L11-K15 WeakPolarHBondContact O-CG 3.33Å; L11-K15 PolarHBondContact O-N 3.15Å
12	Q	81.1	Confident	70.7	Confident	130 Å²	130	106.3 Å²	106.3	61%	0.607	57%	0.569	S	S	*	*	H	α-helix	trans	-67.1	-43.4	174.6	-77.3	179.9	-5.3	0	0	111.6	S8 L9 K15 K16	S8-Q12 WeakPolarHBondContact O-CG 3.5Å; S8-Q12 PolarHBondContact O-N 3.2Å; L9-Q12 PolarHBondContact O-N 2.83Å; Q12-K15 PolarHBondContact O-N 3Å; Q12-K16 VanDerWaalsContact O-CB 3.31Å; Q12-K16 WeakPolarHBondContact O-CB 3.48Å; Q12-K16 PolarHBondContact O-N 3.33Å
13	A	78.4	Confident	70.8	Confident	53 Å²	53	103 Å²	103	44%	0.438	55%	0.554	S	S	.	*	H	α-helix	trans	-61	-44.6	174.5	0	0	0	0	0	111.3	L9 A10 K16 L17	L9-A13 WeakPolarHBondContact O-CB 3.34Å; L9-A13 PolarHBondContact O-N 2.81Å; A10-A13 PolarHBondContact O-N 3.03Å; A13-K16 PolarHBondContact O-N 3.45Å; A13-L17 WeakPolarHBondContact O-CG 3.2Å; A13-L17 PolarHBondContact O-N 2.83Å
14	Q	68.4	Low	70.1	Confident	105 Å²	105	105.9 Å²	105.9	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-61.4	-47.8	176.1	-172	-179.1	5.3	0	0	111.9	A10 K16 L17 M18	A10-Q14 WeakPolarHBondContact O-CB 3.41Å; A10-Q14 PolarHBondContact O-N 3.37Å; Q14-K16 VanDerWaalsContact C-N 3.29Å; Q14-K16 PolarHBondContact O-N 3.32Å; Q14-L17 PolarHBondContact O-N 3.01Å; Q14-M18 HydrophobicContact CG-SD 4.27Å; Q14-M18 WeakPolarHBondContact O-CG 3.27Å; Q14-M18 PolarHBondContact O-N 3.46Å
15	K	75.3	Confident	68.9	Low	156 Å²	156	101.5 Å²	101.5	68%	0.678	54%	0.54	S	S	*	.	H	α-helix	trans	-59.3	-40.4	175.7	-80.6	-178.5	177.6	-178.1	0	112.1	L11 Q12 M18 S19	L11-K15 WeakPolarHBondContact O-CB 3.36Å; L11-K15 WeakPolarHBondContact O-CG 3.33Å; L11-K15 PolarHBondContact O-N 3.15Å; Q12-K15 PolarHBondContact O-N 3Å; K15-M18 PolarHBondContact O-N 3.46Å; K15-S19 WeakPolarHBondContact O-CB 3.21Å; K15-S19 PolarHBondContact O-N 3.31Å; K15-S19 PolarHBondContact O-OG 2.91Å
16	K	73.3	Confident	67.5	Low	139 Å²	139	101.2 Å²	101.2	60%	0.604	54%	0.535	S	S	*	.	H	α-helix	trans	-69.3	-34.4	179.3	-166.7	173.1	-175.3	176.5	0	112.4	Q12 A13 Q14 S19 K20	Q12-K16 VanDerWaalsContact O-CB 3.31Å; Q12-K16 WeakPolarHBondContact O-CB 3.48Å; Q12-K16 PolarHBondContact O-N 3.33Å; A13-K16 PolarHBondContact O-N 3.45Å; Q14-K16 VanDerWaalsContact C-N 3.29Å; Q14-K16 PolarHBondContact O-N 3.32Å; K16-S19 PolarHBondContact O-OG 3.32Å; K16-S19 VanDerWaalsContact O-OG 3.1Å; K16-K20 WeakPolarHBondContact O-CB 3.44Å; K16-K20 WeakPolarHBondContact O-CG 3.45Å; K16-K20 PolarHBondContact O-N 2.9Å
17	L	63.1	Low	66	Low	116 Å²	116	97.9 Å²	97.9	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-69.3	-48.8	172.6	-75.3	166.8	0	0	0	111.3	A13 Q14 S19 K20 M21	A13-L17 WeakPolarHBondContact O-CG 3.2Å; A13-L17 PolarHBondContact O-N 2.83Å; Q14-L17 PolarHBondContact O-N 3.01Å; L17-S19 VanDerWaalsContact C-N 3.33Å; L17-S19 PolarHBondContact O-N 2.99Å; L17-K20 PolarHBondContact O-N 3.29Å; L17-M21 WeakPolarHBondContact O-CG 3.38Å; L17-M21 PolarHBondContact O-N 3.39Å
18	M	59.7	Low	64.8	Low	120 Å²	120	96.3 Å²	96.3	59%	0.591	52%	0.516	S	S	*	.	H	α-helix	trans	-61.9	-39.3	178.4	-67.2	-176.5	96.1	0	0	112.2	Q14 K15 M21 A22	Q14-M18 HydrophobicContact CG-SD 4.27Å; Q14-M18 WeakPolarHBondContact O-CG 3.27Å; Q14-M18 PolarHBondContact O-N 3.46Å; K15-M18 PolarHBondContact O-N 3.46Å; M18-M21 PolarHBondContact O-N 2.9Å; M18-A22 WeakPolarHBondContact O-CB 3.49Å; M18-A22 PolarHBondContact O-N 3.13Å
19	S	61.7	Low	63.6	Low	58 Å²	58	96.5 Å²	96.5	41%	0.406	51%	0.512	S	S	.	.	H	α-helix	trans	-67.5	-39.8	176.9	69.5	0	0	0	0	112	K15 K16 L17 A22 T23	K15-S19 WeakPolarHBondContact O-CB 3.21Å; K15-S19 PolarHBondContact O-N 3.31Å; K15-S19 PolarHBondContact O-OG 2.91Å; K16-S19 PolarHBondContact O-OG 3.32Å; K16-S19 VanDerWaalsContact O-OG 3.1Å; L17-S19 VanDerWaalsContact C-N 3.33Å; L17-S19 PolarHBondContact O-N 2.99Å; S19-A22 PolarHBondContact O-N 2.97Å; S19-T23 WeakPolarHBondContact O-CB 3.4Å; S19-T23 WeakPolarHBondContact O-CG2 3.45Å; S19-T23 PolarHBondContact O-N 3.34Å; S19-T23 PolarHBondContact O-OG1 2.91Å
20	K	59.4	Low	62.2	Low	154 Å²	154	94 Å²	94	67%	0.67	50%	0.498	S	S	*	.	H	α-helix	trans	-65.7	-36.2	174.6	-79.7	-175.4	174.4	-167.9	0	113.2	K16 L17 A22	K16-K20 WeakPolarHBondContact O-CB 3.44Å; K16-K20 WeakPolarHBondContact O-CG 3.45Å; K16-K20 PolarHBondContact O-N 2.9Å; L17-K20 PolarHBondContact O-N 3.29Å; K20-A22 VanDerWaalsContact C-N 3.26Å; K20-A22 PolarHBondContact O-N 3.08Å
21	M	57.7	Low	61.1	Low	113 Å²	113	96.5 Å²	96.5	56%	0.557	50%	0.502	S	S	*	.	H	α-helix	trans	-66.5	-28.4	174.1	-70.7	178.4	78.3	0	0	112.6	L17 M18	L17-M21 WeakPolarHBondContact O-CG 3.38Å; L17-M21 PolarHBondContact O-N 3.39Å; M18-M21 PolarHBondContact O-N 2.9Å
22	A	56	Low	60.7	Low	62 Å²	62	94.5 Å²	94.5	51%	0.512	49%	0.492	S	S	.	.	H	α-helix	trans	-93.1	-25.3	-170.6	0	0	0	0	0	115.8	M18 S19 K20	M18-A22 WeakPolarHBondContact O-CB 3.49Å; M18-A22 PolarHBondContact O-N 3.13Å; S19-A22 PolarHBondContact O-N 2.97Å; K20-A22 VanDerWaalsContact C-N 3.26Å; K20-A22 PolarHBondContact O-N 3.08Å
23	T	52.1	Low	60.6	Low	97 Å²	97	94.3 Å²	94.3	60%	0.595	50%	0.495	S	S	*	.	S	Bend	trans	-105.9	-13.2	-150.5	42.4	0	0	0	0	119	S19	S19-T23 WeakPolarHBondContact O-CB 3.4Å; S19-T23 WeakPolarHBondContact O-CG2 3.45Å; S19-T23 PolarHBondContact O-N 3.34Å; S19-T23 PolarHBondContact O-OG1 2.91Å
24	K	49.3	Very low	61.1	Low	179 Å²	179	92 Å²	92	78%	0.778	48%	0.475	S	S	*	.	S	Bend	trans	-133.9	-31.1	-177.9	-78.9	-170.2	173.7	-173.9	0	116.8
25	S	48.3	Very low	62	Low	58 Å²	58	87.7 Å²	87.7	41%	0.406	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-38.1	-175.5	-166.6	0	0	0	0	112	A27 N28 R75	S25-A27 PolarHBondContact O-N 3.36Å; S25-N28 PolarHBondContact O-N 3Å; S25-R75 PolarHBondContact O-NH1 3.23Å; S25-R75 PolarHBondContact O-NH2 3.04Å; S25-R75 WeakPolarHBondContact OG-CD 3.44Å; S25-R75 PolarHBondContact OG-NE 2.96Å; S25-R75 PolarHBondContact OG-NH1 3.47Å
26	M	49.9	Very low	62.7	Low	39 Å²	39	82.5 Å²	82.5	19%	0.192	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.6	178.6	-71.9	-106	62.8	0	0	113.6	V68 V72	M26-V68 HydrophobicContact CE-CB 3.99Å; M26-V68 HydrophobicContact CE-CG1 3.48Å; M26-V68 VanDerWaalsContact CE-CG1 3.48Å; M26-V68 HydrophobicContact CE-CG2 4.25Å; M26-V68 WeakPolarHBondContact CE-O 3.43Å; M26-V68 HydrophobicContact SD-CG1 3.61Å; M26-V72 HydrophobicContact CE-CG2 3.57Å; M26-V72 HydrophobicContact CG-CG2 4.36Å; M26-V72 HydrophobicContact SD-CG2 3.24Å; M26-V72 WeakPolarHBondContact SD-CG2 3.48Å
27	A	48.9	Very low	63.6	Low	33 Å²	33	81.7 Å²	81.7	27%	0.273	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-60.5	-49.4	175.9	0	0	0	0	0	111.9	S25 L29 F30 I31	S25-A27 PolarHBondContact O-N 3.36Å; A27-L29 PolarHBondContact O-N 3.25Å; A27-F30 PolarHBondContact O-N 3.42Å; A27-I31 VanDerWaalsContact CA-CD1 3.5Å; A27-I31 HydrophobicContact CB-CD1 3.26Å; A27-I31 HydrophobicContact CB-CG1 4.37Å; A27-I31 VanDerWaalsContact O-CB 3.22Å; A27-I31 WeakPolarHBondContact O-CB 3.36Å; A27-I31 WeakPolarHBondContact O-CD1 3.42Å; A27-I31 WeakPolarHBondContact O-CG1 3.47Å; A27-I31 PolarHBondContact O-N 3Å
28	N	53.2	Low	65.2	Low	120 Å²	120	76.8 Å²	76.8	64%	0.642	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-68.2	-11.6	-171.9	-65.4	5.3	0	0	0	115.3	S25	S25-N28 PolarHBondContact O-N 3Å
29	L	55.8	Low	66.9	Low	59 Å²	59	72.4 Å²	72.4	31%	0.309	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-87.9	-9.5	-179.6	-144.1	127	0	0	0	112.8	A27 V67	A27-L29 PolarHBondContact O-N 3.25Å; L29-V67 HydrophobicContact CD2-CG1 3.43Å; L29-V67 VanDerWaalsContact CD2-CG1 3.43Å
30	F	53	Low	68.5	Low	38 Å²	38	73.7 Å²	73.7	17%	0.167	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.5	2.2	-178	-62.7	-86.9	0	0	0	114.1	A27 S36 L39 I64 V67 V68	A27-F30 PolarHBondContact O-N 3.42Å; F30-S36 PolarHBondContact O-OG 3.4Å; F30-L39 HydrophobicContact CD1-CD1 4.32Å; F30-I64 HydrophobicContact CE1-CB 4.45Å; F30-I64 HydrophobicContact CE1-CG1 4.44Å; F30-I64 HydrophobicContact CE1-CG2 4.17Å; F30-I64 HydrophobicContact CZ-CG2 4.27Å; F30-V67 HydrophobicContact CE1-CB 3.77Å; F30-V67 HydrophobicContact CE1-CG1 3.6Å; F30-V67 HydrophobicContact CE2-CB 4.45Å; F30-V67 HydrophobicContact CE2-CG1 4Å; F30-V67 HydrophobicContact CZ-CB 3.37Å; F30-V67 HydrophobicContact CZ-CG1 3.2Å; F30-V68 HydrophobicContact CD2-CG2 4.05Å; F30-V68 HydrophobicContact CE2-CB 4.15Å; F30-V68 HydrophobicContact CE2-CG2 3.23Å; F30-V68 HydrophobicContact CZ-CB 4.4Å; F30-V68 HydrophobicContact CZ-CG2 3.6Å
31	I	56.1	Low	70.4	Confident	112 Å²	112	66.7 Å²	66.7	57%	0.574	36%	0.364	S	S	*	.			trans	-96.4	-2.7	-178.5	-70.7	175.4	0	0	0	111.5	A27 D33	A27-I31 VanDerWaalsContact CA-CD1 3.5Å; A27-I31 HydrophobicContact CB-CD1 3.26Å; A27-I31 HydrophobicContact CB-CG1 4.37Å; A27-I31 VanDerWaalsContact O-CB 3.22Å; A27-I31 WeakPolarHBondContact O-CB 3.36Å; A27-I31 WeakPolarHBondContact O-CD1 3.42Å; A27-I31 WeakPolarHBondContact O-CG1 3.47Å; A27-I31 PolarHBondContact O-N 3Å; I31-D33 PolarHBondContact O-N 3.37Å
32	D	73.5	Confident	72.3	Confident	43 Å²	43	62.9 Å²	62.9	23%	0.23	35%	0.346	C	S	.	.	S	Bend	trans	-69	134.5	167.2	92.6	69.8	0	0	0	109.2	T34 S35 S36	D32-T34 PolarHBondContact O-N 2.98Å; D32-T34 WeakPolarHBondContact OD1-CA 3.45Å; D32-T34 WeakPolarHBondContact OD1-CB 3.33Å; D32-T34 PolarHBondContact OD1-N 3.48Å; D32-S35 PolarHBondContact O-N 3.48Å; D32-S35 PolarHBondContact OD1-N 3.18Å; D32-S35 PolarHBondContact OD1-OG 2.94Å; D32-S35 VanDerWaalsContact OD2-CB 3.25Å; D32-S35 WeakPolarHBondContact OD2-CB 3.3Å; D32-S35 PolarHBondContact OD2-OG 3.1Å; D32-S36 PolarHBondContact O-N 2.86Å; D32-S36 PolarHBondContact O-OG 3.48Å
33	D	80.6	Confident	74.3	Confident	127 Å²	127	62.2 Å²	62.2	68%	0.679	33%	0.331	S	S	*	.	H	α-helix	trans	-61.7	-33.2	-173.9	-66.4	-38.7	0	0	0	111.3	I31 S36 E37	I31-D33 PolarHBondContact O-N 3.37Å; D33-S36 PolarHBondContact O-N 3.5Å; D33-E37 WeakPolarHBondContact O-CG 3.41Å; D33-E37 PolarHBondContact O-N 2.99Å
34	T	88.4	Confident	76.5	Confident	4 Å²	4	62.7 Å²	62.7	3%	0.025	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-49.8	-179.4	-45.1	0	0	0	0	111.5	D32 S36 E37 V38 G176 K179 M180	D32-T34 PolarHBondContact O-N 2.98Å; D32-T34 WeakPolarHBondContact OD1-CA 3.45Å; D32-T34 WeakPolarHBondContact OD1-CB 3.33Å; D32-T34 PolarHBondContact OD1-N 3.48Å; T34-S36 PolarHBondContact O-N 2.96Å; T34-E37 PolarHBondContact O-N 2.88Å; T34-V38 WeakPolarHBondContact O-CG2 3.46Å; T34-V38 PolarHBondContact O-N 3.15Å; T34-G176 WeakPolarHBondContact CG2-O 3.39Å; T34-K179 HydrophobicContact CG2-CB 3.98Å; T34-K179 HydrophobicContact CG2-CD 3.81Å; T34-K179 HydrophobicContact CG2-CG 4.05Å; T34-K179 WeakPolarHBondContact OG1-CD 3.46Å; T34-K179 VanDerWaalsContact OG1-CE 3.23Å; T34-K179 WeakPolarHBondContact OG1-CE 3.34Å; T34-K179 PolarHBondContact OG1-NZ 3.06Å; T34-M180 HydrophobicContact CG2-CG 3.81Å
35	S	87.3	Confident	78.9	Confident	15 Å²	15	54.1 Å²	54.1	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-37.6	177.4	-71.4	0	0	0	0	111.6	D32 L39 M180	D32-S35 PolarHBondContact O-N 3.48Å; D32-S35 PolarHBondContact OD1-N 3.18Å; D32-S35 PolarHBondContact OD1-OG 2.94Å; D32-S35 VanDerWaalsContact OD2-CB 3.25Å; D32-S35 WeakPolarHBondContact OD2-CB 3.3Å; D32-S35 PolarHBondContact OD2-OG 3.1Å; S35-L39 VanDerWaalsContact O-CG 3.27Å; S35-L39 WeakPolarHBondContact O-CG 3.45Å; S35-L39 PolarHBondContact O-N 3.47Å; S35-M180 WeakPolarHBondContact OG-CE 3.44Å
36	S	89.8	Confident	81.3	Confident	46 Å²	46	51.4 Å²	51.4	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-67	-43.8	177.8	-63.5	0	0	0	0	111.9	F30 D32 D33 T34 L39 D40	F30-S36 PolarHBondContact O-OG 3.4Å; D32-S36 PolarHBondContact O-N 2.86Å; D32-S36 PolarHBondContact O-OG 3.48Å; D33-S36 PolarHBondContact O-N 3.5Å; T34-S36 PolarHBondContact O-N 2.96Å; S36-L39 PolarHBondContact O-N 2.85Å; S36-D40 PolarHBondContact O-N 3.25Å
37	E	92.5	Very high	83.6	Confident	122 Å²	122	53.9 Å²	53.9	57%	0.57	28%	0.275	S	S	*	.	H	α-helix	trans	-61.6	-43.9	175.6	-74.4	175.4	180	0	0	112	D33 T34 L39 D40 E41	D33-E37 WeakPolarHBondContact O-CG 3.41Å; D33-E37 PolarHBondContact O-N 2.99Å; T34-E37 PolarHBondContact O-N 2.88Å; E37-L39 PolarHBondContact O-N 3.13Å; E37-D40 PolarHBondContact O-N 3.14Å; E37-E41 WeakPolarHBondContact O-CG 3.11Å; E37-E41 PolarHBondContact O-N 3.02Å
38	V	95.3	Very high	85.9	Confident	14 Å²	14	55.8 Å²	55.8	9%	0.085	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-44.6	175.8	173.5	0	0	0	0	110.9	T34 D40 E41 L42 V177 M180	T34-V38 WeakPolarHBondContact O-CG2 3.46Å; T34-V38 PolarHBondContact O-N 3.15Å; V38-D40 VanDerWaalsContact C-N 3.3Å; V38-D40 PolarHBondContact O-N 3.2Å; V38-E41 PolarHBondContact O-N 3.28Å; V38-L42 HydrophobicContact CG1-CD1 4.06Å; V38-L42 HydrophobicContact CG1-CG 4.35Å; V38-L42 WeakPolarHBondContact O-CB 3.41Å; V38-L42 VanDerWaalsContact O-CG 3.27Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 2.66Å; V38-V177 HydrophobicContact CG1-CG2 4.29Å; V38-V177 HydrophobicContact CG2-CG2 4.48Å; V38-M180 HydrophobicContact CG2-SD 4.14Å
39	L	95.6	Very high	88.1	Confident	28 Å²	28	53.3 Å²	53.3	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-62.7	-36.9	176.9	-73.3	171.4	0	0	0	112.6	F30 S35 S36 E37 Y43 L63 I64	F30-L39 HydrophobicContact CD1-CD1 4.32Å; S35-L39 VanDerWaalsContact O-CG 3.27Å; S35-L39 WeakPolarHBondContact O-CG 3.45Å; S35-L39 PolarHBondContact O-N 3.47Å; S36-L39 PolarHBondContact O-N 2.85Å; E37-L39 PolarHBondContact O-N 3.13Å; L39-Y43 WeakPolarHBondContact O-CB 3.25Å; L39-Y43 PolarHBondContact O-N 2.87Å; L39-L63 HydrophobicContact CD2-CD2 3.58Å; L39-L63 HydrophobicContact CD2-CG 4.23Å; L39-I64 HydrophobicContact CD1-CD1 4.42Å; L39-I64 HydrophobicContact CD1-CG1 4.11Å
40	D	96.3	Very high	90.1	Very high	84 Å²	84	52.6 Å²	52.6	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-67.8	-39.3	176	-89.4	-0.4	0	0	0	112.2	S36 E37 V38 Y43 R44	S36-D40 PolarHBondContact O-N 3.25Å; E37-D40 PolarHBondContact O-N 3.14Å; V38-D40 VanDerWaalsContact C-N 3.3Å; V38-D40 PolarHBondContact O-N 3.2Å; D40-Y43 WeakPolarHBondContact O-CB 3.34Å; D40-Y43 PolarHBondContact O-N 3.49Å; D40-R44 VanDerWaalsContact O-CG 3.24Å; D40-R44 WeakPolarHBondContact O-CG 3.45Å; D40-R44 PolarHBondContact O-N 2.9Å
41	E	98.3	Very high	92.2	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.037	29%	0.286	C	S	.	.	H	α-helix	trans	-70.4	-41.3	174.9	-67	-61.7	142	0	0	111.7	E37 V38 Y43 R44 V45 H169 R172 I173	E37-E41 WeakPolarHBondContact O-CG 3.11Å; E37-E41 PolarHBondContact O-N 3.02Å; V38-E41 PolarHBondContact O-N 3.28Å; E41-Y43 PolarHBondContact O-N 3.2Å; E41-R44 PolarHBondContact O-N 3.43Å; E41-R44 IonicContact OE1-CZ 3.47Å; E41-R44 IonicContact OE1-NE 3.84Å; E41-R44 IonicContact OE1-NH1 2.83Å; E41-R44 PolarHBondContact OE1-NH1 2.97Å; E41-V45 WeakPolarHBondContact O-CG2 3.42Å; E41-V45 PolarHBondContact O-N 3.35Å; E41-H169 WeakPolarHBondContact OE2-CA 3.26Å; E41-H169 IonicContact OE2-CE1 3.52Å; E41-H169 IonicContact OE2-CG 3.84Å; E41-H169 IonicContact OE2-ND1 3.34Å; E41-H169 PolarHBondContact OE2-ND1 2.95Å; E41-R172 HydrophobicContact CG-CB 3.85Å; E41-R172 IonicContact OE1-CZ 3.88Å; E41-R172 IonicContact OE1-NE 3.07Å; E41-R172 PolarHBondContact OE1-NE 3.49Å; E41-R172 IonicContact OE1-NH2 3.56Å; E41-R172 PolarHBondContact OE1-NH2 3.37Å; E41-R172 IonicContact OE2-CZ 2.96Å; E41-R172 IonicContact OE2-NE 2.83Å; E41-R172 PolarHBondContact OE2-NE 3.42Å; E41-R172 IonicContact OE2-NH2 3.51Å; E41-R172 PolarHBondContact OE2-NH2 3.25Å; E41-I173 HydrophobicContact CB-CD1 4.05Å; E41-I173 HydrophobicContact CB-CG1 3.43Å; E41-I173 VanDerWaalsContact CB-CG1 3.43Å; E41-I173 HydrophobicContact CG-CG1 4.39Å
42	L	98.3	Very high	94.2	Very high	33 Å²	33	56.5 Å²	56.5	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-38.8	171.3	-71	174.9	0	0	0	111.5	V38 V45 T46 I60 L63 F150 I173	V38-L42 HydrophobicContact CG1-CD1 4.06Å; V38-L42 HydrophobicContact CG1-CG 4.35Å; V38-L42 WeakPolarHBondContact O-CB 3.41Å; V38-L42 VanDerWaalsContact O-CG 3.27Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 2.66Å; L42-V45 WeakPolarHBondContact O-CG2 3.5Å; L42-T46 VanDerWaalsContact O-CB 3.22Å; L42-T46 WeakPolarHBondContact O-CB 3.43Å; L42-T46 PolarHBondContact O-N 3.08Å; L42-T46 VanDerWaalsContact O-N 3.12Å; L42-T46 PolarHBondContact O-OG1 3.38Å; L42-I60 HydrophobicContact CB-CD1 3.81Å; L42-L63 HydrophobicContact CD1-CD2 4.37Å; L42-F150 HydrophobicContact CB-CE1 4.43Å; L42-F150 HydrophobicContact CB-CZ 4.23Å; L42-F150 HydrophobicContact CD2-CE1 3.85Å; L42-F150 HydrophobicContact CD2-CZ 4.27Å; L42-I173 HydrophobicContact CD2-CD1 4.18Å
43	Y	98.5	Very high	95.4	Very high	48 Å²	48	62 Å²	62	19%	0.188	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-49	171.6	168.9	-111	0	0	0	111.9	L39 D40 E41 T46 K47 A56 Q57 I60	L39-Y43 WeakPolarHBondContact O-CB 3.25Å; L39-Y43 PolarHBondContact O-N 2.87Å; D40-Y43 WeakPolarHBondContact O-CB 3.34Å; D40-Y43 PolarHBondContact O-N 3.49Å; E41-Y43 PolarHBondContact O-N 3.2Å; Y43-T46 PolarHBondContact O-N 3.49Å; Y43-K47 HydrophobicContact CE1-CD 4.39Å; Y43-K47 HydrophobicContact CE2-CB 4.42Å; Y43-K47 WeakPolarHBondContact O-CB 3.32Å; Y43-K47 PolarHBondContact O-N 3.39Å; Y43-A56 HydrophobicContact CD2-CB 3.83Å; Y43-A56 HydrophobicContact CE2-CB 3.68Å; Y43-Q57 HydrophobicContact CD2-CG 4.47Å; Y43-Q57 HydrophobicContact CE2-CG 3.66Å; Y43-I60 HydrophobicContact CD2-CG1 4.34Å
44	R	98.6	Very high	96.3	Very high	106 Å²	106	64 Å²	64	40%	0.4	30%	0.297	S	S	.	.	H	α-helix	trans	-61.1	-49.9	-177	-71.4	164.3	-167	-175.8	1.6	111.3	D40 E41 T46 K47 E48	D40-R44 VanDerWaalsContact O-CG 3.24Å; D40-R44 WeakPolarHBondContact O-CG 3.45Å; D40-R44 PolarHBondContact O-N 2.9Å; E41-R44 PolarHBondContact O-N 3.43Å; E41-R44 IonicContact OE1-CZ 3.47Å; E41-R44 IonicContact OE1-NE 3.84Å; E41-R44 IonicContact OE1-NH1 2.83Å; E41-R44 PolarHBondContact OE1-NH1 2.97Å; R44-T46 VanDerWaalsContact C-N 3.33Å; R44-T46 PolarHBondContact O-N 3.03Å; R44-K47 PolarHBondContact O-N 2.91Å; R44-E48 WeakPolarHBondContact O-CB 3.46Å; R44-E48 PolarHBondContact O-N 3.16Å
45	V	98.5	Very high	96.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-36	179	-57.8	0	0	0	0	112.3	E41 L42 E48 Y49 F155 L159 Y166 H169 I173	E41-V45 WeakPolarHBondContact O-CG2 3.42Å; E41-V45 PolarHBondContact O-N 3.35Å; L42-V45 WeakPolarHBondContact O-CG2 3.5Å; V45-E48 PolarHBondContact O-N 3.37Å; V45-Y49 WeakPolarHBondContact O-CB 3.33Å; V45-Y49 PolarHBondContact O-N 3.28Å; V45-F155 HydrophobicContact CB-CE2 4.44Å; V45-F155 HydrophobicContact CG2-CE2 4.16Å; V45-F155 HydrophobicContact CG2-CZ 3.88Å; V45-L159 HydrophobicContact CB-CD1 4.07Å; V45-L159 HydrophobicContact CG1-CD1 3.78Å; V45-L159 HydrophobicContact CG2-CD1 4.34Å; V45-Y166 HydrophobicContact CB-CD1 4.13Å; V45-Y166 HydrophobicContact CB-CE1 4.13Å; V45-Y166 HydrophobicContact CG1-CD1 4.09Å; V45-H169 HydrophobicContact CG1-CB 3.33Å; V45-I173 HydrophobicContact CG1-CD1 4.1Å; V45-I173 HydrophobicContact CG2-CD1 4.26Å
46	T	98.6	Very high	97.3	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.9	-42.8	175.8	-61.3	0	0	0	0	111.1	L42 Y43 R44 E48 T50 A56 I59 H149	L42-T46 VanDerWaalsContact O-CB 3.22Å; L42-T46 WeakPolarHBondContact O-CB 3.43Å; L42-T46 PolarHBondContact O-N 3.08Å; L42-T46 VanDerWaalsContact O-N 3.12Å; L42-T46 PolarHBondContact O-OG1 3.38Å; Y43-T46 PolarHBondContact O-N 3.49Å; R44-T46 VanDerWaalsContact C-N 3.33Å; R44-T46 PolarHBondContact O-N 3.03Å; T46-E48 VanDerWaalsContact C-N 3.35Å; T46-T50 HydrophobicContact CG2-CG2 4.27Å; T46-T50 WeakPolarHBondContact O-CB 3.37Å; T46-T50 VanDerWaalsContact O-CG2 3.29Å; T46-T50 WeakPolarHBondContact O-CG2 3.31Å; T46-T50 PolarHBondContact O-N 3.23Å; T46-T50 PolarHBondContact O-OG1 3.33Å; T46-A56 HydrophobicContact CG2-CB 3.72Å; T46-I59 HydrophobicContact CG2-CB 4.45Å; T46-I59 HydrophobicContact CG2-CD1 3.56Å; T46-H149 WeakPolarHBondContact CG2-NE2 3.44Å; T46-H149 PolarHBondContact OG1-NE2 3Å; T46-H149 VanDerWaalsContact OG1-NE2 3.14Å
47	K	98.6	Very high	97.7	Very high	92 Å²	92	67.7 Å²	67.7	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-42.7	177.8	177.7	-168.9	164.8	-157.4	0	111	Y43 R44 H51 A56	Y43-K47 HydrophobicContact CE1-CD 4.39Å; Y43-K47 HydrophobicContact CE2-CB 4.42Å; Y43-K47 WeakPolarHBondContact O-CB 3.32Å; Y43-K47 PolarHBondContact O-N 3.39Å; R44-K47 PolarHBondContact O-N 2.91Å; K47-H51 WeakPolarHBondContact O-CA 3.3Å; K47-H51 PolarHBondContact O-N 3.36Å; K47-A56 HydrophobicContact CB-CB 3.75Å
48	E	97.8	Very high	98	Very high	73 Å²	73	65.8 Å²	65.8	34%	0.341	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-50.5	177.9	-170.2	58.9	-151.2	0	0	110.4	R44 V45 T46 H51 V165 Y166	R44-E48 WeakPolarHBondContact O-CB 3.46Å; R44-E48 PolarHBondContact O-N 3.16Å; V45-E48 PolarHBondContact O-N 3.37Å; T46-E48 VanDerWaalsContact C-N 3.35Å; E48-H51 PolarHBondContact O-CE1 2.95Å; E48-H51 PolarHBondContact O-N 2.92Å; E48-H51 PolarHBondContact O-ND1 3.48Å; E48-H51 VanDerWaalsContact O-ND1 3.12Å; E48-V165 HydrophobicContact CG-CG1 3.77Å; E48-Y166 HydrophobicContact CB-CE1 3.99Å; E48-Y166 HydrophobicContact CG-CE1 4.02Å; E48-Y166 HydrophobicContact CG-CE2 4.45Å
49	Y	98.3	Very high	98.1	Very high	67 Å²	67	65.3 Å²	65.3	26%	0.263	29%	0.294	S	S	.	.	H	α-helix	trans	-65.8	-45	-177.8	-178	-107	0	0	0	113.7	V45 H51 D152 D154 F155 A158 Y166	V45-Y49 WeakPolarHBondContact O-CB 3.33Å; V45-Y49 PolarHBondContact O-N 3.28Å; Y49-H51 VanDerWaalsContact C-N 3.3Å; Y49-H51 PolarHBondContact O-N 3.4Å; Y49-D152 PolarHBondContact OH-OD1 3.33Å; Y49-D154 VanDerWaalsContact OH-C 3.29Å; Y49-D154 VanDerWaalsContact OH-CB 3.25Å; Y49-D154 WeakPolarHBondContact OH-CB 3.25Å; Y49-F155 HydrophobicContact CD1-CB 4Å; Y49-F155 AromaticContact CD1-CD2 3.67Å; Y49-F155 HydrophobicContact CD1-CD2 3.67Å; Y49-F155 HydrophobicContact CD1-CG 4.27Å; Y49-F155 HydrophobicContact CD2-CD2 4.15Å; Y49-F155 HydrophobicContact CE1-CB 3.63Å; Y49-F155 HydrophobicContact CE1-CD2 4.22Å; Y49-F155 HydrophobicContact CE1-CG 4.39Å; Y49-F155 HydrophobicContact CE2-CB 4.23Å; Y49-F155 HydrophobicContact CG-CB 4.41Å; Y49-F155 AromaticContact CG-CD2 3.61Å; Y49-F155 HydrophobicContact CG-CD2 3.61Å; Y49-F155 HydrophobicContact CG-CE2 4.46Å; Y49-F155 HydrophobicContact CG-CG 4.5Å; Y49-F155 VanDerWaalsContact CZ-CA 3.44Å; Y49-F155 VanDerWaalsContact CZ-N 3.34Å; Y49-F155 PolarHBondContact OH-N 2.87Å; Y49-A158 HydrophobicContact CD2-CB 3.92Å; Y49-A158 HydrophobicContact CE2-CB 4.02Å; Y49-Y166 WeakPolarHBondContact CA-OH 3.45Å; Y49-Y166 WeakPolarHBondContact CB-OH 3.36Å; Y49-Y166 PolarHBondContact N-OH 3.03Å; Y49-Y166 VanDerWaalsContact N-OH 3.1Å
50	T	98.1	Very high	98.3	Very high	44 Å²	44	64.7 Å²	64.7	27%	0.27	29%	0.291	S	S	.	.	H	α-helix	trans	-80.5	-13.9	-176.1	59.5	0	0	0	0	113.3	T46 N52	T46-T50 HydrophobicContact CG2-CG2 4.27Å; T46-T50 WeakPolarHBondContact O-CB 3.37Å; T46-T50 VanDerWaalsContact O-CG2 3.29Å; T46-T50 WeakPolarHBondContact O-CG2 3.31Å; T46-T50 PolarHBondContact O-N 3.23Å; T46-T50 PolarHBondContact O-OG1 3.33Å; T50-N52 WeakPolarHBondContact O-CB 3.39Å; T50-N52 PolarHBondContact O-N 3.02Å; T50-N52 PolarHBondContact OG1-N 3.28Å; T50-N52 PolarHBondContact OG1-O 3.01Å
51	H	98.1	Very high	98.3	Very high	160 Å²	160	66 Å²	66	74%	0.741	29%	0.292	S	S	*	.			trans	47	26.8	-164.7	-57.1	-63.2	0	0	0	113.4	K47 E48 Y49	K47-H51 WeakPolarHBondContact O-CA 3.3Å; K47-H51 PolarHBondContact O-N 3.36Å; E48-H51 PolarHBondContact O-CE1 2.95Å; E48-H51 PolarHBondContact O-N 2.92Å; E48-H51 PolarHBondContact O-ND1 3.48Å; E48-H51 VanDerWaalsContact O-ND1 3.12Å; Y49-H51 VanDerWaalsContact C-N 3.3Å; Y49-H51 PolarHBondContact O-N 3.4Å
52	N	98.4	Very high	98.3	Very high	73 Å²	73	66.2 Å²	66.2	39%	0.39	29%	0.294	S	S	.	.			trans	-134.1	97.8	-172.1	-172.2	-22.4	0	0	0	111.5	T50 K54 E55 A56	T50-N52 WeakPolarHBondContact O-CB 3.39Å; T50-N52 PolarHBondContact O-N 3.02Å; T50-N52 PolarHBondContact OG1-N 3.28Å; T50-N52 PolarHBondContact OG1-O 3.01Å; N52-K54 VanDerWaalsContact C-N 3.29Å; N52-K54 PolarHBondContact O-N 3.34Å; N52-K54 PolarHBondContact OD1-N 2.95Å; N52-K54 VanDerWaalsContact OD1-N 3.08Å; N52-E55 HydrophobicContact CB-CB 3.9Å; N52-E55 PolarHBondContact O-N 2.94Å; N52-E55 PolarHBondContact OD1-N 3.26Å; N52-A56 PolarHBondContact O-N 3.46Å
53	R	98.3	Very high	98.2	Very high	157 Å²	157	66.2 Å²	66.2	59%	0.592	29%	0.294	S	S	*	.	H	α-helix	trans	-54.9	-42.3	178.3	178	173.3	-178	173.7	3	113.1	E55 Q57	R53-E55 VanDerWaalsContact C-N 3.34Å; R53-Q57 WeakPolarHBondContact O-CB 3.37Å; R53-Q57 VanDerWaalsContact O-CG 3.27Å; R53-Q57 WeakPolarHBondContact O-CG 3.39Å; R53-Q57 PolarHBondContact O-N 2.83Å
54	K	98.4	Very high	98	Very high	171 Å²	171	66.9 Å²	66.9	74%	0.743	30%	0.3	S	S	*	.	H	α-helix	trans	-68.2	-39.2	-176.4	-70.1	-176.8	178.6	174.7	0	110.7	N52 K58	N52-K54 VanDerWaalsContact C-N 3.29Å; N52-K54 PolarHBondContact O-N 3.34Å; N52-K54 PolarHBondContact OD1-N 2.95Å; N52-K54 VanDerWaalsContact OD1-N 3.08Å; K54-K58 WeakPolarHBondContact O-CB 3.39Å; K54-K58 PolarHBondContact O-N 2.98Å
55	E	98.6	Very high	97.7	Very high	53 Å²	53	65.9 Å²	65.9	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-69.9	-46.2	178.9	-173	58.7	-166.3	0	0	111.7	N52 R53 Q57 K58 I59 H145	N52-E55 HydrophobicContact CB-CB 3.9Å; N52-E55 PolarHBondContact O-N 2.94Å; N52-E55 PolarHBondContact OD1-N 3.26Å; R53-E55 VanDerWaalsContact C-N 3.34Å; E55-Q57 VanDerWaalsContact C-N 3.33Å; E55-Q57 PolarHBondContact O-N 2.92Å; E55-K58 CarbonylContact O-C 3.6Å; E55-K58 WeakPolarHBondContact O-CA 3.46Å; E55-K58 WeakPolarHBondContact O-CB 3.46Å; E55-K58 PolarHBondContact O-N 3.14Å; E55-K58 IonicContact OE2-NZ 2.66Å; E55-I59 HydrophobicContact CG-CD1 4.13Å; E55-I59 PolarHBondContact O-N 3.33Å; E55-H145 IonicContact OE1-CD2 3Å; E55-H145 IonicContact OE1-CE1 3.61Å; E55-H145 PolarHBondContact OE1-CE1 3.33Å; E55-H145 IonicContact OE1-NE2 3.46Å; E55-H145 PolarHBondContact OE1-NE2 3.3Å; E55-H145 IonicContact OE2-NE2 3.66Å
56	A	98.4	Very high	97.5	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.7	-45.5	174.7	0	0	0	0	0	112.5	Y43 T46 K47 N52 K58 I59 I60	Y43-A56 HydrophobicContact CD2-CB 3.83Å; Y43-A56 HydrophobicContact CE2-CB 3.68Å; T46-A56 HydrophobicContact CG2-CB 3.72Å; K47-A56 HydrophobicContact CB-CB 3.75Å; N52-A56 PolarHBondContact O-N 3.46Å; A56-K58 VanDerWaalsContact C-N 3.27Å; A56-K58 PolarHBondContact O-N 2.97Å; A56-I59 PolarHBondContact O-N 2.92Å; A56-I60 WeakPolarHBondContact O-CG1 3.36Å; A56-I60 PolarHBondContact O-N 3.27Å; A56-I60 VanDerWaalsContact O-N 3.14Å
57	Q	98.2	Very high	97.2	Very high	88 Å²	88	69 Å²	69	41%	0.411	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-36.8	174.5	-75.1	178.4	-25	0	0	112.4	Y43 R53 E55 K61	Y43-Q57 HydrophobicContact CD2-CG 4.47Å; Y43-Q57 HydrophobicContact CE2-CG 3.66Å; R53-Q57 WeakPolarHBondContact O-CB 3.37Å; R53-Q57 VanDerWaalsContact O-CG 3.27Å; R53-Q57 WeakPolarHBondContact O-CG 3.39Å; R53-Q57 PolarHBondContact O-N 2.83Å; E55-Q57 VanDerWaalsContact C-N 3.33Å; E55-Q57 PolarHBondContact O-N 2.92Å; Q57-K61 WeakPolarHBondContact O-CB 3.09Å; Q57-K61 PolarHBondContact O-N 2.91Å
58	K	98.6	Very high	96.6	Very high	83 Å²	83	66.7 Å²	66.7	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-71.6	-40	-179.8	-176.8	-174.3	163.7	-143.4	0	111.7	K54 E55 A56 N62 H145	K54-K58 WeakPolarHBondContact O-CB 3.39Å; K54-K58 PolarHBondContact O-N 2.98Å; E55-K58 CarbonylContact O-C 3.6Å; E55-K58 WeakPolarHBondContact O-CA 3.46Å; E55-K58 WeakPolarHBondContact O-CB 3.46Å; E55-K58 PolarHBondContact O-N 3.14Å; E55-K58 IonicContact OE2-NZ 2.66Å; A56-K58 VanDerWaalsContact C-N 3.27Å; A56-K58 PolarHBondContact O-N 2.97Å; K58-N62 VanDerWaalsContact O-CB 3.32Å; K58-N62 WeakPolarHBondContact O-CB 3.49Å; K58-N62 PolarHBondContact O-N 2.98Å; K58-N62 PolarHBondContact O-ND2 3.28Å; K58-H145 VanDerWaalsContact CE-NE2 3.32Å; K58-H145 WeakPolarHBondContact CE-NE2 3.44Å; K58-H145 PolarHBondContact NZ-NE2 3.27Å
59	I	98.7	Very high	96.3	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-54.2	174.5	-70.9	164.7	0	0	0	109.8	T46 E55 A56 K61 N62 L63 H145 H149 F150	T46-I59 HydrophobicContact CG2-CB 4.45Å; T46-I59 HydrophobicContact CG2-CD1 3.56Å; E55-I59 HydrophobicContact CG-CD1 4.13Å; E55-I59 PolarHBondContact O-N 3.33Å; A56-I59 PolarHBondContact O-N 2.92Å; I59-K61 PolarHBondContact O-N 3.37Å; I59-N62 WeakPolarHBondContact O-CA 3.41Å; I59-N62 WeakPolarHBondContact O-CB 3.34Å; I59-N62 PolarHBondContact O-N 2.86Å; I59-L63 PolarHBondContact O-N 2.96Å; I59-H145 VanDerWaalsContact CG1-CE1 3.5Å; I59-H145 WeakPolarHBondContact CG1-CE1 3.27Å; I59-H149 HydrophobicContact CD1-CB 3.87Å; I59-F150 HydrophobicContact CG2-CE2 3.81Å; I59-F150 HydrophobicContact CG2-CZ 4.06Å
60	I	98	Very high	96	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-41.1	-178	-58.9	-63.8	0	0	0	111.8	L42 Y43 A56 N62 L63 I64 F150	L42-I60 HydrophobicContact CB-CD1 3.81Å; Y43-I60 HydrophobicContact CD2-CG1 4.34Å; A56-I60 WeakPolarHBondContact O-CG1 3.36Å; A56-I60 PolarHBondContact O-N 3.27Å; A56-I60 VanDerWaalsContact O-N 3.14Å; I60-N62 VanDerWaalsContact C-N 3.26Å; I60-N62 PolarHBondContact O-N 3.38Å; I60-L63 WeakPolarHBondContact O-CB 3.33Å; I60-L63 PolarHBondContact O-N 2.92Å; I60-I64 HydrophobicContact CG2-CD1 4.06Å; I60-I64 WeakPolarHBondContact O-CG1 3.47Å; I60-I64 PolarHBondContact O-N 3.49Å; I60-F150 HydrophobicContact CD1-CZ 4.25Å
61	K	96.9	Very high	95.5	Very high	111 Å²	111	62.7 Å²	62.7	48%	0.483	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-37.2	172.6	178.6	179.5	68.9	-166.1	0	112.4	Q57 I59 K65	Q57-K61 WeakPolarHBondContact O-CB 3.09Å; Q57-K61 PolarHBondContact O-N 2.91Å; I59-K61 PolarHBondContact O-N 3.37Å; K61-K65 HydrophobicContact CG-CD 4.29Å; K61-K65 WeakPolarHBondContact O-CB 3.49Å; K61-K65 WeakPolarHBondContact O-CG 3.46Å; K61-K65 PolarHBondContact O-N 3.34Å
62	N	98.4	Very high	95	Very high	12 Å²	12	57 Å²	57	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-70.6	-40.9	177.7	-77.8	-16	0	0	0	111.2	K58 I59 I60 K65 M66 R142 H145 V146	K58-N62 VanDerWaalsContact O-CB 3.32Å; K58-N62 WeakPolarHBondContact O-CB 3.49Å; K58-N62 PolarHBondContact O-N 2.98Å; K58-N62 PolarHBondContact O-ND2 3.28Å; I59-N62 WeakPolarHBondContact O-CA 3.41Å; I59-N62 WeakPolarHBondContact O-CB 3.34Å; I59-N62 PolarHBondContact O-N 2.86Å; I60-N62 VanDerWaalsContact C-N 3.26Å; I60-N62 PolarHBondContact O-N 3.38Å; N62-K65 PolarHBondContact O-N 2.83Å; N62-M66 VanDerWaalsContact O-CG 3.28Å; N62-M66 WeakPolarHBondContact O-CG 3.4Å; N62-M66 PolarHBondContact O-N 3.11Å; N62-R142 HydrophobicContact CB-CB 4.02Å; N62-R142 HydrophobicContact CB-CG 4.15Å; N62-R142 WeakPolarHBondContact OD1-CG 3.27Å; N62-H145 PolarHBondContact ND2-ND1 3.29Å; N62-V146 HydrophobicContact CB-CG2 3.72Å
63	L	97.1	Very high	94.6	Very high	33 Å²	33	54.4 Å²	54.4	17%	0.173	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-51.7	173.3	174.5	58.7	0	0	0	111.3	L39 L42 I59 I60 K65 M66 V67 V146 F150	L39-L63 HydrophobicContact CD2-CD2 3.58Å; L39-L63 HydrophobicContact CD2-CG 4.23Å; L42-L63 HydrophobicContact CD1-CD2 4.37Å; I59-L63 PolarHBondContact O-N 2.96Å; I60-L63 WeakPolarHBondContact O-CB 3.33Å; I60-L63 PolarHBondContact O-N 2.92Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 2.98Å; L63-M66 WeakPolarHBondContact O-CB 3.31Å; L63-M66 PolarHBondContact O-N 3.25Å; L63-M66 VanDerWaalsContact O-N 3.08Å; L63-V67 HydrophobicContact CD1-CG2 4.21Å; L63-V67 PolarHBondContact O-N 3.23Å; L63-V146 HydrophobicContact CB-CG1 4.17Å; L63-V146 HydrophobicContact CB-CG2 4.08Å; L63-V146 HydrophobicContact CD1-CG1 4.14Å; L63-F150 HydrophobicContact CD2-CE2 4.5Å
64	I	93.3	Very high	94.1	Very high	63 Å²	63	53.3 Å²	53.3	32%	0.323	25%	0.252	S	S	.	.	H	α-helix	trans	-57.1	-47.3	176.4	-66.2	166	0	0	0	110.5	F30 L39 I60 M66 V67 V68	F30-I64 HydrophobicContact CE1-CB 4.45Å; F30-I64 HydrophobicContact CE1-CG1 4.44Å; F30-I64 HydrophobicContact CE1-CG2 4.17Å; F30-I64 HydrophobicContact CZ-CG2 4.27Å; L39-I64 HydrophobicContact CD1-CD1 4.42Å; L39-I64 HydrophobicContact CD1-CG1 4.11Å; I60-I64 HydrophobicContact CG2-CD1 4.06Å; I60-I64 WeakPolarHBondContact O-CG1 3.47Å; I60-I64 PolarHBondContact O-N 3.49Å; I64-M66 VanDerWaalsContact C-N 3.26Å; I64-M66 PolarHBondContact O-N 2.97Å; I64-V67 PolarHBondContact O-N 2.86Å; I64-V68 HydrophobicContact CG2-CG2 4.07Å; I64-V68 WeakPolarHBondContact O-CB 3.29Å; I64-V68 WeakPolarHBondContact O-CG2 3.32Å; I64-V68 PolarHBondContact O-N 3.07Å
65	K	93.1	Very high	93.5	Very high	84 Å²	84	49.7 Å²	49.7	37%	0.365	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-33.9	178.5	-77.5	175.6	-173.2	-64.1	0	113.1	K61 N62 L63 K69	K61-K65 HydrophobicContact CG-CD 4.29Å; K61-K65 WeakPolarHBondContact O-CB 3.49Å; K61-K65 WeakPolarHBondContact O-CG 3.46Å; K61-K65 PolarHBondContact O-N 3.34Å; N62-K65 PolarHBondContact O-N 2.83Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 2.98Å; K65-K69 WeakPolarHBondContact O-CB 3.41Å; K65-K69 VanDerWaalsContact O-CG 3.24Å; K65-K69 WeakPolarHBondContact O-CG 3.37Å; K65-K69 PolarHBondContact O-N 3.37Å
66	M	94.3	Very high	93	Very high	16 Å²	16	50.5 Å²	50.5	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-68	-52.8	176.9	-73.4	156.7	48.3	0	0	110.5	N62 L63 I64 V68 K69 L70 L127 R142 V143 V146 F147	N62-M66 VanDerWaalsContact O-CG 3.28Å; N62-M66 WeakPolarHBondContact O-CG 3.4Å; N62-M66 PolarHBondContact O-N 3.11Å; L63-M66 WeakPolarHBondContact O-CB 3.31Å; L63-M66 PolarHBondContact O-N 3.25Å; L63-M66 VanDerWaalsContact O-N 3.08Å; I64-M66 VanDerWaalsContact C-N 3.26Å; I64-M66 PolarHBondContact O-N 2.97Å; M66-V68 VanDerWaalsContact C-N 3.34Å; M66-V68 PolarHBondContact O-N 3.45Å; M66-K69 PolarHBondContact O-N 3.29Å; M66-K69 VanDerWaalsContact O-N 3.17Å; M66-L70 PolarHBondContact O-N 2.75Å; M66-L127 HydrophobicContact CE-CD2 3.66Å; M66-R142 HydrophobicContact CG-CB 4.37Å; M66-R142 HydrophobicContact SD-CB 4.32Å; M66-V143 HydrophobicContact CE-CB 4.25Å; M66-V143 HydrophobicContact CE-CG1 4.46Å; M66-V143 HydrophobicContact CE-CG2 3.91Å; M66-V143 HydrophobicContact CG-CG2 4.05Å; M66-V143 VanDerWaalsContact SD-CA 3.54Å; M66-V143 HydrophobicContact SD-CB 4.36Å; M66-V143 HydrophobicContact SD-CG2 4.01Å; M66-V146 HydrophobicContact CE-CB 4.28Å; M66-V146 HydrophobicContact CE-CG1 4.37Å; M66-V146 HydrophobicContact SD-CB 4.03Å; M66-V146 HydrophobicContact SD-CG2 3.71Å; M66-F147 HydrophobicContact CE-CD2 4.2Å; M66-F147 HydrophobicContact CE-CE2 3.76Å
67	V	91	Very high	92.6	Very high	51 Å²	51	57.3 Å²	57.3	31%	0.309	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-39.8	-178.2	174.2	0	0	0	0	110.9	L29 F30 L63 I64 K69 L70 G71	L29-V67 HydrophobicContact CD2-CG1 3.43Å; L29-V67 VanDerWaalsContact CD2-CG1 3.43Å; F30-V67 HydrophobicContact CE1-CB 3.77Å; F30-V67 HydrophobicContact CE1-CG1 3.6Å; F30-V67 HydrophobicContact CE2-CB 4.45Å; F30-V67 HydrophobicContact CE2-CG1 4Å; F30-V67 HydrophobicContact CZ-CB 3.37Å; F30-V67 HydrophobicContact CZ-CG1 3.2Å; L63-V67 HydrophobicContact CD1-CG2 4.21Å; L63-V67 PolarHBondContact O-N 3.23Å; I64-V67 PolarHBondContact O-N 2.86Å; V67-K69 PolarHBondContact O-N 3.02Å; V67-L70 PolarHBondContact O-N 3.32Å; V67-G71 PolarHBondContact O-N 3.42Å
68	V	87.7	Confident	92.4	Very high	42 Å²	42	58.1 Å²	58.1	26%	0.255	28%	0.28	S	S	.	.	H	α-helix	trans	-56.5	-51.5	172.9	164.3	0	0	0	0	110.4	M26 F30 I64 M66 L70 G71 V72	M26-V68 HydrophobicContact CE-CB 3.99Å; M26-V68 HydrophobicContact CE-CG1 3.48Å; M26-V68 VanDerWaalsContact CE-CG1 3.48Å; M26-V68 HydrophobicContact CE-CG2 4.25Å; M26-V68 WeakPolarHBondContact CE-O 3.43Å; M26-V68 HydrophobicContact SD-CG1 3.61Å; F30-V68 HydrophobicContact CD2-CG2 4.05Å; F30-V68 HydrophobicContact CE2-CB 4.15Å; F30-V68 HydrophobicContact CE2-CG2 3.23Å; F30-V68 HydrophobicContact CZ-CB 4.4Å; F30-V68 HydrophobicContact CZ-CG2 3.6Å; I64-V68 HydrophobicContact CG2-CG2 4.07Å; I64-V68 WeakPolarHBondContact O-CB 3.29Å; I64-V68 WeakPolarHBondContact O-CG2 3.32Å; I64-V68 PolarHBondContact O-N 3.07Å; M66-V68 VanDerWaalsContact C-N 3.34Å; M66-V68 PolarHBondContact O-N 3.45Å; V68-L70 PolarHBondContact O-N 3.05Å; V68-G71 PolarHBondContact O-N 3.03Å; V68-V72 WeakPolarHBondContact O-CG2 3.39Å; V68-V72 PolarHBondContact O-N 3.19Å
69	K	90.8	Very high	92.3	Very high	64 Å²	64	55 Å²	55	28%	0.278	27%	0.266	S	S	.	.	H	α-helix	trans	-64.3	-42	-177.9	-78.3	177.8	164.8	-136.1	0	112.1	K65 M66 V67 G71 V72 L73 L135 S139	K65-K69 WeakPolarHBondContact O-CB 3.41Å; K65-K69 VanDerWaalsContact O-CG 3.24Å; K65-K69 WeakPolarHBondContact O-CG 3.37Å; K65-K69 PolarHBondContact O-N 3.37Å; M66-K69 PolarHBondContact O-N 3.29Å; M66-K69 VanDerWaalsContact O-N 3.17Å; V67-K69 PolarHBondContact O-N 3.02Å; K69-G71 VanDerWaalsContact C-N 3.35Å; K69-V72 PolarHBondContact O-N 3.06Å; K69-L73 WeakPolarHBondContact O-CG 3.38Å; K69-L73 PolarHBondContact O-N 3.17Å; K69-L135 HydrophobicContact CB-CD1 4.02Å; K69-L135 HydrophobicContact CB-CD2 4.41Å; K69-L135 HydrophobicContact CD-CD1 4Å; K69-L135 HydrophobicContact CD-CD2 4.06Å; K69-S139 PolarHBondContact NZ-OG 2.95Å
70	L	91.5	Very high	92.2	Very high	28 Å²	28	56.8 Å²	56.8	15%	0.147	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-46.3	177	-175.7	59.1	0	0	0	110.8	M66 V67 V68 V72 L73 Y74 F79 V87 F90 L127	M66-L70 PolarHBondContact O-N 2.75Å; V67-L70 PolarHBondContact O-N 3.32Å; V68-L70 PolarHBondContact O-N 3.05Å; L70-V72 VanDerWaalsContact C-N 3.34Å; L70-V72 PolarHBondContact O-N 2.85Å; L70-L73 PolarHBondContact O-N 2.9Å; L70-Y74 WeakPolarHBondContact O-CB 3.33Å; L70-Y74 PolarHBondContact O-N 3.16Å; L70-F79 HydrophobicContact CD1-CE2 3.95Å; L70-F79 HydrophobicContact CD1-CZ 3.65Å; L70-V87 HydrophobicContact CD1-CG2 4.48Å; L70-F90 HydrophobicContact CD2-CD1 4.23Å; L70-F90 HydrophobicContact CD2-CE1 3.85Å; L70-L127 HydrophobicContact CD1-CD1 4.39Å; L70-L127 HydrophobicContact CD2-CD1 4.06Å
71	G	87.3	Confident	92.2	Very high	8 Å²	8	58.6 Å²	58.6	8%	0.082	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-37.5	176.4	0	0	0	0	0	113.6	V67 V68 K69 R75	V67-G71 PolarHBondContact O-N 3.42Å; V68-G71 PolarHBondContact O-N 3.03Å; K69-G71 VanDerWaalsContact C-N 3.35Å; G71-R75 WeakPolarHBondContact O-CB 3.35Å; G71-R75 VanDerWaalsContact O-CG 3.32Å; G71-R75 WeakPolarHBondContact O-CG 3.32Å; G71-R75 PolarHBondContact O-N 3.28Å
72	V	87.5	Confident	92.2	Very high	42 Å²	42	60.7 Å²	60.7	26%	0.255	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-42.9	174.9	171.9	0	0	0	0	111.7	M26 V68 K69 L70 N76	M26-V72 HydrophobicContact CE-CG2 3.57Å; M26-V72 HydrophobicContact CG-CG2 4.36Å; M26-V72 HydrophobicContact SD-CG2 3.24Å; M26-V72 WeakPolarHBondContact SD-CG2 3.48Å; V68-V72 WeakPolarHBondContact O-CG2 3.39Å; V68-V72 PolarHBondContact O-N 3.19Å; K69-V72 PolarHBondContact O-N 3.06Å; L70-V72 VanDerWaalsContact C-N 3.34Å; L70-V72 PolarHBondContact O-N 2.85Å; V72-N76 WeakPolarHBondContact CG1-ND2 3.29Å; V72-N76 WeakPolarHBondContact O-CB 3.46Å; V72-N76 PolarHBondContact O-N 3.34Å; V72-N76 PolarHBondContact O-ND2 3.25Å
73	L	90.9	Very high	92.2	Very high	18 Å²	18	60.6 Å²	60.6	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-47.5	178.1	-68.9	173.3	0	0	0	111	K69 L70 N76 N77 Q78 F79 H134 L135	K69-L73 WeakPolarHBondContact O-CG 3.38Å; K69-L73 PolarHBondContact O-N 3.17Å; L70-L73 PolarHBondContact O-N 2.9Å; L73-N76 PolarHBondContact O-N 3.46Å; L73-N77 PolarHBondContact O-N 3.49Å; L73-Q78 HydrophobicContact CB-CB 4.29Å; L73-Q78 HydrophobicContact CD2-CB 3.85Å; L73-Q78 HydrophobicContact CD2-CG 4.05Å; L73-Q78 WeakPolarHBondContact O-CB 3.36Å; L73-Q78 PolarHBondContact O-N 2.68Å; L73-F79 HydrophobicContact CB-CD2 4.37Å; L73-F79 HydrophobicContact CB-CE1 4.17Å; L73-F79 HydrophobicContact CB-CE2 3.61Å; L73-F79 HydrophobicContact CB-CZ 3.49Å; L73-F79 VanDerWaalsContact CB-CZ 3.49Å; L73-F79 HydrophobicContact CD1-CE1 4.03Å; L73-F79 HydrophobicContact CD1-CZ 3.76Å; L73-F79 HydrophobicContact CG-CZ 4.27Å; L73-H134 HydrophobicContact CD1-CB 3.71Å; L73-H134 HydrophobicContact CD2-CB 3.8Å; L73-H134 HydrophobicContact CG-CB 4.43Å; L73-L135 HydrophobicContact CD1-CD1 4.32Å; L73-L135 HydrophobicContact CD1-CD2 4.11Å; L73-L135 HydrophobicContact CD1-CG 4.05Å
74	Y	87.6	Confident	92.2	Very high	133 Å²	133	62.7 Å²	62.7	52%	0.522	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-51.5	-179.7	-171.8	-95.8	0	0	0	111.8	L70 N76 N77 F79 L84 V87	L70-Y74 WeakPolarHBondContact O-CB 3.33Å; L70-Y74 PolarHBondContact O-N 3.16Å; Y74-N76 VanDerWaalsContact C-N 3.28Å; Y74-N76 PolarHBondContact O-N 2.86Å; Y74-N77 PolarHBondContact O-N 3.35Å; Y74-N77 VanDerWaalsContact O-N 3.08Å; Y74-F79 HydrophobicContact CD2-CD2 4.33Å; Y74-L84 HydrophobicContact CD2-CD2 4.22Å; Y74-L84 HydrophobicContact CE2-CD2 3.96Å; Y74-V87 HydrophobicContact CD2-CG1 4.16Å; Y74-V87 HydrophobicContact CE2-CG1 4.35Å
75	R	86	Confident	92.4	Very high	96 Å²	96	64.2 Å²	64.2	36%	0.362	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-27.8	-177.4	-73.9	178.9	173.6	159.2	-6.7	114.3	S25 G71 N77	S25-R75 PolarHBondContact O-NH1 3.23Å; S25-R75 PolarHBondContact O-NH2 3.04Å; S25-R75 WeakPolarHBondContact OG-CD 3.44Å; S25-R75 PolarHBondContact OG-NE 2.96Å; S25-R75 PolarHBondContact OG-NH1 3.47Å; G71-R75 WeakPolarHBondContact O-CB 3.35Å; G71-R75 VanDerWaalsContact O-CG 3.32Å; G71-R75 WeakPolarHBondContact O-CG 3.32Å; G71-R75 PolarHBondContact O-N 3.28Å; R75-N77 VanDerWaalsContact C-N 3.26Å
76	N	86.7	Confident	92.6	Very high	69 Å²	69	62.1 Å²	62.1	37%	0.369	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	15.4	177.5	-66.5	-40.7	0	0	0	112.4	V72 L73 Y74 Q78	V72-N76 WeakPolarHBondContact CG1-ND2 3.29Å; V72-N76 WeakPolarHBondContact O-CB 3.46Å; V72-N76 PolarHBondContact O-N 3.34Å; V72-N76 PolarHBondContact O-ND2 3.25Å; L73-N76 PolarHBondContact O-N 3.46Å; Y74-N76 VanDerWaalsContact C-N 3.28Å; Y74-N76 PolarHBondContact O-N 2.86Å; N76-Q78 HydrophobicContact CB-CG 3.9Å; N76-Q78 PolarHBondContact O-N 2.71Å; N76-Q78 VanDerWaalsContact O-N 3.13Å; N76-Q78 PolarHBondContact O-NE2 2.92Å
77	N	90.9	Very high	92.7	Very high	144 Å²	144	62.2 Å²	62.2	77%	0.77	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	40.3	179.5	-56.2	-54.3	0	0	0	112.4	L73 Y74 R75 F79	L73-N77 PolarHBondContact O-N 3.49Å; Y74-N77 PolarHBondContact O-N 3.35Å; Y74-N77 VanDerWaalsContact O-N 3.08Å; R75-N77 VanDerWaalsContact C-N 3.26Å; N77-F79 VanDerWaalsContact C-N 3.32Å
78	Q	94.8	Very high	92.9	Very high	104 Å²	104	63.2 Å²	63.2	49%	0.486	33%	0.331	S	S	.	.			trans	-79.5	-19.6	-177.6	-63	-62.7	-69.6	0	0	112.3	L73 N76 H134	L73-Q78 HydrophobicContact CB-CB 4.29Å; L73-Q78 HydrophobicContact CD2-CB 3.85Å; L73-Q78 HydrophobicContact CD2-CG 4.05Å; L73-Q78 WeakPolarHBondContact O-CB 3.36Å; L73-Q78 PolarHBondContact O-N 2.68Å; N76-Q78 HydrophobicContact CB-CG 3.9Å; N76-Q78 PolarHBondContact O-N 2.71Å; N76-Q78 VanDerWaalsContact O-N 3.13Å; N76-Q78 PolarHBondContact O-NE2 2.92Å; Q78-H134 PolarHBondContact O-CE1 2.85Å
79	F	95.2	Very high	93.4	Very high	17 Å²	17	63.5 Å²	63.5	8%	0.075	34%	0.335	C	S	.	.	S	Bend	trans	-79.3	138.3	-179.6	-66.6	-56.4	0	0	0	112.4	L70 L73 Y74 N77 E83 L84 V87 A130 H134	L70-F79 HydrophobicContact CD1-CE2 3.95Å; L70-F79 HydrophobicContact CD1-CZ 3.65Å; L73-F79 HydrophobicContact CB-CD2 4.37Å; L73-F79 HydrophobicContact CB-CE1 4.17Å; L73-F79 HydrophobicContact CB-CE2 3.61Å; L73-F79 HydrophobicContact CB-CZ 3.49Å; L73-F79 VanDerWaalsContact CB-CZ 3.49Å; L73-F79 HydrophobicContact CD1-CE1 4.03Å; L73-F79 HydrophobicContact CD1-CZ 3.76Å; L73-F79 HydrophobicContact CG-CZ 4.27Å; Y74-F79 HydrophobicContact CD2-CD2 4.33Å; N77-F79 VanDerWaalsContact C-N 3.32Å; F79-E83 VanDerWaalsContact CA-OE2 3.27Å; F79-E83 WeakPolarHBondContact CA-OE2 3.43Å; F79-E83 HydrophobicContact CB-CB 3.86Å; F79-E83 HydrophobicContact CD1-CB 3.73Å; F79-E83 HydrophobicContact CD1-CG 4.44Å; F79-E83 HydrophobicContact CG-CB 4.17Å; F79-L84 HydrophobicContact CB-CD2 3.85Å; F79-L84 HydrophobicContact CB-CG 3.89Å; F79-L84 HydrophobicContact CD2-CD2 4.38Å; F79-V87 HydrophobicContact CD1-CG2 4.5Å; F79-V87 HydrophobicContact CD2-CG2 3.96Å; F79-V87 HydrophobicContact CE1-CG2 4.36Å; F79-V87 HydrophobicContact CE2-CG2 3.8Å; F79-V87 HydrophobicContact CG-CG2 4.31Å; F79-V87 HydrophobicContact CZ-CG2 4.01Å; F79-A130 VanDerWaalsContact CE1-O 3.3Å; F79-A130 WeakPolarHBondContact CE1-O 3.36Å; F79-H134 AromaticContact CD1-CD2 3.88Å; F79-H134 AromaticContact CD1-NE2 3.76Å; F79-H134 AromaticContact CE1-CD2 3.77Å
80	S	97.4	Very high	93.8	Very high	41 Å²	41	61.9 Å²	61.9	29%	0.287	33%	0.328	S	S	.	.			trans	-70.7	170.9	166.3	79.2	0	0	0	0	111.5	E82 E83 L84	S80-E82 VanDerWaalsContact C-N 3.31Å; S80-E82 PolarHBondContact O-N 3.34Å; S80-E82 PolarHBondContact OG-N 3.24Å; S80-E83 PolarHBondContact N-OE2 3.43Å; S80-E83 PolarHBondContact O-N 3.26Å; S80-E83 WeakPolarHBondContact OG-CG 3.33Å; S80-E83 PolarHBondContact OG-N 3.44Å; S80-L84 WeakPolarHBondContact O-CG 3.4Å; S80-L84 PolarHBondContact O-N 3.1Å
81	G	97.3	Very high	93.9	Very high	55 Å²	55	66.3 Å²	66.3	57%	0.567	34%	0.342	S	S	*	.	H	α-helix	trans	-57.8	-41.9	174.5	0	0	0	0	0	113.2	L84 V85	G81-L84 PolarHBondContact O-N 3.27Å; G81-V85 WeakPolarHBondContact O-CG2 3.31Å; G81-V85 PolarHBondContact O-N 3.47Å
82	E	97.3	Very high	94.4	Very high	154 Å²	154	72 Å²	72	72%	0.72	37%	0.365	S	S	*	.	H	α-helix	trans	-64.5	-41.1	175.9	-65.1	174.9	176.4	0	0	111.7	S80 V85 L86	S80-E82 VanDerWaalsContact C-N 3.31Å; S80-E82 PolarHBondContact O-N 3.34Å; S80-E82 PolarHBondContact OG-N 3.24Å; E82-V85 WeakPolarHBondContact O-CB 3.44Å; E82-V85 PolarHBondContact O-N 3.41Å; E82-L86 PolarHBondContact O-N 3.32Å
83	E	97.8	Very high	94.9	Very high	11 Å²	11	72.4 Å²	72.4	5%	0.051	36%	0.363	C	S	.	.	H	α-helix	trans	-69.1	-34.2	178	-67.8	169.1	156	0	0	111.8	F79 S80 V85 L86 V87 R133 H134	F79-E83 VanDerWaalsContact CA-OE2 3.27Å; F79-E83 WeakPolarHBondContact CA-OE2 3.43Å; F79-E83 HydrophobicContact CB-CB 3.86Å; F79-E83 HydrophobicContact CD1-CB 3.73Å; F79-E83 HydrophobicContact CD1-CG 4.44Å; F79-E83 HydrophobicContact CG-CB 4.17Å; S80-E83 PolarHBondContact N-OE2 3.43Å; S80-E83 PolarHBondContact O-N 3.26Å; S80-E83 WeakPolarHBondContact OG-CG 3.33Å; S80-E83 PolarHBondContact OG-N 3.44Å; E83-V85 VanDerWaalsContact C-N 3.32Å; E83-V85 PolarHBondContact O-N 2.89Å; E83-L86 WeakPolarHBondContact O-CB 3.32Å; E83-L86 PolarHBondContact O-N 3.04Å; E83-L86 VanDerWaalsContact O-N 3.17Å; E83-V87 WeakPolarHBondContact O-CG2 3.24Å; E83-V87 PolarHBondContact O-N 3.22Å; E83-R133 WeakPolarHBondContact OE1-CD 3.28Å; E83-R133 IonicContact OE1-NE 3.89Å; E83-R133 PolarHBondContact OE1-NE 3.42Å; E83-H134 IonicContact OE1-CD2 3.73Å; E83-H134 IonicContact OE1-NE2 2.65Å; E83-H134 PolarHBondContact OE1-NE2 2.77Å; E83-H134 IonicContact OE2-CD2 3.44Å; E83-H134 IonicContact OE2-CE1 3.33Å; E83-H134 IonicContact OE2-NE2 2.93Å; E83-H134 PolarHBondContact OE2-NE2 3.04Å
84	L	96.8	Very high	95.2	Very high	76 Å²	76	73.1 Å²	73.1	40%	0.398	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-35.7	173.9	-73.6	172.4	0	0	0	112.2	Y74 F79 S80 G81 L86 V87 E88	Y74-L84 HydrophobicContact CD2-CD2 4.22Å; Y74-L84 HydrophobicContact CE2-CD2 3.96Å; F79-L84 HydrophobicContact CB-CD2 3.85Å; F79-L84 HydrophobicContact CB-CG 3.89Å; F79-L84 HydrophobicContact CD2-CD2 4.38Å; S80-L84 WeakPolarHBondContact O-CG 3.4Å; S80-L84 PolarHBondContact O-N 3.1Å; G81-L84 PolarHBondContact O-N 3.27Å; L84-L86 VanDerWaalsContact C-N 3.31Å; L84-L86 PolarHBondContact O-N 3.2Å; L84-V87 PolarHBondContact O-N 3.43Å; L84-E88 WeakPolarHBondContact O-CB 3.49Å; L84-E88 PolarHBondContact O-N 3.24Å
85	V	98.1	Very high	95.6	Very high	96 Å²	96	70.6 Å²	70.6	58%	0.582	36%	0.361	S	S	*	.	H	α-helix	trans	-62.9	-39.6	172.5	173.7	0	0	0	0	111	G81 E82 E83 S89	G81-V85 WeakPolarHBondContact O-CG2 3.31Å; G81-V85 PolarHBondContact O-N 3.47Å; E82-V85 WeakPolarHBondContact O-CB 3.44Å; E82-V85 PolarHBondContact O-N 3.41Å; E83-V85 VanDerWaalsContact C-N 3.32Å; E83-V85 PolarHBondContact O-N 2.89Å; V85-S89 WeakPolarHBondContact O-CB 3.35Å; V85-S89 PolarHBondContact O-N 3.41Å; V85-S89 PolarHBondContact O-OG 3.45Å
86	L	98	Very high	96.2	Very high	39 Å²	39	68.9 Å²	68.9	20%	0.204	36%	0.361	C	S	.	.	H	α-helix	trans	-66.6	-42.1	175	-68.4	168.2	0	0	0	111.9	E82 E83 L84 S89 F90 L126 Q129 A130	E82-L86 PolarHBondContact O-N 3.32Å; E83-L86 WeakPolarHBondContact O-CB 3.32Å; E83-L86 PolarHBondContact O-N 3.04Å; E83-L86 VanDerWaalsContact O-N 3.17Å; L84-L86 VanDerWaalsContact C-N 3.31Å; L84-L86 PolarHBondContact O-N 3.2Å; L86-S89 PolarHBondContact O-N 3.22Å; L86-F90 WeakPolarHBondContact O-CB 3.17Å; L86-F90 PolarHBondContact O-N 3.39Å; L86-L126 HydrophobicContact CD2-CD2 4.28Å; L86-Q129 HydrophobicContact CD1-CB 3.79Å; L86-Q129 HydrophobicContact CD2-CB 4.16Å; L86-A130 HydrophobicContact CB-CB 4.07Å
87	V	95.6	Very high	96.8	Very high	18 Å²	18	67 Å²	67	11%	0.109	35%	0.351	C	S	.	.	H	α-helix	trans	-62.3	-43	176.3	171.5	0	0	0	0	111.1	L70 Y74 F79 E83 L84 F90 R91 A130	L70-V87 HydrophobicContact CD1-CG2 4.48Å; Y74-V87 HydrophobicContact CD2-CG1 4.16Å; Y74-V87 HydrophobicContact CE2-CG1 4.35Å; F79-V87 HydrophobicContact CD1-CG2 4.5Å; F79-V87 HydrophobicContact CD2-CG2 3.96Å; F79-V87 HydrophobicContact CE1-CG2 4.36Å; F79-V87 HydrophobicContact CE2-CG2 3.8Å; F79-V87 HydrophobicContact CG-CG2 4.31Å; F79-V87 HydrophobicContact CZ-CG2 4.01Å; E83-V87 WeakPolarHBondContact O-CG2 3.24Å; E83-V87 PolarHBondContact O-N 3.22Å; L84-V87 PolarHBondContact O-N 3.43Å; V87-F90 WeakPolarHBondContact O-CB 3.04Å; V87-F90 PolarHBondContact O-N 2.91Å; V87-R91 PolarHBondContact O-N 2.96Å; V87-A130 HydrophobicContact CG2-CB 4.06Å
88	E	96.2	Very high	97.1	Very high	73 Å²	73	60.5 Å²	60.5	34%	0.341	32%	0.318	S	S	.	.	H	α-helix	trans	-67.1	-38.5	176.9	-177.1	56.8	-156.1	0	0	111.7	L84 R91 K92	L84-E88 WeakPolarHBondContact O-CB 3.49Å; L84-E88 PolarHBondContact O-N 3.24Å; E88-R91 PolarHBondContact O-N 3.18Å; E88-K92 WeakPolarHBondContact O-CG 3.4Å; E88-K92 PolarHBondContact O-N 3.1Å; E88-K92 WeakPolarHBondContact OE1-CE 3.24Å
89	S	98.1	Very high	97.2	Very high	47 Å²	47	59.7 Å²	59.7	33%	0.329	32%	0.315	S	S	.	.	H	α-helix	trans	-64.1	-41.8	174	-59.2	0	0	0	0	111.7	V85 L86 K92 K93	V85-S89 WeakPolarHBondContact O-CB 3.35Å; V85-S89 PolarHBondContact O-N 3.41Å; V85-S89 PolarHBondContact O-OG 3.45Å; L86-S89 PolarHBondContact O-N 3.22Å; S89-K92 PolarHBondContact O-N 2.61Å; S89-K93 WeakPolarHBondContact O-CB 3.17Å; S89-K93 PolarHBondContact O-N 3.28Å
90	F	97.8	Very high	97.4	Very high	31 Å²	31	60 Å²	60	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-47.7	173.5	171.8	-104.5	0	0	0	110.9	L70 L86 V87 K92 K93 V94 C123 L126 L127 F147	L70-F90 HydrophobicContact CD2-CD1 4.23Å; L70-F90 HydrophobicContact CD2-CE1 3.85Å; L86-F90 WeakPolarHBondContact O-CB 3.17Å; L86-F90 PolarHBondContact O-N 3.39Å; V87-F90 WeakPolarHBondContact O-CB 3.04Å; V87-F90 PolarHBondContact O-N 2.91Å; F90-K92 PolarHBondContact O-N 3.29Å; F90-K93 PolarHBondContact O-N 3.28Å; F90-K93 VanDerWaalsContact O-N 3.14Å; F90-V94 HydrophobicContact CD1-CG2 4.35Å; F90-V94 HydrophobicContact CD2-CG2 4.24Å; F90-V94 HydrophobicContact CE1-CG2 3.89Å; F90-V94 HydrophobicContact CE2-CG2 3.77Å; F90-V94 HydrophobicContact CZ-CG2 3.57Å; F90-V94 WeakPolarHBondContact O-CG2 3.39Å; F90-V94 PolarHBondContact O-N 3.5Å; F90-C123 HydrophobicContact CD2-CB 4.4Å; F90-C123 WeakPolarHBondContact CD2-O 3.3Å; F90-C123 HydrophobicContact CE2-CB 4.05Å; F90-C123 WeakPolarHBondContact CE2-O 3.46Å; F90-L126 HydrophobicContact CB-CB 4.05Å; F90-L126 HydrophobicContact CD2-CB 4.29Å; F90-L127 HydrophobicContact CD2-CB 4.06Å; F90-L127 HydrophobicContact CE2-CB 3.93Å; F90-L127 HydrophobicContact CE2-CD2 4.44Å; F90-L127 HydrophobicContact CZ-CD1 4.46Å; F90-L127 HydrophobicContact CZ-CD2 4.44Å; F90-F147 HydrophobicContact CE2-CZ 4.45Å
91	R	95.6	Very high	97.4	Very high	120 Å²	120	58.9 Å²	58.9	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-57.8	-50.4	177.5	-175	-174.3	169.9	-141	-3.3	112	V87 E88 K93 V94 H95 L186	V87-R91 PolarHBondContact O-N 2.96Å; E88-R91 PolarHBondContact O-N 3.18Å; R91-K93 PolarHBondContact O-N 3.08Å; R91-V94 PolarHBondContact O-N 2.94Å; R91-V94 VanDerWaalsContact O-N 3.13Å; R91-H95 PolarHBondContact O-N 2.89Å; R91-L186 WeakPolarHBondContact CG-OXT 3.28Å; R91-L186 PolarHBondContact NE-O 3.48Å; R91-L186 PolarHBondContact NH2-O 2.67Å
92	K	97.3	Very high	97.4	Very high	127 Å²	127	56.5 Å²	56.5	55%	0.552	29%	0.286	S	S	*	.	H	α-helix	trans	-57.9	-37	176.4	-72	173.8	-179.5	172.8	0	112.4	E88 S89 F90 H95 T96	E88-K92 WeakPolarHBondContact O-CG 3.4Å; E88-K92 PolarHBondContact O-N 3.1Å; E88-K92 WeakPolarHBondContact OE1-CE 3.24Å; S89-K92 PolarHBondContact O-N 2.61Å; F90-K92 PolarHBondContact O-N 3.29Å; K92-H95 PolarHBondContact O-N 2.92Å; K92-T96 PolarHBondContact O-N 3.17Å; K92-T96 PolarHBondContact O-OG1 3.45Å
93	K	98.3	Very high	97.4	Very high	52 Å²	52	51.2 Å²	51.2	23%	0.226	27%	0.266	C	S	.	.	H	α-helix	trans	-71.2	-39.3	177.4	-166.7	58.5	52.5	164	0	112.1	S89 F90 R91 H95 T96 L97 I119 E122 C123 L126	S89-K93 WeakPolarHBondContact O-CB 3.17Å; S89-K93 PolarHBondContact O-N 3.28Å; F90-K93 PolarHBondContact O-N 3.28Å; F90-K93 VanDerWaalsContact O-N 3.14Å; R91-K93 PolarHBondContact O-N 3.08Å; K93-H95 VanDerWaalsContact C-N 3.35Å; K93-T96 WeakPolarHBondContact O-CB 3.48Å; K93-T96 PolarHBondContact O-N 3.36Å; K93-L97 WeakPolarHBondContact O-CB 3.42Å; K93-L97 PolarHBondContact O-N 2.95Å; K93-I119 HydrophobicContact CD-CG2 3.91Å; K93-I119 HydrophobicContact CG-CG2 4.3Å; K93-E122 HydrophobicContact CD-CB 4.23Å; K93-E122 WeakPolarHBondContact CD-OE2 3.43Å; K93-E122 WeakPolarHBondContact CE-OE2 3.36Å; K93-E122 HydrophobicContact CG-CB 4.18Å; K93-E122 IonicContact NZ-OE2 2.83Å; K93-E122 PolarHBondContact NZ-OE2 3.19Å; K93-C123 WeakPolarHBondContact CG-SG 3.41Å; K93-L126 HydrophobicContact CB-CD1 3.99Å; K93-L126 HydrophobicContact CG-CD1 4.35Å
94	V	97.1	Very high	97.4	Very high	32 Å²	32	52.1 Å²	52.1	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-41.5	172.1	170.1	0	0	0	0	111.3	F90 R91 T96 L97 A98 L186	F90-V94 HydrophobicContact CD1-CG2 4.35Å; F90-V94 HydrophobicContact CD2-CG2 4.24Å; F90-V94 HydrophobicContact CE1-CG2 3.89Å; F90-V94 HydrophobicContact CE2-CG2 3.77Å; F90-V94 HydrophobicContact CZ-CG2 3.57Å; F90-V94 WeakPolarHBondContact O-CG2 3.39Å; F90-V94 PolarHBondContact O-N 3.5Å; R91-V94 PolarHBondContact O-N 2.94Å; R91-V94 VanDerWaalsContact O-N 3.13Å; V94-T96 VanDerWaalsContact C-N 3.34Å; V94-T96 PolarHBondContact O-N 2.82Å; V94-L97 WeakPolarHBondContact O-CB 3.29Å; V94-L97 PolarHBondContact O-N 2.97Å; V94-A98 WeakPolarHBondContact O-CB 3.09Å; V94-A98 PolarHBondContact O-N 3.27Å; V94-L186 HydrophobicContact CG1-CD2 3.77Å
95	H	96.4	Very high	97.3	Very high	81 Å²	81	50.6 Å²	50.6	38%	0.375	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-43.3	173.2	-174.4	-72.4	0	0	0	111.8	R91 K92 K93 L97 A98 M99	R91-H95 PolarHBondContact O-N 2.89Å; K92-H95 PolarHBondContact O-N 2.92Å; K93-H95 VanDerWaalsContact C-N 3.35Å; H95-L97 VanDerWaalsContact C-N 3.33Å; H95-L97 PolarHBondContact O-N 3.4Å; H95-A98 PolarHBondContact O-N 2.91Å; H95-M99 WeakPolarHBondContact O-CG 3.29Å; H95-M99 PolarHBondContact O-N 3.2Å
96	T	98.1	Very high	97.1	Very high	60 Å²	60	51.9 Å²	51.9	37%	0.368	26%	0.26	S	S	.	.	H	α-helix	trans	-61.5	-42.3	175.3	-55.7	0	0	0	0	111.5	K92 K93 V94 T100	K92-T96 PolarHBondContact O-N 3.17Å; K92-T96 PolarHBondContact O-OG1 3.45Å; K93-T96 WeakPolarHBondContact O-CB 3.48Å; K93-T96 PolarHBondContact O-N 3.36Å; V94-T96 VanDerWaalsContact C-N 3.34Å; V94-T96 PolarHBondContact O-N 2.82Å; T96-T100 VanDerWaalsContact O-CB 3.32Å; T96-T100 WeakPolarHBondContact O-CB 3.37Å; T96-T100 PolarHBondContact O-N 3.37Å; T96-T100 PolarHBondContact O-OG1 3.43Å
97	L	98.4	Very high	96.9	Very high	29 Å²	29	54.5 Å²	54.5	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-48.4	175.9	174.6	62.9	0	0	0	111.5	K93 V94 H95 T100 A101 M116 I119 L120	K93-L97 WeakPolarHBondContact O-CB 3.42Å; K93-L97 PolarHBondContact O-N 2.95Å; V94-L97 WeakPolarHBondContact O-CB 3.29Å; V94-L97 PolarHBondContact O-N 2.97Å; H95-L97 VanDerWaalsContact C-N 3.33Å; H95-L97 PolarHBondContact O-N 3.4Å; L97-T100 PolarHBondContact O-N 2.94Å; L97-A101 WeakPolarHBondContact O-CB 3.33Å; L97-A101 PolarHBondContact O-N 3.3Å; L97-M116 HydrophobicContact CD1-SD 3.29Å; L97-M116 WeakPolarHBondContact CD1-SD 3.38Å; L97-I119 HydrophobicContact CB-CG2 3.66Å; L97-I119 HydrophobicContact CD1-CB 4.39Å; L97-I119 HydrophobicContact CD1-CG2 3.89Å; L97-I119 HydrophobicContact CG-CG2 4.34Å; L97-L120 HydrophobicContact CD1-CD2 4.01Å; L97-L120 HydrophobicContact CD1-CG 3.82Å; L97-L120 HydrophobicContact CD2-CD2 3.54Å; L97-L120 HydrophobicContact CD2-CG 4.22Å; L97-L120 HydrophobicContact CG-CD2 4.43Å
98	A	97.8	Very high	96.5	Very high	8 Å²	8	60.9 Å²	60.9	7%	0.066	30%	0.302	C	S	.	.	H	α-helix	trans	-59.2	-51	178.9	0	0	0	0	0	111.9	V94 H95 T100 A101 V102 V177 L181 L186	V94-A98 WeakPolarHBondContact O-CB 3.09Å; V94-A98 PolarHBondContact O-N 3.27Å; H95-A98 PolarHBondContact O-N 2.91Å; A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 3.29Å; A98-A101 PolarHBondContact O-N 3.21Å; A98-V102 WeakPolarHBondContact O-CG2 3.42Å; A98-V102 PolarHBondContact O-N 3.03Å; A98-V102 VanDerWaalsContact O-N 3.07Å; A98-V177 HydrophobicContact CB-CG1 3.56Å; A98-L181 HydrophobicContact CB-CD1 4.03Å; A98-L181 HydrophobicContact CB-CD2 3.95Å; A98-L181 HydrophobicContact CB-CG 4.16Å; A98-L186 HydrophobicContact CB-CD1 3.87Å
99	M	97.6	Very high	96.2	Very high	87 Å²	87	67.1 Å²	67.1	43%	0.429	33%	0.328	S	S	.	.	H	α-helix	trans	-58.6	-41.5	176.3	-70.8	-63.3	-58.5	0	0	112.2	H95 S103 L181	H95-M99 WeakPolarHBondContact O-CG 3.29Å; H95-M99 PolarHBondContact O-N 3.2Å; M99-S103 WeakPolarHBondContact O-CB 3.45Å; M99-S103 PolarHBondContact O-N 3.09Å; M99-S103 PolarHBondContact O-OG 3.47Å; M99-L181 HydrophobicContact CG-CD1 4.29Å; M99-L181 HydrophobicContact CG-CD2 4.33Å; M99-L181 HydrophobicContact SD-CD1 3.61Å; M99-L181 HydrophobicContact SD-CD2 4.23Å; M99-L181 HydrophobicContact SD-CG 4.48Å
100	T	98	Very high	96.1	Very high	24 Å²	24	67.6 Å²	67.6	15%	0.147	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-43.1	179.8	-57.5	0	0	0	0	111.2	T96 L97 A98 S103 F104 M116 I119	T96-T100 VanDerWaalsContact O-CB 3.32Å; T96-T100 WeakPolarHBondContact O-CB 3.37Å; T96-T100 PolarHBondContact O-N 3.37Å; T96-T100 PolarHBondContact O-OG1 3.43Å; L97-T100 PolarHBondContact O-N 2.94Å; A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 3.29Å; T100-S103 PolarHBondContact O-N 3.41Å; T100-F104 HydrophobicContact CG2-CD2 3.89Å; T100-F104 HydrophobicContact CG2-CE1 4.2Å; T100-F104 HydrophobicContact CG2-CE2 3.49Å; T100-F104 VanDerWaalsContact CG2-CE2 3.49Å; T100-F104 HydrophobicContact CG2-CG 4.39Å; T100-F104 HydrophobicContact CG2-CZ 3.67Å; T100-F104 WeakPolarHBondContact O-CB 3.39Å; T100-F104 WeakPolarHBondContact O-CG 3.18Å; T100-F104 PolarHBondContact O-N 3.01Å; T100-M116 HydrophobicContact CG2-CE 4.17Å; T100-I119 HydrophobicContact CG2-CD1 3.97Å
101	A	97.4	Very high	96.1	Very high	17 Å²	17	68.9 Å²	68.9	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-46.9	178.3	0	0	0	0	0	111.7	L97 A98 H105 M116 Y160	L97-A101 WeakPolarHBondContact O-CB 3.33Å; L97-A101 PolarHBondContact O-N 3.3Å; A98-A101 PolarHBondContact O-N 3.21Å; A101-H105 PolarHBondContact O-N 2.73Å; A101-M116 VanDerWaalsContact CA-CE 3.42Å; A101-M116 HydrophobicContact CB-CE 3.71Å; A101-Y160 VanDerWaalsContact CA-OH 3.26Å; A101-Y160 WeakPolarHBondContact CA-OH 3.43Å; A101-Y160 WeakPolarHBondContact CB-OH 3.32Å; A101-Y160 PolarHBondContact O-OH 3.31Å; A101-Y160 VanDerWaalsContact O-OH 3.11Å
102	V	97.5	Very high	96.2	Very high	4 Å²	4	66.3 Å²	66.3	2%	0.024	33%	0.33	C	S	.	.	H	α-helix	trans	-61.4	-48	175	170	0	0	0	0	111.1	A98 F104 H105 Q106 C174 V177 N178	A98-V102 WeakPolarHBondContact O-CG2 3.42Å; A98-V102 PolarHBondContact O-N 3.03Å; A98-V102 VanDerWaalsContact O-N 3.07Å; V102-F104 VanDerWaalsContact C-N 3.33Å; V102-F104 PolarHBondContact O-N 2.9Å; V102-H105 PolarHBondContact O-N 3.37Å; V102-H105 VanDerWaalsContact O-N 3.09Å; V102-Q106 HydrophobicContact CG1-CG 4.04Å; V102-Q106 WeakPolarHBondContact O-CG 3.37Å; V102-Q106 PolarHBondContact O-N 2.94Å; V102-C174 HydrophobicContact CG2-CB 4.31Å; V102-V177 HydrophobicContact CG2-CB 4.32Å; V102-V177 HydrophobicContact CG2-CG1 3.92Å; V102-N178 WeakPolarHBondContact CG1-ND2 3.46Å; V102-N178 VanDerWaalsContact CG1-OD1 3.27Å; V102-N178 WeakPolarHBondContact CG1-OD1 3.28Å; V102-N178 WeakPolarHBondContact CG2-OD1 3.44Å
103	S	97.3	Very high	96.2	Very high	43 Å²	43	64.7 Å²	64.7	30%	0.301	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-41.3	-176.5	-59.9	0	0	0	0	112	M99 T100 H105 Q106 I107	M99-S103 WeakPolarHBondContact O-CB 3.45Å; M99-S103 PolarHBondContact O-N 3.09Å; M99-S103 PolarHBondContact O-OG 3.47Å; T100-S103 PolarHBondContact O-N 3.41Å; S103-H105 PolarHBondContact O-N 3.45Å; S103-Q106 PolarHBondContact O-N 3.31Å; S103-I107 WeakPolarHBondContact O-CB 3.47Å; S103-I107 WeakPolarHBondContact O-CG1 3.26Å; S103-I107 PolarHBondContact O-N 3.07Å
104	F	97.5	Very high	96.2	Very high	31 Å²	31	71.1 Å²	71.1	14%	0.136	34%	0.343	C	S	.	.	H	α-helix	trans	-66.1	-24.7	176.7	-74.1	-15.4	0	0	0	114	T100 V102 T110 F111 D112 V115 M116 Y160	T100-F104 HydrophobicContact CG2-CD2 3.89Å; T100-F104 HydrophobicContact CG2-CE1 4.2Å; T100-F104 HydrophobicContact CG2-CE2 3.49Å; T100-F104 VanDerWaalsContact CG2-CE2 3.49Å; T100-F104 HydrophobicContact CG2-CG 4.39Å; T100-F104 HydrophobicContact CG2-CZ 3.67Å; T100-F104 WeakPolarHBondContact O-CB 3.39Å; T100-F104 WeakPolarHBondContact O-CG 3.18Å; T100-F104 PolarHBondContact O-N 3.01Å; V102-F104 VanDerWaalsContact C-N 3.33Å; V102-F104 PolarHBondContact O-N 2.9Å; F104-T110 WeakPolarHBondContact CD1-O 3.4Å; F104-T110 WeakPolarHBondContact CE1-O 3.41Å; F104-F111 HydrophobicContact CB-CB 4.23Å; F104-F111 HydrophobicContact CB-CD2 4.1Å; F104-F111 AromaticContact CD2-CD2 3.67Å; F104-F111 HydrophobicContact CD2-CD2 3.67Å; F104-F111 HydrophobicContact CD2-CE2 4.33Å; F104-F111 HydrophobicContact CE2-CD2 4.33Å; F104-F111 HydrophobicContact CG-CB 4.39Å; F104-F111 HydrophobicContact CG-CD2 4.11Å; F104-D112 HydrophobicContact CZ-CB 4.28Å; F104-V115 HydrophobicContact CE2-CB 4.48Å; F104-V115 HydrophobicContact CE2-CG1 4.45Å; F104-V115 HydrophobicContact CZ-CB 4.14Å; F104-V115 HydrophobicContact CZ-CG1 4Å; F104-M116 HydrophobicContact CD2-CE 3.74Å; F104-M116 HydrophobicContact CE2-CB 4.26Å; F104-M116 HydrophobicContact CE2-CE 4.16Å; F104-Y160 HydrophobicContact CB-CD1 4.08Å; F104-Y160 HydrophobicContact CB-CE1 3.6Å
105	H	96	Very high	96.3	Very high	44 Å²	44	72.5 Å²	72.5	20%	0.204	35%	0.352	C	S	.	.	H	α-helix	trans	-83.5	-41	173.8	176.7	62.3	0	0	0	112.1	A101 V102 S103 Y160 L170 Q171 C174	A101-H105 PolarHBondContact O-N 2.73Å; V102-H105 PolarHBondContact O-N 3.37Å; V102-H105 VanDerWaalsContact O-N 3.09Å; S103-H105 PolarHBondContact O-N 3.45Å; H105-Y160 HydrophobicContact CB-CE1 4.26Å; H105-L170 HydrophobicContact CB-CD2 4.34Å; H105-L170 HydrophobicContact CB-CG 4.39Å; H105-Q171 PolarHBondContact NE2-OE1 3.23Å; H105-C174 HydrophobicContact CB-CB 4.45Å; H105-C174 WeakPolarHBondContact CB-SG 3.39Å
106	Q	93.6	Very high	96.4	Very high	122 Å²	122	69 Å²	69	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-78.3	-27.9	-175.1	-70.6	-179.2	-12.3	0	0	113.8	V102 S103 N178	V102-Q106 HydrophobicContact CG1-CG 4.04Å; V102-Q106 WeakPolarHBondContact O-CG 3.37Å; V102-Q106 PolarHBondContact O-N 2.94Å; S103-Q106 PolarHBondContact O-N 3.31Å; Q106-N178 PolarHBondContact NE2-ND2 3.29Å; Q106-N178 VanDerWaalsContact NE2-ND2 3.18Å
107	I	94.4	Very high	96.4	Very high	94 Å²	94	66.9 Å²	66.9	48%	0.482	32%	0.324	S	S	.	.	S	Bend	trans	-110.2	110.7	-176.3	-47.1	174	0	0	0	109.3	S103 T110	S103-I107 WeakPolarHBondContact O-CB 3.47Å; S103-I107 WeakPolarHBondContact O-CG1 3.26Å; S103-I107 PolarHBondContact O-N 3.07Å; I107-T110 HydrophobicContact CB-CG2 3.79Å; I107-T110 HydrophobicContact CG2-CG2 3.41Å; I107-T110 VanDerWaalsContact CG2-CG2 3.41Å; I107-T110 PolarHBondContact O-N 3.26Å; I107-T110 PolarHBondContact O-OG1 2.95Å
108	E	87.4	Confident	96.4	Very high	152 Å²	152	67.7 Å²	67.7	71%	0.71	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	143.6	-178.9	-61.9	-170.7	160.9	0	0	112.3	T110	E108-T110 PolarHBondContact O-N 3.29Å; E108-T110 VanDerWaalsContact O-N 3.12Å
109	F	89.4	Confident	96.5	Very high	205 Å²	205	68.1 Å²	68.1	90%	0.899	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	14.3	176.4	-46.4	-74.5	0	0	0	116.1
110	T	94.8	Very high	96.5	Very high	56 Å²	56	64.7 Å²	64.7	34%	0.344	32%	0.319	S	S	.	.			trans	-96	-14.4	177.7	62.8	0	0	0	0	114.7	F104 I107 E108 D112	F104-T110 WeakPolarHBondContact CD1-O 3.4Å; F104-T110 WeakPolarHBondContact CE1-O 3.41Å; I107-T110 HydrophobicContact CB-CG2 3.79Å; I107-T110 HydrophobicContact CG2-CG2 3.41Å; I107-T110 VanDerWaalsContact CG2-CG2 3.41Å; I107-T110 PolarHBondContact O-N 3.26Å; I107-T110 PolarHBondContact O-OG1 2.95Å; E108-T110 PolarHBondContact O-N 3.29Å; E108-T110 VanDerWaalsContact O-N 3.12Å; T110-D112 PolarHBondContact O-N 2.89Å
111	F	97.6	Very high	96.6	Very high	58 Å²	58	65.8 Å²	65.8	25%	0.254	32%	0.324	S	S	.	.			trans	-60.2	122.9	-175.9	170.7	-109.2	0	0	0	112.6	F104 R113 L156 Y160	F104-F111 HydrophobicContact CB-CB 4.23Å; F104-F111 HydrophobicContact CB-CD2 4.1Å; F104-F111 AromaticContact CD2-CD2 3.67Å; F104-F111 HydrophobicContact CD2-CD2 3.67Å; F104-F111 HydrophobicContact CD2-CE2 4.33Å; F104-F111 HydrophobicContact CE2-CD2 4.33Å; F104-F111 HydrophobicContact CG-CB 4.39Å; F104-F111 HydrophobicContact CG-CD2 4.11Å; F111-R113 HydrophobicContact CE1-CB 3.92Å; F111-R113 HydrophobicContact CE2-CB 4.46Å; F111-R113 HydrophobicContact CZ-CB 3.59Å; F111-L156 HydrophobicContact CZ-CB 4.01Å; F111-L156 VanDerWaalsContact CZ-O 3.27Å; F111-L156 WeakPolarHBondContact CZ-O 3.43Å; F111-Y160 HydrophobicContact CB-CD1 4.33Å; F111-Y160 HydrophobicContact CD1-CG 4.3Å; F111-Y160 AromaticContact CD2-CD1 3.57Å; F111-Y160 HydrophobicContact CD2-CD1 3.57Å; F111-Y160 AromaticContact CD2-CD2 3.73Å; F111-Y160 HydrophobicContact CD2-CD2 3.73Å; F111-Y160 HydrophobicContact CD2-CE1 4.12Å; F111-Y160 HydrophobicContact CD2-CE2 4.27Å; F111-Y160 AromaticContact CD2-CG 3.35Å; F111-Y160 HydrophobicContact CD2-CG 3.35Å; F111-Y160 HydrophobicContact CE1-CG 4.36Å; F111-Y160 HydrophobicContact CE2-CD1 4.09Å; F111-Y160 AromaticContact CE2-CD2 3.33Å; F111-Y160 HydrophobicContact CE2-CD2 3.33Å; F111-Y160 AromaticContact CE2-CE2 3.91Å; F111-Y160 HydrophobicContact CE2-CE2 3.91Å; F111-Y160 AromaticContact CE2-CG 3.44Å; F111-Y160 HydrophobicContact CE2-CG 3.44Å; F111-Y160 VanDerWaalsContact CE2-CG 3.44Å; F111-Y160 HydrophobicContact CG-CD1 4.01Å; F111-Y160 AromaticContact CG-CG 3.81Å; F111-Y160 HydrophobicContact CG-CG 3.81Å; F111-Y160 AromaticContact CZ-CD2 3.85Å; F111-Y160 HydrophobicContact CZ-CD2 3.85Å; F111-Y160 AromaticContact CZ-CG 3.96Å; F111-Y160 HydrophobicContact CZ-CG 3.96Å
112	D	98.1	Very high	96.6	Very high	67 Å²	67	69.1 Å²	69.1	36%	0.358	34%	0.336	S	S	.	.			trans	-124.6	108.9	169.8	-172.2	-27.1	0	0	0	110.7	F104 T110 R114 V115 M116	F104-D112 HydrophobicContact CZ-CB 4.28Å; T110-D112 PolarHBondContact O-N 2.89Å; D112-R114 PolarHBondContact O-N 3.25Å; D112-R114 WeakPolarHBondContact OD1-CA 3.05Å; D112-R114 VanDerWaalsContact OD1-CB 3.32Å; D112-R114 WeakPolarHBondContact OD1-CB 3.22Å; D112-R114 PolarHBondContact OD1-N 2.95Å; D112-V115 HydrophobicContact CB-CB 4.05Å; D112-V115 HydrophobicContact CB-CG2 3.84Å; D112-V115 PolarHBondContact O-N 3.04Å; D112-V115 PolarHBondContact OD1-N 3.07Å; D112-M116 PolarHBondContact O-N 3.26Å; D112-M116 VanDerWaalsContact O-N 3.1Å
113	R	98.1	Very high	96.7	Very high	93 Å²	93	68.9 Å²	68.9	35%	0.351	34%	0.335	S	S	.	.	H	α-helix	trans	-57.9	-32.5	177.7	64.7	-174.7	-178.1	156.4	-2.8	113.8	F111 S117 C153 D154 L156	F111-R113 HydrophobicContact CE1-CB 3.92Å; F111-R113 HydrophobicContact CE2-CB 4.46Å; F111-R113 HydrophobicContact CZ-CB 3.59Å; R113-S117 WeakPolarHBondContact O-CB 3.27Å; R113-S117 PolarHBondContact O-N 2.94Å; R113-C153 WeakPolarHBondContact CD-O 3.4Å; R113-C153 HydrophobicContact CG-CB 4.31Å; R113-C153 PolarHBondContact NH1-O 3.06Å; R113-D154 IonicContact NH1-OD1 2.64Å; R113-D154 PolarHBondContact NH1-OD1 2.98Å; R113-L156 HydrophobicContact CB-CB 4.13Å
114	R	98.4	Very high	96.8	Very high	186 Å²	186	69.2 Å²	69.2	70%	0.702	33%	0.33	S	S	*	.	H	α-helix	trans	-74.1	-39.6	-179.5	-63.6	-179.3	174.5	179.2	-0.2	110.9	D112 S117 A118	D112-R114 PolarHBondContact O-N 3.25Å; D112-R114 WeakPolarHBondContact OD1-CA 3.05Å; D112-R114 VanDerWaalsContact OD1-CB 3.32Å; D112-R114 WeakPolarHBondContact OD1-CB 3.22Å; D112-R114 PolarHBondContact OD1-N 2.95Å; R114-S117 PolarHBondContact O-N 2.88Å; R114-A118 VanDerWaalsContact O-CB 3.3Å; R114-A118 WeakPolarHBondContact O-CB 3.19Å; R114-A118 PolarHBondContact O-N 3.21Å
115	V	98.5	Very high	96.8	Very high	62 Å²	62	71.5 Å²	71.5	38%	0.376	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-49.6	174.1	173.3	0	0	0	0	110.1	F104 D112 S117 A118 I119	F104-V115 HydrophobicContact CE2-CB 4.48Å; F104-V115 HydrophobicContact CE2-CG1 4.45Å; F104-V115 HydrophobicContact CZ-CB 4.14Å; F104-V115 HydrophobicContact CZ-CG1 4Å; D112-V115 HydrophobicContact CB-CB 4.05Å; D112-V115 HydrophobicContact CB-CG2 3.84Å; D112-V115 PolarHBondContact O-N 3.04Å; D112-V115 PolarHBondContact OD1-N 3.07Å; V115-S117 PolarHBondContact O-N 3.18Å; V115-A118 PolarHBondContact O-N 3.21Å; V115-I119 HydrophobicContact CG1-CD1 4.01Å; V115-I119 WeakPolarHBondContact O-CG1 3.38Å; V115-I119 PolarHBondContact O-N 2.82Å; V115-I119 VanDerWaalsContact O-N 3.08Å
116	M	98.4	Very high	97	Very high	6 Å²	6	70.9 Å²	70.9	3%	0.03	34%	0.339	C	S	.	.	H	α-helix	trans	-60.2	-47	178	-175.9	61.7	76.5	0	0	112.1	L97 T100 A101 F104 D112 A118 I119 L120 L156	L97-M116 HydrophobicContact CD1-SD 3.29Å; L97-M116 WeakPolarHBondContact CD1-SD 3.38Å; T100-M116 HydrophobicContact CG2-CE 4.17Å; A101-M116 VanDerWaalsContact CA-CE 3.42Å; A101-M116 HydrophobicContact CB-CE 3.71Å; F104-M116 HydrophobicContact CD2-CE 3.74Å; F104-M116 HydrophobicContact CE2-CB 4.26Å; F104-M116 HydrophobicContact CE2-CE 4.16Å; D112-M116 PolarHBondContact O-N 3.26Å; D112-M116 VanDerWaalsContact O-N 3.1Å; M116-A118 VanDerWaalsContact C-N 3.33Å; M116-A118 PolarHBondContact O-N 3.42Å; M116-I119 PolarHBondContact O-N 3.43Å; M116-L120 HydrophobicContact CG-CD1 4.02Å; M116-L120 WeakPolarHBondContact O-CG 3.36Å; M116-L120 PolarHBondContact O-N 2.99Å; M116-L120 HydrophobicContact SD-CD1 4.42Å; M116-L156 HydrophobicContact CB-CD1 3.99Å; M116-L156 HydrophobicContact CB-CD2 4.49Å; M116-L156 HydrophobicContact CG-CD1 3.84Å; M116-L156 HydrophobicContact CG-CD2 3.63Å; M116-L156 HydrophobicContact CG-CG 4.36Å
117	S	98.8	Very high	97.2	Very high	17 Å²	17	65.4 Å²	65.4	12%	0.119	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-41.3	177.2	-176.5	0	0	0	0	112.1	R113 R114 V115 L120 N121 A151	R113-S117 WeakPolarHBondContact O-CB 3.27Å; R113-S117 PolarHBondContact O-N 2.94Å; R114-S117 PolarHBondContact O-N 2.88Å; V115-S117 PolarHBondContact O-N 3.18Å; S117-L120 PolarHBondContact O-N 3.21Å; S117-N121 PolarHBondContact O-N 3.28Å; S117-N121 PolarHBondContact O-ND2 2.96Å; S117-N121 PolarHBondContact OG-ND2 3.49Å; S117-A151 WeakPolarHBondContact CB-O 3.37Å; S117-A151 PolarHBondContact OG-O 3.14Å
118	A	98.8	Very high	97.4	Very high	46 Å²	46	62 Å²	62	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-62.4	-48	177.5	0	0	0	0	0	111.7	R114 V115 M116 L120 N121 E122	R114-A118 VanDerWaalsContact O-CB 3.3Å; R114-A118 WeakPolarHBondContact O-CB 3.19Å; R114-A118 PolarHBondContact O-N 3.21Å; V115-A118 PolarHBondContact O-N 3.21Å; M116-A118 VanDerWaalsContact C-N 3.33Å; M116-A118 PolarHBondContact O-N 3.42Å; A118-L120 VanDerWaalsContact C-N 3.32Å; A118-L120 PolarHBondContact O-N 3.32Å; A118-N121 PolarHBondContact O-N 3.28Å; A118-N121 VanDerWaalsContact O-N 3.16Å; A118-E122 WeakPolarHBondContact O-CG 3.44Å; A118-E122 PolarHBondContact O-N 3.35Å
119	I	98.7	Very high	97.9	Very high	17 Å²	17	59.5 Å²	59.5	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-43.3	178.2	-63.5	166.7	0	0	0	111	K93 L97 T100 V115 M116 N121 E122 C123	K93-I119 HydrophobicContact CD-CG2 3.91Å; K93-I119 HydrophobicContact CG-CG2 4.3Å; L97-I119 HydrophobicContact CB-CG2 3.66Å; L97-I119 HydrophobicContact CD1-CB 4.39Å; L97-I119 HydrophobicContact CD1-CG2 3.89Å; L97-I119 HydrophobicContact CG-CG2 4.34Å; T100-I119 HydrophobicContact CG2-CD1 3.97Å; V115-I119 HydrophobicContact CG1-CD1 4.01Å; V115-I119 WeakPolarHBondContact O-CG1 3.38Å; V115-I119 PolarHBondContact O-N 2.82Å; V115-I119 VanDerWaalsContact O-N 3.08Å; M116-I119 PolarHBondContact O-N 3.43Å; I119-N121 PolarHBondContact O-N 3.12Å; I119-E122 PolarHBondContact O-N 2.94Å; I119-C123 PolarHBondContact O-N 3.42Å
120	L	98.8	Very high	98.3	Very high	15 Å²	15	49.8 Å²	49.8	8%	0.079	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-40.7	176.5	-77.6	161	0	0	0	112.4	L97 M116 S117 A118 C123 R124 F147 F150 A151 L156	L97-L120 HydrophobicContact CD1-CD2 4.01Å; L97-L120 HydrophobicContact CD1-CG 3.82Å; L97-L120 HydrophobicContact CD2-CD2 3.54Å; L97-L120 HydrophobicContact CD2-CG 4.22Å; L97-L120 HydrophobicContact CG-CD2 4.43Å; M116-L120 HydrophobicContact CG-CD1 4.02Å; M116-L120 WeakPolarHBondContact O-CG 3.36Å; M116-L120 PolarHBondContact O-N 2.99Å; M116-L120 HydrophobicContact SD-CD1 4.42Å; S117-L120 PolarHBondContact O-N 3.21Å; A118-L120 VanDerWaalsContact C-N 3.32Å; A118-L120 PolarHBondContact O-N 3.32Å; L120-C123 WeakPolarHBondContact O-CB 3.46Å; L120-C123 PolarHBondContact O-N 3.31Å; L120-R124 PolarHBondContact O-N 3.35Å; L120-F147 HydrophobicContact CB-CD1 4.34Å; L120-F147 HydrophobicContact CD2-CD1 4.17Å; L120-F147 HydrophobicContact CD2-CE1 4.19Å; L120-F147 WeakPolarHBondContact O-CD1 3.33Å; L120-F147 WeakPolarHBondContact O-CE1 3.26Å; L120-F150 HydrophobicContact CD1-CB 4.34Å; L120-F150 WeakPolarHBondContact CD1-O 3.37Å; L120-F150 HydrophobicContact CD2-CB 4.35Å; L120-A151 HydrophobicContact CB-CB 3.76Å; L120-A151 HydrophobicContact CD1-CB 4.19Å; L120-L156 HydrophobicContact CD1-CD1 4.46Å; L120-L156 HydrophobicContact CD1-CD2 4.5Å
121	N	98.8	Very high	98.4	Very high	47 Å²	47	47.3 Å²	47.3	25%	0.251	23%	0.226	S	C	.	.	H	α-helix	trans	-67.6	-36.8	175.6	-77.1	-62.1	0	0	0	111.9	S117 A118 I119 R124 E125	S117-N121 PolarHBondContact O-N 3.28Å; S117-N121 PolarHBondContact O-ND2 2.96Å; S117-N121 PolarHBondContact OG-ND2 3.49Å; A118-N121 PolarHBondContact O-N 3.28Å; A118-N121 VanDerWaalsContact O-N 3.16Å; I119-N121 PolarHBondContact O-N 3.12Å; N121-R124 VanDerWaalsContact O-CB 3.27Å; N121-R124 WeakPolarHBondContact O-CB 3.26Å; N121-R124 PolarHBondContact O-N 3.06Å; N121-R124 VanDerWaalsContact O-N 3.14Å; N121-R124 PolarHBondContact OD1-NH1 3.42Å; N121-E125 WeakPolarHBondContact O-CG 3.48Å; N121-E125 PolarHBondContact O-N 2.93Å
122	E	98.8	Very high	98.4	Very high	86 Å²	86	49.7 Å²	49.7	40%	0.402	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-43.2	172.4	-72.1	176.3	-156.5	0	0	111.9	K93 A118 I119 R124 E125 L126	K93-E122 HydrophobicContact CD-CB 4.23Å; K93-E122 WeakPolarHBondContact CD-OE2 3.43Å; K93-E122 WeakPolarHBondContact CE-OE2 3.36Å; K93-E122 HydrophobicContact CG-CB 4.18Å; K93-E122 IonicContact NZ-OE2 2.83Å; K93-E122 PolarHBondContact NZ-OE2 3.19Å; A118-E122 WeakPolarHBondContact O-CG 3.44Å; A118-E122 PolarHBondContact O-N 3.35Å; I119-E122 PolarHBondContact O-N 2.94Å; E122-R124 VanDerWaalsContact C-N 3.27Å; E122-R124 PolarHBondContact O-N 2.84Å; E122-E125 PolarHBondContact O-N 2.8Å; E122-L126 WeakPolarHBondContact O-CB 3.29Å; E122-L126 WeakPolarHBondContact O-CG 3.42Å; E122-L126 PolarHBondContact O-N 3.18Å
123	C	98.7	Very high	98.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-55.6	-43.4	170.7	-78.2	0	0	0	0	111.6	F90 K93 I119 L120 L127 F147	F90-C123 HydrophobicContact CD2-CB 4.4Å; F90-C123 WeakPolarHBondContact CD2-O 3.3Å; F90-C123 HydrophobicContact CE2-CB 4.05Å; F90-C123 WeakPolarHBondContact CE2-O 3.46Å; K93-C123 WeakPolarHBondContact CG-SG 3.41Å; I119-C123 PolarHBondContact O-N 3.42Å; L120-C123 WeakPolarHBondContact O-CB 3.46Å; L120-C123 PolarHBondContact O-N 3.31Å; C123-L127 VanDerWaalsContact O-CB 3.31Å; C123-L127 WeakPolarHBondContact O-CB 3.4Å; C123-L127 PolarHBondContact O-N 3.23Å; C123-F147 HydrophobicContact CB-CD1 4.45Å; C123-F147 HydrophobicContact CB-CE1 3.49Å; C123-F147 VanDerWaalsContact CB-CE1 3.49Å; C123-F147 HydrophobicContact CB-CZ 3.81Å
124	R	98.8	Very high	98.2	Very high	50 Å²	50	53.7 Å²	53.7	19%	0.189	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-49.7	178.5	-167.7	-173.5	70.4	-166	-7.3	111.7	L120 N121 E122 L127 H128 V143 N144 F147 N148	L120-R124 PolarHBondContact O-N 3.35Å; N121-R124 VanDerWaalsContact O-CB 3.27Å; N121-R124 WeakPolarHBondContact O-CB 3.26Å; N121-R124 PolarHBondContact O-N 3.06Å; N121-R124 VanDerWaalsContact O-N 3.14Å; N121-R124 PolarHBondContact OD1-NH1 3.42Å; E122-R124 VanDerWaalsContact C-N 3.27Å; E122-R124 PolarHBondContact O-N 2.84Å; R124-L127 PolarHBondContact O-N 3.07Å; R124-H128 PolarHBondContact O-CD2 3.41Å; R124-H128 PolarHBondContact O-N 2.94Å; R124-V143 HydrophobicContact CG-CG1 3.73Å; R124-N144 WeakPolarHBondContact CD-OD1 3.19Å; R124-F147 HydrophobicContact CB-CB 3.8Å; R124-F147 HydrophobicContact CB-CD1 4.02Å; R124-F147 HydrophobicContact CB-CD2 3.87Å; R124-F147 HydrophobicContact CB-CE2 4.43Å; R124-F147 HydrophobicContact CB-CG 3.62Å; R124-F147 HydrophobicContact CG-CB 3.66Å; R124-F147 HydrophobicContact CG-CD2 3.8Å; R124-F147 HydrophobicContact CG-CG 3.81Å; R124-N148 PolarHBondContact NH1-OD1 3.04Å
125	E	98.8	Very high	98.1	Very high	78 Å²	78	46.3 Å²	46.3	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-67.8	-42.7	-177.2	-63.3	-45	130.1	0	0	112.2	N121 E122 L127 H128 Q129	N121-E125 WeakPolarHBondContact O-CG 3.48Å; N121-E125 PolarHBondContact O-N 2.93Å; E122-E125 PolarHBondContact O-N 2.8Å; E125-L127 VanDerWaalsContact C-N 3.3Å; E125-L127 PolarHBondContact O-N 2.94Å; E125-H128 PolarHBondContact O-N 2.9Å; E125-Q129 WeakPolarHBondContact O-CG 3.49Å; E125-Q129 PolarHBondContact O-N 2.83Å; E125-Q129 PolarHBondContact O-NE2 3.34Å
126	L	98.6	Very high	98.1	Very high	31 Å²	31	47.5 Å²	47.5	16%	0.162	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-43.5	174.7	-73.3	168.4	0	0	0	111.2	L86 F90 K93 E122 Q129 A130	L86-L126 HydrophobicContact CD2-CD2 4.28Å; F90-L126 HydrophobicContact CB-CB 4.05Å; F90-L126 HydrophobicContact CD2-CB 4.29Å; K93-L126 HydrophobicContact CB-CD1 3.99Å; K93-L126 HydrophobicContact CG-CD1 4.35Å; E122-L126 WeakPolarHBondContact O-CB 3.29Å; E122-L126 WeakPolarHBondContact O-CG 3.42Å; E122-L126 PolarHBondContact O-N 3.18Å; L126-Q129 PolarHBondContact O-N 3.07Å; L126-A130 WeakPolarHBondContact O-CB 3.08Å; L126-A130 PolarHBondContact O-N 3.18Å
127	L	98	Very high	98.1	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-41.2	178	-175.8	59.9	0	0	0	111.8	M66 L70 F90 C123 R124 E125 Q129 A130 I131 V143 F147	M66-L127 HydrophobicContact CE-CD2 3.66Å; L70-L127 HydrophobicContact CD1-CD1 4.39Å; L70-L127 HydrophobicContact CD2-CD1 4.06Å; F90-L127 HydrophobicContact CD2-CB 4.06Å; F90-L127 HydrophobicContact CE2-CB 3.93Å; F90-L127 HydrophobicContact CE2-CD2 4.44Å; F90-L127 HydrophobicContact CZ-CD1 4.46Å; F90-L127 HydrophobicContact CZ-CD2 4.44Å; C123-L127 VanDerWaalsContact O-CB 3.31Å; C123-L127 WeakPolarHBondContact O-CB 3.4Å; C123-L127 PolarHBondContact O-N 3.23Å; R124-L127 PolarHBondContact O-N 3.07Å; E125-L127 VanDerWaalsContact C-N 3.3Å; E125-L127 PolarHBondContact O-N 2.94Å; L127-Q129 VanDerWaalsContact C-N 3.34Å; L127-Q129 PolarHBondContact O-N 2.71Å; L127-A130 PolarHBondContact O-N 3.35Å; L127-I131 HydrophobicContact CD1-CG2 3.89Å; L127-I131 HydrophobicContact CG-CD1 4.5Å; L127-I131 VanDerWaalsContact O-CG1 3.25Å; L127-I131 WeakPolarHBondContact O-CG1 3.32Å; L127-I131 WeakPolarHBondContact O-CG2 3.49Å; L127-I131 PolarHBondContact O-N 3.36Å; L127-I131 VanDerWaalsContact O-N 3.1Å; L127-V143 HydrophobicContact CD2-CG1 4.13Å; L127-V143 HydrophobicContact CD2-CG2 3.86Å; L127-V143 HydrophobicContact CG-CG2 4.29Å; L127-F147 HydrophobicContact CD2-CE2 4.01Å
128	H	98.6	Very high	98.1	Very high	21 Å²	21	57.1 Å²	57.1	10%	0.097	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-44.9	175	-84.6	-47.7	0	0	0	112.5	R124 E125 N132 H140 V143 N144	R124-H128 PolarHBondContact O-CD2 3.41Å; R124-H128 PolarHBondContact O-N 2.94Å; E125-H128 PolarHBondContact O-N 2.9Å; H128-N132 WeakPolarHBondContact O-CB 3.22Å; H128-N132 PolarHBondContact O-N 3.47Å; H128-H140 AromaticContact CE1-CG 3.91Å; H128-H140 AromaticContact CE1-ND1 3.55Å; H128-H140 PolarHBondContact CE1-O 3.45Å; H128-H140 AromaticContact CG-ND1 3.84Å; H128-H140 AromaticContact ND1-CE1 3.66Å; H128-H140 AromaticContact ND1-CG 3.59Å; H128-H140 AromaticContact ND1-ND1 2.88Å; H128-H140 PolarHBondContact ND1-ND1 3.23Å; H128-H140 PolarHBondContact O-CE1 3.12Å; H128-V143 WeakPolarHBondContact NE2-CG1 3.28Å; H128-N144 PolarHBondContact NE2-OD1 3.42Å
129	Q	98.4	Very high	98	Very high	100 Å²	100	55.1 Å²	55.1	47%	0.467	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-47.5	178	-68	172	52.3	0	0	111.1	L86 E125 L126 L127 I131 N132	L86-Q129 HydrophobicContact CD1-CB 3.79Å; L86-Q129 HydrophobicContact CD2-CB 4.16Å; E125-Q129 WeakPolarHBondContact O-CG 3.49Å; E125-Q129 PolarHBondContact O-N 2.83Å; E125-Q129 PolarHBondContact O-NE2 3.34Å; L126-Q129 PolarHBondContact O-N 3.07Å; L127-Q129 VanDerWaalsContact C-N 3.34Å; L127-Q129 PolarHBondContact O-N 2.71Å; Q129-I131 VanDerWaalsContact C-N 3.31Å; Q129-I131 PolarHBondContact O-N 3.43Å; Q129-N132 WeakPolarHBondContact O-CB 3.32Å; Q129-N132 PolarHBondContact O-N 2.95Å
130	A	97.3	Very high	98	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-38.3	-178.5	0	0	0	0	0	113	F79 L86 V87 L126 L127	F79-A130 VanDerWaalsContact CE1-O 3.3Å; F79-A130 WeakPolarHBondContact CE1-O 3.36Å; L86-A130 HydrophobicContact CB-CB 4.07Å; V87-A130 HydrophobicContact CG2-CB 4.06Å; L126-A130 WeakPolarHBondContact O-CB 3.08Å; L126-A130 PolarHBondContact O-N 3.18Å; L127-A130 PolarHBondContact O-N 3.35Å
131	I	97.1	Very high	98	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-94.2	-4.7	-175	73.8	-174.7	0	0	0	114.5	L127 Q129 R133 H134 L135 V143	L127-I131 HydrophobicContact CD1-CG2 3.89Å; L127-I131 HydrophobicContact CG-CD1 4.5Å; L127-I131 VanDerWaalsContact O-CG1 3.25Å; L127-I131 WeakPolarHBondContact O-CG1 3.32Å; L127-I131 WeakPolarHBondContact O-CG2 3.49Å; L127-I131 PolarHBondContact O-N 3.36Å; L127-I131 VanDerWaalsContact O-N 3.1Å; Q129-I131 VanDerWaalsContact C-N 3.31Å; Q129-I131 PolarHBondContact O-N 3.43Å; I131-R133 VanDerWaalsContact C-N 3.26Å; I131-R133 PolarHBondContact O-N 3.38Å; I131-R133 VanDerWaalsContact O-N 3.15Å; I131-H134 PolarHBondContact O-N 2.91Å; I131-L135 HydrophobicContact CB-CB 4.2Å; I131-L135 HydrophobicContact CB-CD1 3.77Å; I131-L135 HydrophobicContact CB-CG 3.97Å; I131-L135 HydrophobicContact CD1-CB 4.48Å; I131-L135 HydrophobicContact CD1-CD1 3.99Å; I131-L135 HydrophobicContact CG1-CB 4.38Å; I131-L135 HydrophobicContact CG1-CD1 4.3Å; I131-L135 HydrophobicContact CG2-CD1 3.92Å; I131-L135 PolarHBondContact O-N 3.09Å; I131-V143 HydrophobicContact CD1-CG2 3.85Å
132	N	97.6	Very high	98	Very high	108 Å²	108	58.4 Å²	58.4	58%	0.578	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-38.5	-165.7	-172.2	48.5	0	0	0	113.6	H128 Q129	H128-N132 WeakPolarHBondContact O-CB 3.22Å; H128-N132 PolarHBondContact O-N 3.47Å; Q129-N132 WeakPolarHBondContact O-CB 3.32Å; Q129-N132 PolarHBondContact O-N 2.95Å
133	R	97.4	Very high	98	Very high	188 Å²	188	54.4 Å²	54.4	71%	0.709	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-14.4	-178.4	-70.2	173	46.6	147.3	4	114.1	E83 I131	E83-R133 WeakPolarHBondContact OE1-CD 3.28Å; E83-R133 IonicContact OE1-NE 3.89Å; E83-R133 PolarHBondContact OE1-NE 3.42Å; I131-R133 VanDerWaalsContact C-N 3.26Å; I131-R133 PolarHBondContact O-N 3.38Å; I131-R133 VanDerWaalsContact O-N 3.15Å
134	H	95.2	Very high	98	Very high	56 Å²	56	57.1 Å²	57.1	26%	0.259	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-32.2	-165.7	-61.5	-68.4	0	0	0	113.1	L73 Q78 F79 E83 I131	L73-H134 HydrophobicContact CD1-CB 3.71Å; L73-H134 HydrophobicContact CD2-CB 3.8Å; L73-H134 HydrophobicContact CG-CB 4.43Å; Q78-H134 PolarHBondContact O-CE1 2.85Å; F79-H134 AromaticContact CD1-CD2 3.88Å; F79-H134 AromaticContact CD1-NE2 3.76Å; F79-H134 AromaticContact CE1-CD2 3.77Å; E83-H134 IonicContact OE1-CD2 3.73Å; E83-H134 IonicContact OE1-NE2 2.65Å; E83-H134 PolarHBondContact OE1-NE2 2.77Å; E83-H134 IonicContact OE2-CD2 3.44Å; E83-H134 IonicContact OE2-CE1 3.33Å; E83-H134 IonicContact OE2-NE2 2.93Å; E83-H134 PolarHBondContact OE2-NE2 3.04Å; I131-H134 PolarHBondContact O-N 2.91Å
135	L	96.8	Very high	98	Very high	31 Å²	31	56.5 Å²	56.5	16%	0.162	29%	0.288	C	S	.	.	S	Bend	trans	-117.1	146.5	-169.7	-61.3	-170.1	0	0	0	112.2	K69 L73 I131	K69-L135 HydrophobicContact CB-CD1 4.02Å; K69-L135 HydrophobicContact CB-CD2 4.41Å; K69-L135 HydrophobicContact CD-CD1 4Å; K69-L135 HydrophobicContact CD-CD2 4.06Å; L73-L135 HydrophobicContact CD1-CD1 4.32Å; L73-L135 HydrophobicContact CD1-CD2 4.11Å; L73-L135 HydrophobicContact CD1-CG 4.05Å; I131-L135 HydrophobicContact CB-CB 4.2Å; I131-L135 HydrophobicContact CB-CD1 3.77Å; I131-L135 HydrophobicContact CB-CG 3.97Å; I131-L135 HydrophobicContact CD1-CB 4.48Å; I131-L135 HydrophobicContact CD1-CD1 3.99Å; I131-L135 HydrophobicContact CG1-CB 4.38Å; I131-L135 HydrophobicContact CG1-CD1 4.3Å; I131-L135 HydrophobicContact CG2-CD1 3.92Å; I131-L135 PolarHBondContact O-N 3.09Å
136	T	98	Very high	98	Very high	88 Å²	88	52.9 Å²	52.9	54%	0.54	27%	0.272	S	S	.	.			trans	-72.7	164	-177.8	62.4	0	0	0	0	112.9	K138 S139 H140	T136-K138 PolarHBondContact O-N 2.85Å; T136-S139 WeakPolarHBondContact O-CA 3.45Å; T136-S139 VanDerWaalsContact O-CB 3.31Å; T136-S139 WeakPolarHBondContact O-CB 3.46Å; T136-S139 PolarHBondContact O-N 3.45Å; T136-H140 PolarHBondContact O-N 2.62Å
137	A	98.1	Very high	98	Very high	84 Å²	84	52.3 Å²	52.3	69%	0.694	27%	0.268	S	S	*	.	H	α-helix	trans	-49.7	-33.6	171.6	0	0	0	0	0	113.5	S139 H140 S141	A137-S139 VanDerWaalsContact C-N 3.25Å; A137-S139 PolarHBondContact O-N 3.3Å; A137-H140 PolarHBondContact O-N 2.99Å; A137-S141 PolarHBondContact O-N 3.14Å
138	K	98.3	Very high	98.1	Very high	141 Å²	141	56 Å²	56	61%	0.613	29%	0.288	S	S	*	.	H	α-helix	trans	-60.5	-33.9	173.5	-172.5	174	-168.8	170.4	0	112.7	T136 R142	T136-K138 PolarHBondContact O-N 2.85Å; K138-R142 VanDerWaalsContact O-CG 3.29Å; K138-R142 WeakPolarHBondContact O-CG 3.23Å; K138-R142 PolarHBondContact O-N 2.9Å
139	S	98.2	Very high	98.1	Very high	3 Å²	3	56 Å²	56	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-74.9	-41.1	176.3	-46	0	0	0	0	110.9	K69 T136 A137 S141 R142 V143	K69-S139 PolarHBondContact NZ-OG 2.95Å; T136-S139 WeakPolarHBondContact O-CA 3.45Å; T136-S139 VanDerWaalsContact O-CB 3.31Å; T136-S139 WeakPolarHBondContact O-CB 3.46Å; T136-S139 PolarHBondContact O-N 3.45Å; A137-S139 VanDerWaalsContact C-N 3.25Å; A137-S139 PolarHBondContact O-N 3.3Å; S139-S141 VanDerWaalsContact C-N 3.34Å; S139-S141 PolarHBondContact O-N 3.01Å; S139-R142 WeakPolarHBondContact O-CB 3.42Å; S139-R142 PolarHBondContact O-N 3.45Å; S139-R142 VanDerWaalsContact O-N 3.07Å; S139-V143 WeakPolarHBondContact O-CG2 3.35Å; S139-V143 PolarHBondContact O-N 2.87Å
140	H	98.6	Very high	98.1	Very high	34 Å²	34	52.4 Å²	52.4	16%	0.157	27%	0.271	C	S	.	.	H	α-helix	trans	-60	-43.5	172.7	-73.4	-108.5	0	0	0	111.7	H128 T136 A137 R142 V143 N144	H128-H140 AromaticContact CE1-CG 3.91Å; H128-H140 AromaticContact CE1-ND1 3.55Å; H128-H140 PolarHBondContact CE1-O 3.45Å; H128-H140 AromaticContact CG-ND1 3.84Å; H128-H140 AromaticContact ND1-CE1 3.66Å; H128-H140 AromaticContact ND1-CG 3.59Å; H128-H140 AromaticContact ND1-ND1 2.88Å; H128-H140 PolarHBondContact ND1-ND1 3.23Å; H128-H140 PolarHBondContact O-CE1 3.12Å; T136-H140 PolarHBondContact O-N 2.62Å; A137-H140 PolarHBondContact O-N 2.99Å; H140-R142 PolarHBondContact O-N 2.78Å; H140-V143 WeakPolarHBondContact O-CB 3.33Å; H140-V143 PolarHBondContact O-N 3.11Å; H140-V143 VanDerWaalsContact O-N 3.11Å; H140-N144 PolarHBondContact O-N 3.31Å
141	S	98.7	Very high	98.2	Very high	76 Å²	76	52.7 Å²	52.7	53%	0.531	27%	0.273	S	S	.	.	H	α-helix	trans	-59	-34.2	174.1	172.8	0	0	0	0	112.7	A137 S139 H145	A137-S141 PolarHBondContact O-N 3.14Å; S139-S141 VanDerWaalsContact C-N 3.34Å; S139-S141 PolarHBondContact O-N 3.01Å; S141-H145 VanDerWaalsContact O-CB 3.29Å; S141-H145 WeakPolarHBondContact O-CB 3.37Å; S141-H145 PolarHBondContact O-N 3.01Å
142	R	98.7	Very high	98.3	Very high	39 Å²	39	55.2 Å²	55.2	15%	0.147	29%	0.286	C	S	.	.	H	α-helix	trans	-69.8	-40.7	174.4	-69	173	-179.6	145.5	-2.8	112.4	N62 M66 K138 S139 H140 H145 V146	N62-R142 HydrophobicContact CB-CB 4.02Å; N62-R142 HydrophobicContact CB-CG 4.15Å; N62-R142 WeakPolarHBondContact OD1-CG 3.27Å; M66-R142 HydrophobicContact CG-CB 4.37Å; M66-R142 HydrophobicContact SD-CB 4.32Å; K138-R142 VanDerWaalsContact O-CG 3.29Å; K138-R142 WeakPolarHBondContact O-CG 3.23Å; K138-R142 PolarHBondContact O-N 2.9Å; S139-R142 WeakPolarHBondContact O-CB 3.42Å; S139-R142 PolarHBondContact O-N 3.45Å; S139-R142 VanDerWaalsContact O-N 3.07Å; H140-R142 PolarHBondContact O-N 2.78Å; R142-H145 WeakPolarHBondContact O-CB 3.25Å; R142-H145 PolarHBondContact O-N 3.25Å; R142-V146 WeakPolarHBondContact O-CG2 3.38Å; R142-V146 PolarHBondContact O-N 3.07Å
143	V	98.8	Very high	98.3	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-56.3	-53.2	173.7	173	0	0	0	0	109.3	M66 R124 L127 H128 I131 S139 H140 H145 V146 F147	M66-V143 HydrophobicContact CE-CB 4.25Å; M66-V143 HydrophobicContact CE-CG1 4.46Å; M66-V143 HydrophobicContact CE-CG2 3.91Å; M66-V143 HydrophobicContact CG-CG2 4.05Å; M66-V143 VanDerWaalsContact SD-CA 3.54Å; M66-V143 HydrophobicContact SD-CB 4.36Å; M66-V143 HydrophobicContact SD-CG2 4.01Å; R124-V143 HydrophobicContact CG-CG1 3.73Å; L127-V143 HydrophobicContact CD2-CG1 4.13Å; L127-V143 HydrophobicContact CD2-CG2 3.86Å; L127-V143 HydrophobicContact CG-CG2 4.29Å; H128-V143 WeakPolarHBondContact NE2-CG1 3.28Å; I131-V143 HydrophobicContact CD1-CG2 3.85Å; S139-V143 WeakPolarHBondContact O-CG2 3.35Å; S139-V143 PolarHBondContact O-N 2.87Å; H140-V143 WeakPolarHBondContact O-CB 3.33Å; H140-V143 PolarHBondContact O-N 3.11Å; H140-V143 VanDerWaalsContact O-N 3.11Å; V143-H145 VanDerWaalsContact C-N 3.35Å; V143-H145 PolarHBondContact O-N 3.33Å; V143-V146 PolarHBondContact O-N 2.89Å; V143-F147 HydrophobicContact CG1-CD2 3.8Å; V143-F147 HydrophobicContact CG1-CE2 4.13Å; V143-F147 WeakPolarHBondContact O-CD2 3.21Å; V143-F147 PolarHBondContact O-N 3.41Å
144	N	98.8	Very high	98.4	Very high	57 Å²	57	47.3 Å²	47.3	31%	0.305	26%	0.261	S	S	.	.	H	α-helix	trans	-56.7	-47.2	176	-74.5	-30.5	0	0	0	112.4	R124 H128 H140 V146 F147 N148	R124-N144 WeakPolarHBondContact CD-OD1 3.19Å; H128-N144 PolarHBondContact NE2-OD1 3.42Å; H140-N144 PolarHBondContact O-N 3.31Å; N144-V146 VanDerWaalsContact C-N 3.27Å; N144-V146 PolarHBondContact O-N 3.29Å; N144-F147 PolarHBondContact O-N 3.47Å; N144-N148 WeakPolarHBondContact O-CB 3.36Å; N144-N148 PolarHBondContact O-N 3.39Å; N144-N148 PolarHBondContact O-ND2 3.05Å; N144-N148 PolarHBondContact O-OD1 2.87Å
145	H	98.8	Very high	98.5	Very high	37 Å²	37	44.7 Å²	44.7	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-38.3	-179.9	-171.4	-100	0	0	0	113.6	E55 K58 I59 N62 S141 R142 V143	E55-H145 IonicContact OE1-CD2 3Å; E55-H145 IonicContact OE1-CE1 3.61Å; E55-H145 PolarHBondContact OE1-CE1 3.33Å; E55-H145 IonicContact OE1-NE2 3.46Å; E55-H145 PolarHBondContact OE1-NE2 3.3Å; E55-H145 IonicContact OE2-NE2 3.66Å; K58-H145 VanDerWaalsContact CE-NE2 3.32Å; K58-H145 WeakPolarHBondContact CE-NE2 3.44Å; K58-H145 PolarHBondContact NZ-NE2 3.27Å; I59-H145 VanDerWaalsContact CG1-CE1 3.5Å; I59-H145 WeakPolarHBondContact CG1-CE1 3.27Å; N62-H145 PolarHBondContact ND2-ND1 3.29Å; S141-H145 VanDerWaalsContact O-CB 3.29Å; S141-H145 WeakPolarHBondContact O-CB 3.37Å; S141-H145 PolarHBondContact O-N 3.01Å; R142-H145 WeakPolarHBondContact O-CB 3.25Å; R142-H145 PolarHBondContact O-N 3.25Å; V143-H145 VanDerWaalsContact C-N 3.35Å; V143-H145 PolarHBondContact O-N 3.33Å
146	V	98.9	Very high	98.6	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	24%	0.242	C	C	.	.	H	α-helix	trans	-74.9	-53.6	179.1	170.3	0	0	0	0	110.7	N62 L63 M66 R142 V143 N144 H149 F150	N62-V146 HydrophobicContact CB-CG2 3.72Å; L63-V146 HydrophobicContact CB-CG1 4.17Å; L63-V146 HydrophobicContact CB-CG2 4.08Å; L63-V146 HydrophobicContact CD1-CG1 4.14Å; M66-V146 HydrophobicContact CE-CB 4.28Å; M66-V146 HydrophobicContact CE-CG1 4.37Å; M66-V146 HydrophobicContact SD-CB 4.03Å; M66-V146 HydrophobicContact SD-CG2 3.71Å; R142-V146 WeakPolarHBondContact O-CG2 3.38Å; R142-V146 PolarHBondContact O-N 3.07Å; V143-V146 PolarHBondContact O-N 2.89Å; N144-V146 VanDerWaalsContact C-N 3.27Å; N144-V146 PolarHBondContact O-N 3.29Å; V146-H149 PolarHBondContact O-N 3.2Å; V146-F150 HydrophobicContact CG1-CD2 3.79Å; V146-F150 HydrophobicContact CG1-CE2 3.94Å; V146-F150 VanDerWaalsContact O-CD2 3.3Å; V146-F150 WeakPolarHBondContact O-CD2 3.27Å; V146-F150 PolarHBondContact O-N 2.9Å; V146-F150 VanDerWaalsContact O-N 3.12Å
147	F	98.8	Very high	98.6	Very high	18 Å²	18	41 Å²	41	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-71.2	-33.4	-174.8	-79.3	-79.5	0	0	0	112.8	M66 F90 L120 C123 R124 L127 V143 N144 H149 F150 A151	M66-F147 HydrophobicContact CE-CD2 4.2Å; M66-F147 HydrophobicContact CE-CE2 3.76Å; F90-F147 HydrophobicContact CE2-CZ 4.45Å; L120-F147 HydrophobicContact CB-CD1 4.34Å; L120-F147 HydrophobicContact CD2-CD1 4.17Å; L120-F147 HydrophobicContact CD2-CE1 4.19Å; L120-F147 WeakPolarHBondContact O-CD1 3.33Å; L120-F147 WeakPolarHBondContact O-CE1 3.26Å; C123-F147 HydrophobicContact CB-CD1 4.45Å; C123-F147 HydrophobicContact CB-CE1 3.49Å; C123-F147 VanDerWaalsContact CB-CE1 3.49Å; C123-F147 HydrophobicContact CB-CZ 3.81Å; R124-F147 HydrophobicContact CB-CB 3.8Å; R124-F147 HydrophobicContact CB-CD1 4.02Å; R124-F147 HydrophobicContact CB-CD2 3.87Å; R124-F147 HydrophobicContact CB-CE2 4.43Å; R124-F147 HydrophobicContact CB-CG 3.62Å; R124-F147 HydrophobicContact CG-CB 3.66Å; R124-F147 HydrophobicContact CG-CD2 3.8Å; R124-F147 HydrophobicContact CG-CG 3.81Å; L127-F147 HydrophobicContact CD2-CE2 4.01Å; V143-F147 HydrophobicContact CG1-CD2 3.8Å; V143-F147 HydrophobicContact CG1-CE2 4.13Å; V143-F147 WeakPolarHBondContact O-CD2 3.21Å; V143-F147 PolarHBondContact O-N 3.41Å; N144-F147 PolarHBondContact O-N 3.47Å; F147-H149 VanDerWaalsContact C-N 3.26Å; F147-H149 PolarHBondContact O-N 3.3Å; F147-F150 PolarHBondContact O-N 3.44Å; F147-A151 WeakPolarHBondContact O-CA 3.27Å; F147-A151 WeakPolarHBondContact O-CB 3.46Å; F147-A151 PolarHBondContact O-N 3.34Å
148	N	98.8	Very high	98.6	Very high	86 Å²	86	38.3 Å²	38.3	46%	0.46	21%	0.209	S	C	.	.	H	α-helix	trans	-63.5	-34	175.6	-67.1	0.7	0	0	0	111.9	R124 N144 D152	R124-N148 PolarHBondContact NH1-OD1 3.04Å; N144-N148 WeakPolarHBondContact O-CB 3.36Å; N144-N148 PolarHBondContact O-N 3.39Å; N144-N148 PolarHBondContact O-ND2 3.05Å; N144-N148 PolarHBondContact O-OD1 2.87Å; N148-D152 PolarHBondContact O-N 3.31Å
149	H	98.8	Very high	98.6	Very high	22 Å²	22	32.2 Å²	32.2	10%	0.102	18%	0.182	C	C	.	.	H	α-helix	trans	-70.9	-54.7	174.1	173.5	74.5	0	0	0	111.3	T46 I59 V146 F147 A151 D152 F155	T46-H149 WeakPolarHBondContact CG2-NE2 3.44Å; T46-H149 PolarHBondContact OG1-NE2 3Å; T46-H149 VanDerWaalsContact OG1-NE2 3.14Å; I59-H149 HydrophobicContact CD1-CB 3.87Å; V146-H149 PolarHBondContact O-N 3.2Å; F147-H149 VanDerWaalsContact C-N 3.26Å; F147-H149 PolarHBondContact O-N 3.3Å; H149-A151 VanDerWaalsContact C-N 3.3Å; H149-A151 PolarHBondContact O-N 2.68Å; H149-D152 VanDerWaalsContact O-CB 3.29Å; H149-D152 WeakPolarHBondContact O-CB 3.22Å; H149-D152 PolarHBondContact O-N 3.02Å; H149-F155 AromaticContact CE1-CD2 3.77Å; H149-F155 AromaticContact NE2-CD2 3.8Å; H149-F155 AromaticContact NE2-CE2 3.64Å; H149-F155 AromaticContact NE2-CZ 3.81Å
150	F	98.8	Very high	98.6	Very high	24 Å²	24	33.9 Å²	33.9	11%	0.105	19%	0.188	C	C	.	.	H	α-helix	trans	-70.7	-26	-174.6	-70.4	-60.7	0	0	0	113.4	L42 I59 I60 L63 L120 V146 F147 D152 F155 L156	L42-F150 HydrophobicContact CB-CE1 4.43Å; L42-F150 HydrophobicContact CB-CZ 4.23Å; L42-F150 HydrophobicContact CD2-CE1 3.85Å; L42-F150 HydrophobicContact CD2-CZ 4.27Å; I59-F150 HydrophobicContact CG2-CE2 3.81Å; I59-F150 HydrophobicContact CG2-CZ 4.06Å; I60-F150 HydrophobicContact CD1-CZ 4.25Å; L63-F150 HydrophobicContact CD2-CE2 4.5Å; L120-F150 HydrophobicContact CD1-CB 4.34Å; L120-F150 WeakPolarHBondContact CD1-O 3.37Å; L120-F150 HydrophobicContact CD2-CB 4.35Å; V146-F150 HydrophobicContact CG1-CD2 3.79Å; V146-F150 HydrophobicContact CG1-CE2 3.94Å; V146-F150 VanDerWaalsContact O-CD2 3.3Å; V146-F150 WeakPolarHBondContact O-CD2 3.27Å; V146-F150 PolarHBondContact O-N 2.9Å; V146-F150 VanDerWaalsContact O-N 3.12Å; F147-F150 PolarHBondContact O-N 3.44Å; F150-D152 VanDerWaalsContact C-N 3.35Å; F150-F155 AromaticContact CD1-CE1 3.72Å; F150-F155 HydrophobicContact CD1-CE1 3.72Å; F150-F155 HydrophobicContact CD1-CZ 4.11Å; F150-F155 HydrophobicContact CE1-CE1 4.35Å; F150-F155 HydrophobicContact CE1-CZ 4.28Å; F150-L156 WeakPolarHBondContact O-CD2 3.45Å; F150-L156 WeakPolarHBondContact O-CG 3.29Å
151	A	98.8	Very high	98.3	Very high	7 Å²	7	33.2 Å²	33.2	6%	0.058	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.1	176	0	0	0	0	0	113.4	S117 L120 F147 H149 C153	S117-A151 WeakPolarHBondContact CB-O 3.37Å; S117-A151 PolarHBondContact OG-O 3.14Å; L120-A151 HydrophobicContact CB-CB 3.76Å; L120-A151 HydrophobicContact CD1-CB 4.19Å; F147-A151 WeakPolarHBondContact O-CA 3.27Å; F147-A151 WeakPolarHBondContact O-CB 3.46Å; F147-A151 PolarHBondContact O-N 3.34Å; H149-A151 VanDerWaalsContact C-N 3.3Å; H149-A151 PolarHBondContact O-N 2.68Å; A151-C153 PolarHBondContact O-N 3.12Å
152	D	98.8	Very high	97.9	Very high	56 Å²	56	35.9 Å²	35.9	30%	0.299	21%	0.207	S	C	.	.			trans	-63.3	122.4	175.8	176.8	-122.1	0	0	0	110.1	Y49 N148 H149 F150 D154 F155 L156	Y49-D152 PolarHBondContact OH-OD1 3.33Å; N148-D152 PolarHBondContact O-N 3.31Å; H149-D152 VanDerWaalsContact O-CB 3.29Å; H149-D152 WeakPolarHBondContact O-CB 3.22Å; H149-D152 PolarHBondContact O-N 3.02Å; F150-D152 VanDerWaalsContact C-N 3.35Å; D152-D154 PolarHBondContact O-N 3.14Å; D152-D154 PolarHBondContact OD1-N 3.34Å; D152-F155 HydrophobicContact CB-CB 3.9Å; D152-F155 PolarHBondContact O-N 3.35Å; D152-F155 WeakPolarHBondContact OD1-CB 3.39Å; D152-F155 PolarHBondContact OD1-N 2.97Å; D152-L156 WeakPolarHBondContact O-CB 3.47Å; D152-L156 VanDerWaalsContact O-CG 3.26Å; D152-L156 WeakPolarHBondContact O-CG 3.5Å; D152-L156 PolarHBondContact O-N 2.88Å
153	C	98.6	Very high	97.5	Very high	35 Å²	35	36.4 Å²	36.4	24%	0.236	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-27.6	-175.2	-82.3	0	0	0	0	112.4	R113 A151 A157	R113-C153 WeakPolarHBondContact CD-O 3.4Å; R113-C153 HydrophobicContact CG-CB 4.31Å; R113-C153 PolarHBondContact NH1-O 3.06Å; A151-C153 PolarHBondContact O-N 3.12Å; C153-A157 VanDerWaalsContact O-CB 3.26Å; C153-A157 WeakPolarHBondContact O-CB 3.39Å; C153-A157 PolarHBondContact O-N 2.98Å
154	D	98.4	Very high	97	Very high	95 Å²	95	43 Å²	43	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-80.6	-37.4	179.2	-65.2	-26.8	0	0	0	111	Y49 R113 D152 A157 A158	Y49-D154 VanDerWaalsContact OH-C 3.29Å; Y49-D154 VanDerWaalsContact OH-CB 3.25Å; Y49-D154 WeakPolarHBondContact OH-CB 3.25Å; R113-D154 IonicContact NH1-OD1 2.64Å; R113-D154 PolarHBondContact NH1-OD1 2.98Å; D152-D154 PolarHBondContact O-N 3.14Å; D152-D154 PolarHBondContact OD1-N 3.34Å; D154-A157 PolarHBondContact O-N 2.75Å; D154-A158 WeakPolarHBondContact O-CB 3.37Å; D154-A158 PolarHBondContact O-N 2.79Å
155	F	98.6	Very high	96.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	25%	0.253	C	S	.	.	H	α-helix	trans	-58.3	-49.2	167.8	170.4	-105.8	0	0	0	111.2	V45 Y49 H149 F150 D152 A157 A158 L159	V45-F155 HydrophobicContact CB-CE2 4.44Å; V45-F155 HydrophobicContact CG2-CE2 4.16Å; V45-F155 HydrophobicContact CG2-CZ 3.88Å; Y49-F155 HydrophobicContact CD1-CB 4Å; Y49-F155 AromaticContact CD1-CD2 3.67Å; Y49-F155 HydrophobicContact CD1-CD2 3.67Å; Y49-F155 HydrophobicContact CD1-CG 4.27Å; Y49-F155 HydrophobicContact CD2-CD2 4.15Å; Y49-F155 HydrophobicContact CE1-CB 3.63Å; Y49-F155 HydrophobicContact CE1-CD2 4.22Å; Y49-F155 HydrophobicContact CE1-CG 4.39Å; Y49-F155 HydrophobicContact CE2-CB 4.23Å; Y49-F155 HydrophobicContact CG-CB 4.41Å; Y49-F155 AromaticContact CG-CD2 3.61Å; Y49-F155 HydrophobicContact CG-CD2 3.61Å; Y49-F155 HydrophobicContact CG-CE2 4.46Å; Y49-F155 HydrophobicContact CG-CG 4.5Å; Y49-F155 VanDerWaalsContact CZ-CA 3.44Å; Y49-F155 VanDerWaalsContact CZ-N 3.34Å; Y49-F155 PolarHBondContact OH-N 2.87Å; H149-F155 AromaticContact CE1-CD2 3.77Å; H149-F155 AromaticContact NE2-CD2 3.8Å; H149-F155 AromaticContact NE2-CE2 3.64Å; H149-F155 AromaticContact NE2-CZ 3.81Å; F150-F155 AromaticContact CD1-CE1 3.72Å; F150-F155 HydrophobicContact CD1-CE1 3.72Å; F150-F155 HydrophobicContact CD1-CZ 4.11Å; F150-F155 HydrophobicContact CE1-CE1 4.35Å; F150-F155 HydrophobicContact CE1-CZ 4.28Å; D152-F155 HydrophobicContact CB-CB 3.9Å; D152-F155 PolarHBondContact O-N 3.35Å; D152-F155 WeakPolarHBondContact OD1-CB 3.39Å; D152-F155 PolarHBondContact OD1-N 2.97Å; F155-A157 VanDerWaalsContact C-N 3.33Å; F155-A157 PolarHBondContact O-N 3.12Å; F155-A158 PolarHBondContact O-N 2.86Å; F155-L159 HydrophobicContact CE1-CD2 4.05Å; F155-L159 HydrophobicContact CZ-CD2 4.02Å; F155-L159 WeakPolarHBondContact O-CB 3.12Å; F155-L159 PolarHBondContact O-N 3.47Å
156	L	98.6	Very high	96.5	Very high	6 Å²	6	43 Å²	43	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-41.4	179	-70.7	172	0	0	0	111.5	F111 R113 M116 L120 F150 D152 A158 L159 Y160	F111-L156 HydrophobicContact CZ-CB 4.01Å; F111-L156 VanDerWaalsContact CZ-O 3.27Å; F111-L156 WeakPolarHBondContact CZ-O 3.43Å; R113-L156 HydrophobicContact CB-CB 4.13Å; M116-L156 HydrophobicContact CB-CD1 3.99Å; M116-L156 HydrophobicContact CB-CD2 4.49Å; M116-L156 HydrophobicContact CG-CD1 3.84Å; M116-L156 HydrophobicContact CG-CD2 3.63Å; M116-L156 HydrophobicContact CG-CG 4.36Å; L120-L156 HydrophobicContact CD1-CD1 4.46Å; L120-L156 HydrophobicContact CD1-CD2 4.5Å; F150-L156 WeakPolarHBondContact O-CD2 3.45Å; F150-L156 WeakPolarHBondContact O-CG 3.29Å; D152-L156 WeakPolarHBondContact O-CB 3.47Å; D152-L156 VanDerWaalsContact O-CG 3.26Å; D152-L156 WeakPolarHBondContact O-CG 3.5Å; D152-L156 PolarHBondContact O-N 2.88Å; L156-A158 VanDerWaalsContact C-N 3.35Å; L156-L159 PolarHBondContact O-N 3.05Å; L156-Y160 PolarHBondContact O-N 3.37Å; L156-Y160 VanDerWaalsContact O-N 3.07Å
157	A	98	Very high	96.2	Very high	36 Å²	36	50.2 Å²	50.2	30%	0.298	28%	0.276	S	S	.	.	H	α-helix	trans	-65.4	-36.3	175.8	0	0	0	0	0	112.8	C153 D154 F155 G161	C153-A157 VanDerWaalsContact O-CB 3.26Å; C153-A157 WeakPolarHBondContact O-CB 3.39Å; C153-A157 PolarHBondContact O-N 2.98Å; D154-A157 PolarHBondContact O-N 2.75Å; F155-A157 VanDerWaalsContact C-N 3.33Å; F155-A157 PolarHBondContact O-N 3.12Å; A157-G161 VanDerWaalsContact O-CA 3.26Å; A157-G161 WeakPolarHBondContact O-CA 3.36Å; A157-G161 PolarHBondContact O-N 3.44Å
158	A	97.8	Very high	96.1	Very high	27 Å²	27	50.8 Å²	50.8	22%	0.223	29%	0.287	C	S	.	.	H	α-helix	trans	-68.6	-43.8	174.4	0	0	0	0	0	111.6	Y49 D154 F155 L156 G161 Y166	Y49-A158 HydrophobicContact CD2-CB 3.92Å; Y49-A158 HydrophobicContact CE2-CB 4.02Å; D154-A158 WeakPolarHBondContact O-CB 3.37Å; D154-A158 PolarHBondContact O-N 2.79Å; F155-A158 PolarHBondContact O-N 2.86Å; L156-A158 VanDerWaalsContact C-N 3.35Å; A158-G161 PolarHBondContact O-N 3.48Å; A158-Y166 HydrophobicContact CB-CE2 4.14Å; A158-Y166 VanDerWaalsContact O-CD2 3.28Å; A158-Y166 WeakPolarHBondContact O-CD2 3.23Å
159	L	98.1	Very high	96	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.063	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-45.2	-177.5	178.3	61.3	0	0	0	112.7	V45 F155 L156 G161 Y166 L170	V45-L159 HydrophobicContact CB-CD1 4.07Å; V45-L159 HydrophobicContact CG1-CD1 3.78Å; V45-L159 HydrophobicContact CG2-CD1 4.34Å; F155-L159 HydrophobicContact CE1-CD2 4.05Å; F155-L159 HydrophobicContact CZ-CD2 4.02Å; F155-L159 WeakPolarHBondContact O-CB 3.12Å; F155-L159 PolarHBondContact O-N 3.47Å; L156-L159 PolarHBondContact O-N 3.05Å; L159-G161 VanDerWaalsContact C-N 3.33Å; L159-Y166 HydrophobicContact CD1-CD1 4.18Å; L159-L170 HydrophobicContact CD1-CB 4.24Å; L159-L170 HydrophobicContact CD1-CD1 4.3Å; L159-L170 HydrophobicContact CD2-CD1 4.42Å; L159-L170 HydrophobicContact CG-CD1 4.15Å
160	Y	97.4	Very high	95.9	Very high	38 Å²	38	47.7 Å²	47.7	15%	0.149	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	5.6	177.2	-73	-99	0	0	0	112.9	A101 F104 H105 F111 L156 L170	A101-Y160 VanDerWaalsContact CA-OH 3.26Å; A101-Y160 WeakPolarHBondContact CA-OH 3.43Å; A101-Y160 WeakPolarHBondContact CB-OH 3.32Å; A101-Y160 PolarHBondContact O-OH 3.31Å; A101-Y160 VanDerWaalsContact O-OH 3.11Å; F104-Y160 HydrophobicContact CB-CD1 4.08Å; F104-Y160 HydrophobicContact CB-CE1 3.6Å; H105-Y160 HydrophobicContact CB-CE1 4.26Å; F111-Y160 HydrophobicContact CB-CD1 4.33Å; F111-Y160 HydrophobicContact CD1-CG 4.3Å; F111-Y160 AromaticContact CD2-CD1 3.57Å; F111-Y160 HydrophobicContact CD2-CD1 3.57Å; F111-Y160 AromaticContact CD2-CD2 3.73Å; F111-Y160 HydrophobicContact CD2-CD2 3.73Å; F111-Y160 HydrophobicContact CD2-CE1 4.12Å; F111-Y160 HydrophobicContact CD2-CE2 4.27Å; F111-Y160 AromaticContact CD2-CG 3.35Å; F111-Y160 HydrophobicContact CD2-CG 3.35Å; F111-Y160 HydrophobicContact CE1-CG 4.36Å; F111-Y160 HydrophobicContact CE2-CD1 4.09Å; F111-Y160 AromaticContact CE2-CD2 3.33Å; F111-Y160 HydrophobicContact CE2-CD2 3.33Å; F111-Y160 AromaticContact CE2-CE2 3.91Å; F111-Y160 HydrophobicContact CE2-CE2 3.91Å; F111-Y160 AromaticContact CE2-CG 3.44Å; F111-Y160 HydrophobicContact CE2-CG 3.44Å; F111-Y160 VanDerWaalsContact CE2-CG 3.44Å; F111-Y160 HydrophobicContact CG-CD1 4.01Å; F111-Y160 AromaticContact CG-CG 3.81Å; F111-Y160 HydrophobicContact CG-CG 3.81Å; F111-Y160 AromaticContact CZ-CD2 3.85Å; F111-Y160 HydrophobicContact CZ-CD2 3.85Å; F111-Y160 AromaticContact CZ-CG 3.96Å; F111-Y160 HydrophobicContact CZ-CG 3.96Å; L156-Y160 PolarHBondContact O-N 3.37Å; L156-Y160 VanDerWaalsContact O-N 3.07Å; Y160-L170 HydrophobicContact CD1-CD2 3.63Å; Y160-L170 HydrophobicContact CD2-CD2 4.47Å; Y160-L170 HydrophobicContact CE1-CD1 4.05Å; Y160-L170 HydrophobicContact CE1-CD2 3.86Å; Y160-L170 HydrophobicContact CE2-CD1 4.16Å; Y160-L170 HydrophobicContact CG-CD2 3.96Å
161	G	93.5	Very high	95.9	Very high	21 Å²	21	50.4 Å²	50.4	22%	0.216	28%	0.283	C	S	.	.	S	Bend	trans	-74.5	173.5	180	0	0	0	0	0	112.7	A157 A158 L159 S163	A157-G161 VanDerWaalsContact O-CA 3.26Å; A157-G161 WeakPolarHBondContact O-CA 3.36Å; A157-G161 PolarHBondContact O-N 3.44Å; A158-G161 PolarHBondContact O-N 3.48Å; L159-G161 VanDerWaalsContact C-N 3.33Å; G161-S163 PolarHBondContact O-N 3.45Å
162	P	89.2	Confident	95.8	Very high	132 Å²	132	55.3 Å²	55.3	86%	0.857	30%	0.3	S	S	*	.	S	Bend	trans	-73.9	6.1	-177.3	32.6	-37.5	0	0	0	114.1	E164	P162-E164 PolarHBondContact O-N 3.39Å
163	S	91.3	Very high	95.7	Very high	49 Å²	49	53.4 Å²	53.4	34%	0.343	29%	0.29	S	S	.	.			trans	-70.4	120.8	-177.8	175.4	0	0	0	0	110.8	G161 V165 Y166 R167	G161-S163 PolarHBondContact O-N 3.45Å; S163-V165 PolarHBondContact O-N 3.21Å; S163-V165 VanDerWaalsContact O-N 3.12Å; S163-V165 PolarHBondContact OG-N 3.43Å; S163-Y166 PolarHBondContact O-N 3.05Å; S163-R167 PolarHBondContact O-N 3.02Å
164	E	87.6	Confident	95.7	Very high	141 Å²	141	51.8 Å²	51.8	66%	0.659	28%	0.279	S	S	*	.	H	α-helix	trans	-57.3	-27.8	176.3	-68.5	-58.4	148.3	0	0	112.9	P162 Y166	P162-E164 PolarHBondContact O-N 3.39Å; E164-Y166 PolarHBondContact O-N 3.29Å
165	V	91.3	Very high	95.6	Very high	71 Å²	71	51.1 Å²	51.1	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-47.4	176.3	-177.3	0	0	0	0	110.4	E48 S163 H169	E48-V165 HydrophobicContact CG-CG1 3.77Å; S163-V165 PolarHBondContact O-N 3.21Å; S163-V165 VanDerWaalsContact O-N 3.12Å; S163-V165 PolarHBondContact OG-N 3.43Å; V165-H169 PolarHBondContact O-CD2 3.28Å
166	Y	95.5	Very high	95.5	Very high	22 Å²	22	51.3 Å²	51.3	9%	0.086	28%	0.278	C	S	.	.	H	α-helix	trans	-81.5	-30.4	-178	-69	-72.9	0	0	0	113	V45 E48 Y49 A158 L159 S163 E164 G168 H169 L170	V45-Y166 HydrophobicContact CB-CD1 4.13Å; V45-Y166 HydrophobicContact CB-CE1 4.13Å; V45-Y166 HydrophobicContact CG1-CD1 4.09Å; E48-Y166 HydrophobicContact CB-CE1 3.99Å; E48-Y166 HydrophobicContact CG-CE1 4.02Å; E48-Y166 HydrophobicContact CG-CE2 4.45Å; Y49-Y166 WeakPolarHBondContact CA-OH 3.45Å; Y49-Y166 WeakPolarHBondContact CB-OH 3.36Å; Y49-Y166 PolarHBondContact N-OH 3.03Å; Y49-Y166 VanDerWaalsContact N-OH 3.1Å; A158-Y166 HydrophobicContact CB-CE2 4.14Å; A158-Y166 VanDerWaalsContact O-CD2 3.28Å; A158-Y166 WeakPolarHBondContact O-CD2 3.23Å; L159-Y166 HydrophobicContact CD1-CD1 4.18Å; S163-Y166 PolarHBondContact O-N 3.05Å; E164-Y166 PolarHBondContact O-N 3.29Å; Y166-G168 VanDerWaalsContact C-N 3.33Å; Y166-G168 PolarHBondContact O-N 2.95Å; Y166-H169 PolarHBondContact O-N 2.97Å; Y166-L170 WeakPolarHBondContact O-CB 3.35Å; Y166-L170 PolarHBondContact O-N 3.04Å
167	R	94.3	Very high	95.4	Very high	154 Å²	154	52 Å²	52	58%	0.581	28%	0.282	S	S	*	.	H	α-helix	trans	-53.4	-47.7	-176.3	-171.9	-178.6	174.8	127.9	6.2	112.8	S163 H169 L170 Q171	S163-R167 PolarHBondContact O-N 3.02Å; R167-H169 PolarHBondContact O-N 3.26Å; R167-L170 PolarHBondContact O-N 2.8Å; R167-Q171 PolarHBondContact O-N 2.95Å
168	G	95.2	Very high	95.3	Very high	31 Å²	31	52 Å²	52	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-34.7	178.7	0	0	0	0	0	113.4	Y166 R172	Y166-G168 VanDerWaalsContact C-N 3.33Å; Y166-G168 PolarHBondContact O-N 2.95Å; G168-R172 VanDerWaalsContact O-CZ 3.27Å; G168-R172 PolarHBondContact O-N 2.95Å; G168-R172 PolarHBondContact O-NH1 3.03Å
169	H	97.5	Very high	95.2	Very high	35 Å²	35	55.2 Å²	55.2	16%	0.162	29%	0.287	C	S	.	.	H	α-helix	trans	-70.7	-46	175.5	-67.4	-62.6	0	0	0	111.6	E41 V45 V165 Y166 R167 Q171 R172 I173	E41-H169 WeakPolarHBondContact OE2-CA 3.26Å; E41-H169 IonicContact OE2-CE1 3.52Å; E41-H169 IonicContact OE2-CG 3.84Å; E41-H169 IonicContact OE2-ND1 3.34Å; E41-H169 PolarHBondContact OE2-ND1 2.95Å; V45-H169 HydrophobicContact CG1-CB 3.33Å; V165-H169 PolarHBondContact O-CD2 3.28Å; Y166-H169 PolarHBondContact O-N 2.97Å; R167-H169 PolarHBondContact O-N 3.26Å; H169-Q171 VanDerWaalsContact C-N 3.33Å; H169-Q171 PolarHBondContact O-N 2.98Å; H169-R172 PolarHBondContact CE1-NH2 2.87Å; H169-R172 PolarHBondContact ND1-NH2 2.91Å; H169-R172 PolarHBondContact O-N 2.92Å; H169-I173 WeakPolarHBondContact O-CG1 3.45Å; H169-I173 PolarHBondContact O-N 3.1Å
170	L	97.6	Very high	94.8	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-40.8	179.4	179.6	60.7	0	0	0	111.9	H105 L159 Y160 Y166 R167 R172 I173 C174	H105-L170 HydrophobicContact CB-CD2 4.34Å; H105-L170 HydrophobicContact CB-CG 4.39Å; L159-L170 HydrophobicContact CD1-CB 4.24Å; L159-L170 HydrophobicContact CD1-CD1 4.3Å; L159-L170 HydrophobicContact CD2-CD1 4.42Å; L159-L170 HydrophobicContact CG-CD1 4.15Å; Y160-L170 HydrophobicContact CD1-CD2 3.63Å; Y160-L170 HydrophobicContact CD2-CD2 4.47Å; Y160-L170 HydrophobicContact CE1-CD1 4.05Å; Y160-L170 HydrophobicContact CE1-CD2 3.86Å; Y160-L170 HydrophobicContact CE2-CD1 4.16Å; Y160-L170 HydrophobicContact CG-CD2 3.96Å; Y166-L170 WeakPolarHBondContact O-CB 3.35Å; Y166-L170 PolarHBondContact O-N 3.04Å; R167-L170 PolarHBondContact O-N 2.8Å; L170-R172 PolarHBondContact O-N 3Å; L170-I173 PolarHBondContact O-N 3.32Å; L170-C174 PolarHBondContact O-N 2.98Å; L170-C174 PolarHBondContact O-SG 3.04Å
171	Q	96.9	Very high	94.5	Very high	80 Å²	80	55 Å²	55	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-55.4	-52.2	173.5	-179.7	65.4	54.7	0	0	111.2	H105 R167 H169 I173 C174 D175	H105-Q171 PolarHBondContact NE2-OE1 3.23Å; R167-Q171 PolarHBondContact O-N 2.95Å; H169-Q171 VanDerWaalsContact C-N 3.33Å; H169-Q171 PolarHBondContact O-N 2.98Å; Q171-I173 VanDerWaalsContact C-N 3.32Å; Q171-I173 PolarHBondContact O-N 3.37Å; Q171-C174 PolarHBondContact O-N 3.13Å; Q171-C174 VanDerWaalsContact O-N 3.14Å; Q171-D175 VanDerWaalsContact NE2-CG 3.28Å; Q171-D175 PolarHBondContact NE2-OD1 3.47Å; Q171-D175 PolarHBondContact NE2-OD2 2.99Å; Q171-D175 VanDerWaalsContact NE2-OD2 3.12Å; Q171-D175 PolarHBondContact O-N 2.71Å
172	R	97.6	Very high	94.4	Very high	111 Å²	111	60.9 Å²	60.9	42%	0.419	31%	0.314	S	S	.	.	H	α-helix	trans	-64.6	-35.1	-179.7	-70	-169.8	-64.5	-81.5	-9.5	112.9	E41 G168 H169 L170 G176	E41-R172 HydrophobicContact CG-CB 3.85Å; E41-R172 IonicContact OE1-CZ 3.88Å; E41-R172 IonicContact OE1-NE 3.07Å; E41-R172 PolarHBondContact OE1-NE 3.49Å; E41-R172 IonicContact OE1-NH2 3.56Å; E41-R172 PolarHBondContact OE1-NH2 3.37Å; E41-R172 IonicContact OE2-CZ 2.96Å; E41-R172 IonicContact OE2-NE 2.83Å; E41-R172 PolarHBondContact OE2-NE 3.42Å; E41-R172 IonicContact OE2-NH2 3.51Å; E41-R172 PolarHBondContact OE2-NH2 3.25Å; G168-R172 VanDerWaalsContact O-CZ 3.27Å; G168-R172 PolarHBondContact O-N 2.95Å; G168-R172 PolarHBondContact O-NH1 3.03Å; H169-R172 PolarHBondContact CE1-NH2 2.87Å; H169-R172 PolarHBondContact ND1-NH2 2.91Å; H169-R172 PolarHBondContact O-N 2.92Å; L170-R172 PolarHBondContact O-N 3Å; R172-G176 PolarHBondContact O-N 3.06Å
173	I	97.8	Very high	94.4	Very high	15 Å²	15	59 Å²	59	8%	0.077	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-50.9	171.7	-68	166.3	0	0	0	109.8	E41 L42 V45 H169 L170 Q171 D175 G176 V177	E41-I173 HydrophobicContact CB-CD1 4.05Å; E41-I173 HydrophobicContact CB-CG1 3.43Å; E41-I173 VanDerWaalsContact CB-CG1 3.43Å; E41-I173 HydrophobicContact CG-CG1 4.39Å; L42-I173 HydrophobicContact CD2-CD1 4.18Å; V45-I173 HydrophobicContact CG1-CD1 4.1Å; V45-I173 HydrophobicContact CG2-CD1 4.26Å; H169-I173 WeakPolarHBondContact O-CG1 3.45Å; H169-I173 PolarHBondContact O-N 3.1Å; L170-I173 PolarHBondContact O-N 3.32Å; Q171-I173 VanDerWaalsContact C-N 3.32Å; Q171-I173 PolarHBondContact O-N 3.37Å; I173-D175 PolarHBondContact O-N 3.06Å; I173-G176 PolarHBondContact O-N 3.08Å; I173-V177 HydrophobicContact CG2-CG2 4.21Å; I173-V177 WeakPolarHBondContact O-CB 3.48Å; I173-V177 WeakPolarHBondContact O-CG2 3.34Å; I173-V177 PolarHBondContact O-N 3.2Å
174	C	97.7	Very high	94	Very high	2 Å²	2	59 Å²	59	1%	0.014	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-37.4	-177.9	-64.7	0	0	0	0	112.4	V102 H105 L170 Q171 V177 N178	V102-C174 HydrophobicContact CG2-CB 4.31Å; H105-C174 HydrophobicContact CB-CB 4.45Å; H105-C174 WeakPolarHBondContact CB-SG 3.39Å; L170-C174 PolarHBondContact O-N 2.98Å; L170-C174 PolarHBondContact O-SG 3.04Å; Q171-C174 PolarHBondContact O-N 3.13Å; Q171-C174 VanDerWaalsContact O-N 3.14Å; C174-V177 PolarHBondContact O-N 3.12Å; C174-N178 WeakPolarHBondContact O-CB 3.24Å; C174-N178 PolarHBondContact O-N 3.45Å; C174-N178 PolarHBondContact O-ND2 3.21Å
175	D	97.1	Very high	93.5	Very high	80 Å²	80	56.5 Å²	56.5	43%	0.428	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-47	176	-67.1	-24	0	0	0	111.2	Q171 I173 N178 K179	Q171-D175 VanDerWaalsContact NE2-CG 3.28Å; Q171-D175 PolarHBondContact NE2-OD1 3.47Å; Q171-D175 PolarHBondContact NE2-OD2 2.99Å; Q171-D175 VanDerWaalsContact NE2-OD2 3.12Å; Q171-D175 PolarHBondContact O-N 2.71Å; I173-D175 PolarHBondContact O-N 3.06Å; D175-N178 PolarHBondContact O-N 3.24Å; D175-K179 WeakPolarHBondContact O-CB 3.37Å; D175-K179 PolarHBondContact O-N 3.34Å
176	G	96.1	Very high	92.6	Very high	7 Å²	7	55 Å²	55	7%	0.072	28%	0.282	C	S	.	.	H	α-helix	trans	-64.1	-43.3	175.9	0	0	0	0	0	112.4	T34 R172 I173 K179 M180	T34-G176 WeakPolarHBondContact CG2-O 3.39Å; R172-G176 PolarHBondContact O-N 3.06Å; I173-G176 PolarHBondContact O-N 3.08Å; G176-K179 PolarHBondContact O-N 2.83Å; G176-M180 VanDerWaalsContact O-CG 3.28Å; G176-M180 WeakPolarHBondContact O-CG 3.47Å; G176-M180 PolarHBondContact O-N 3.48Å
177	V	96.2	Very high	92.5	Very high	19 Å²	19	56.7 Å²	56.7	12%	0.115	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-42.2	177.2	169.8	0	0	0	0	111.6	V38 A98 V102 I173 C174 M180 L181 L186	V38-V177 HydrophobicContact CG1-CG2 4.29Å; V38-V177 HydrophobicContact CG2-CG2 4.48Å; A98-V177 HydrophobicContact CB-CG1 3.56Å; V102-V177 HydrophobicContact CG2-CB 4.32Å; V102-V177 HydrophobicContact CG2-CG1 3.92Å; I173-V177 HydrophobicContact CG2-CG2 4.21Å; I173-V177 WeakPolarHBondContact O-CB 3.48Å; I173-V177 WeakPolarHBondContact O-CG2 3.34Å; I173-V177 PolarHBondContact O-N 3.2Å; C174-V177 PolarHBondContact O-N 3.12Å; V177-M180 PolarHBondContact O-N 3.26Å; V177-L181 HydrophobicContact CG1-CD1 4.2Å; V177-L181 WeakPolarHBondContact O-CG 3.34Å; V177-L181 PolarHBondContact O-N 3.49Å; V177-L186 HydrophobicContact CG1-CD1 4.3Å
178	N	95.6	Very high	92.4	Very high	37 Å²	37	51.5 Å²	51.5	20%	0.198	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-46.5	173.7	-90.4	-32.1	0	0	0	111.9	V102 Q106 C174 D175 M180 L181 D182	V102-N178 WeakPolarHBondContact CG1-ND2 3.46Å; V102-N178 VanDerWaalsContact CG1-OD1 3.27Å; V102-N178 WeakPolarHBondContact CG1-OD1 3.28Å; V102-N178 WeakPolarHBondContact CG2-OD1 3.44Å; Q106-N178 PolarHBondContact NE2-ND2 3.29Å; Q106-N178 VanDerWaalsContact NE2-ND2 3.18Å; C174-N178 WeakPolarHBondContact O-CB 3.24Å; C174-N178 PolarHBondContact O-N 3.45Å; C174-N178 PolarHBondContact O-ND2 3.21Å; D175-N178 PolarHBondContact O-N 3.24Å; N178-M180 VanDerWaalsContact C-N 3.29Å; N178-M180 PolarHBondContact O-N 3.49Å; N178-L181 WeakPolarHBondContact O-CB 3.15Å; N178-L181 PolarHBondContact O-N 3.48Å; N178-L181 VanDerWaalsContact O-N 3.07Å; N178-D182 PolarHBondContact O-N 3.01Å
179	K	94.9	Very high	92.2	Very high	95 Å²	95	52.7 Å²	52.7	41%	0.413	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-41.1	177	-177.2	176.7	173.3	-156.7	0	111.7	T34 D175 G176 L181 D182 E183	T34-K179 HydrophobicContact CG2-CB 3.98Å; T34-K179 HydrophobicContact CG2-CD 3.81Å; T34-K179 HydrophobicContact CG2-CG 4.05Å; T34-K179 WeakPolarHBondContact OG1-CD 3.46Å; T34-K179 VanDerWaalsContact OG1-CE 3.23Å; T34-K179 WeakPolarHBondContact OG1-CE 3.34Å; T34-K179 PolarHBondContact OG1-NZ 3.06Å; D175-K179 WeakPolarHBondContact O-CB 3.37Å; D175-K179 PolarHBondContact O-N 3.34Å; G176-K179 PolarHBondContact O-N 2.83Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-L181 PolarHBondContact O-N 3.31Å; K179-D182 PolarHBondContact O-N 3.44Å; K179-E183 WeakPolarHBondContact CE-OE1 3.49Å; K179-E183 WeakPolarHBondContact O-CB 3.37Å; K179-E183 VanDerWaalsContact O-CG 3.28Å; K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 2.95Å
180	M	91.3	Very high	91.9	Very high	22 Å²	22	53.7 Å²	53.7	11%	0.108	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-35.8	174.7	-67.4	172.3	73.3	0	0	112.7	T34 S35 V38 G176 V177 N178 G184 N185 L186	T34-M180 HydrophobicContact CG2-CG 3.81Å; S35-M180 WeakPolarHBondContact OG-CE 3.44Å; V38-M180 HydrophobicContact CG2-SD 4.14Å; G176-M180 VanDerWaalsContact O-CG 3.28Å; G176-M180 WeakPolarHBondContact O-CG 3.47Å; G176-M180 PolarHBondContact O-N 3.48Å; V177-M180 PolarHBondContact O-N 3.26Å; N178-M180 VanDerWaalsContact C-N 3.29Å; N178-M180 PolarHBondContact O-N 3.49Å; M180-G184 PolarHBondContact O-N 2.65Å; M180-N185 HydrophobicContact CB-CB 4.44Å; M180-N185 PolarHBondContact O-N 3.44Å; M180-L186 HydrophobicContact CB-CD1 3.55Å; M180-L186 HydrophobicContact CB-CG 3.98Å; M180-L186 HydrophobicContact CE-CD2 4.21Å; M180-L186 HydrophobicContact CE-CG 4.15Å
181	L	91.4	Very high	91.6	Very high	24 Å²	24	56.6 Å²	56.6	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-47.5	174.1	-74.4	163.7	0	0	0	111	A98 M99 V177 N178 K179 E183 G184 L186	A98-L181 HydrophobicContact CB-CD1 4.03Å; A98-L181 HydrophobicContact CB-CD2 3.95Å; A98-L181 HydrophobicContact CB-CG 4.16Å; M99-L181 HydrophobicContact CG-CD1 4.29Å; M99-L181 HydrophobicContact CG-CD2 4.33Å; M99-L181 HydrophobicContact SD-CD1 3.61Å; M99-L181 HydrophobicContact SD-CD2 4.23Å; M99-L181 HydrophobicContact SD-CG 4.48Å; V177-L181 HydrophobicContact CG1-CD1 4.2Å; V177-L181 WeakPolarHBondContact O-CG 3.34Å; V177-L181 PolarHBondContact O-N 3.49Å; N178-L181 WeakPolarHBondContact O-CB 3.15Å; N178-L181 PolarHBondContact O-N 3.48Å; N178-L181 VanDerWaalsContact O-N 3.07Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-L181 PolarHBondContact O-N 3.31Å; L181-E183 VanDerWaalsContact C-N 3.31Å; L181-E183 PolarHBondContact O-N 3.05Å; L181-G184 PolarHBondContact O-N 3.12Å; L181-G184 VanDerWaalsContact O-N 3.09Å; L181-L186 HydrophobicContact CD2-CB 4.25Å; L181-L186 HydrophobicContact CD2-CD1 3.97Å; L181-L186 HydrophobicContact CG-CD1 3.79Å
182	D	90.9	Very high	91.2	Very high	143 Å²	143	55 Å²	55	77%	0.765	29%	0.29	S	S	*	.	H	α-helix	trans	-62.8	-36.8	-180	-70.5	-22.4	0	0	0	112.3	N178 K179 G184	N178-D182 PolarHBondContact O-N 3.01Å; K179-D182 PolarHBondContact O-N 3.44Å; D182-G184 VanDerWaalsContact C-N 3.27Å; D182-G184 PolarHBondContact O-N 2.64Å
183	E	87.9	Confident	90.8	Very high	93 Å²	93	51 Å²	51	44%	0.435	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.4	177.4	-68.1	173.1	173.7	0	0	113.4	K179 L181 N185	K179-E183 WeakPolarHBondContact CE-OE1 3.49Å; K179-E183 WeakPolarHBondContact O-CB 3.37Å; K179-E183 VanDerWaalsContact O-CG 3.28Å; K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 2.95Å; L181-E183 VanDerWaalsContact C-N 3.31Å; L181-E183 PolarHBondContact O-N 3.05Å; E183-N185 VanDerWaalsContact C-N 3.28Å; E183-N185 VanDerWaalsContact CB-ND2 3.33Å; E183-N185 WeakPolarHBondContact CB-ND2 3.27Å; E183-N185 PolarHBondContact O-N 2.93Å; E183-N185 PolarHBondContact OE2-ND2 3.33Å
184	G	82.8	Confident	90.2	Very high	49 Å²	49	53.8 Å²	53.8	51%	0.505	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	23.6	-176.9	0	0	0	0	0	113.9	M180 L181 D182 L186	M180-G184 PolarHBondContact O-N 2.65Å; L181-G184 PolarHBondContact O-N 3.12Å; L181-G184 VanDerWaalsContact O-N 3.09Å; D182-G184 VanDerWaalsContact C-N 3.27Å; D182-G184 PolarHBondContact O-N 2.64Å; G184-L186 VanDerWaalsContact C-N 3.32Å
185	N	77.8	Confident	89.6	Confident	89 Å²	89	58.1 Å²	58.1	48%	0.476	32%	0.32	S	S	.	.			trans	-88.4	7.1	-177.2	-72.4	-31.8	0	0	0	113.5	M180 E183	M180-N185 HydrophobicContact CB-CB 4.44Å; M180-N185 PolarHBondContact O-N 3.44Å; E183-N185 VanDerWaalsContact C-N 3.28Å; E183-N185 VanDerWaalsContact CB-ND2 3.33Å; E183-N185 WeakPolarHBondContact CB-ND2 3.27Å; E183-N185 PolarHBondContact O-N 2.93Å; E183-N185 PolarHBondContact OE2-ND2 3.33Å
186	L	73.3	Confident	88.9	Confident	39 Å²	39	56.1 Å²	56.1	20%	0.204	31%	0.311	C	S	.	.			trans	-117.1	0	177.4	-80.4	161.1	0	0	0	113.8	R91 V94 A98 V177 M180 L181 G184	R91-L186 WeakPolarHBondContact CG-OXT 3.28Å; R91-L186 PolarHBondContact NE-O 3.48Å; R91-L186 PolarHBondContact NH2-O 2.67Å; V94-L186 HydrophobicContact CG1-CD2 3.77Å; A98-L186 HydrophobicContact CB-CD1 3.87Å; V177-L186 HydrophobicContact CG1-CD1 4.3Å; M180-L186 HydrophobicContact CB-CD1 3.55Å; M180-L186 HydrophobicContact CB-CG 3.98Å; M180-L186 HydrophobicContact CE-CD2 4.21Å; M180-L186 HydrophobicContact CE-CG 4.15Å; L181-L186 HydrophobicContact CD2-CB 4.25Å; L181-L186 HydrophobicContact CD2-CD1 3.97Å; L181-L186 HydrophobicContact CG-CD1 3.79Å; G184-L186 VanDerWaalsContact C-N 3.32Å

Retrieved 186 of 186 residues in 709.9 ms (Link to these results)

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