A0A077Z954_TRITR Loading...

dolichyl-diphosphooligosaccharide--protein glycotransferase

AlphaFold DB , UniProt , Accession A0A077Z954, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 487 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	67.2	Low	78.1	Confident	133 Å²	133	94.9 Å²	94.9	66%	0.655	49%	0.488	S	S	*	.				0	-51.9	0	-67.4	-175.2	179.7	0	0	112.7	N3 G4 F5	M1-N3 PolarHBondContact O-N 3.11Å; M1-G4 WeakPolarHBondContact O-CA 3.35Å; M1-G4 PolarHBondContact O-N 3.45Å; M1-F5 PolarHBondContact O-N 3.46Å
2	I	80	Confident	77.7	Confident	142 Å²	142	93.3 Å²	93.3	73%	0.728	48%	0.477	S	S	*	.	H	α-helix	trans	-56.1	-47	179.7	-67.3	160.7	0	0	0	113	G4 F5 A6	I2-G4 PolarHBondContact O-N 3.37Å; I2-F5 CarbonylContact O-C 3.55Å; I2-F5 WeakPolarHBondContact O-CB 3.44Å; I2-F5 PolarHBondContact O-N 2.81Å; I2-F5 VanDerWaalsContact O-N 3.09Å; I2-A6 WeakPolarHBondContact O-CB 3.09Å; I2-A6 PolarHBondContact O-N 3.37Å
3	N	82.6	Confident	77.8	Confident	140 Å²	140	92.6 Å²	92.6	75%	0.749	49%	0.486	S	S	*	.	H	α-helix	trans	-59.9	-36.3	177.2	-64.8	-11.3	0	0	0	112.5	M1 A6 A7	M1-N3 PolarHBondContact O-N 3.11Å; N3-A6 PolarHBondContact O-N 3.29Å; N3-A7 WeakPolarHBondContact O-CB 3.47Å; N3-A7 PolarHBondContact O-N 2.85Å
4	G	76.9	Confident	77.9	Confident	28 Å²	28	92.5 Å²	92.5	29%	0.289	49%	0.491	S	S	.	.	H	α-helix	trans	-64.4	-46.2	174.2	0	0	0	0	0	111.4	M1 I2 A6 A7 V8	M1-G4 WeakPolarHBondContact O-CA 3.35Å; M1-G4 PolarHBondContact O-N 3.45Å; I2-G4 PolarHBondContact O-N 3.37Å; G4-A6 PolarHBondContact O-N 3.5Å; G4-A7 PolarHBondContact O-N 3.23Å; G4-V8 VanDerWaalsContact O-CB 3.26Å; G4-V8 WeakPolarHBondContact O-CB 3.43Å; G4-V8 WeakPolarHBondContact O-CG2 3.33Å; G4-V8 PolarHBondContact O-N 2.92Å
5	F	78.6	Confident	77.2	Confident	91 Å²	91	91.1 Å²	91.1	40%	0.399	48%	0.483	S	S	.	.	H	α-helix	trans	-62	-40.8	174.8	-179.1	-100.1	0	0	0	112.7	M1 I2 V8 R9 L28	M1-F5 PolarHBondContact O-N 3.46Å; I2-F5 CarbonylContact O-C 3.55Å; I2-F5 WeakPolarHBondContact O-CB 3.44Å; I2-F5 PolarHBondContact O-N 2.81Å; I2-F5 VanDerWaalsContact O-N 3.09Å; F5-V8 PolarHBondContact O-N 3.18Å; F5-R9 HydrophobicContact CD1-CG 4.2Å; F5-R9 HydrophobicContact CE1-CG 3.77Å; F5-R9 HydrophobicContact CE2-CG 4.37Å; F5-R9 HydrophobicContact CZ-CG 3.88Å; F5-R9 WeakPolarHBondContact O-CB 3.46Å; F5-R9 WeakPolarHBondContact O-CG 3.38Å; F5-R9 PolarHBondContact O-N 3.43Å; F5-L28 HydrophobicContact CB-CD1 4.19Å; F5-L28 HydrophobicContact CD2-CD1 3.76Å; F5-L28 HydrophobicContact CD2-CD2 3.79Å; F5-L28 HydrophobicContact CD2-CG 4.44Å; F5-L28 HydrophobicContact CE2-CD2 4Å; F5-L28 HydrophobicContact CG-CD1 4.48Å
6	A	83.3	Confident	76	Confident	51 Å²	51	96.3 Å²	96.3	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-43.5	177.5	0	0	0	0	0	112	I2 N3 G4 V8 R9 Y10	I2-A6 WeakPolarHBondContact O-CB 3.09Å; I2-A6 PolarHBondContact O-N 3.37Å; N3-A6 PolarHBondContact O-N 3.29Å; G4-A6 PolarHBondContact O-N 3.5Å; A6-V8 VanDerWaalsContact C-N 3.35Å; A6-R9 PolarHBondContact O-N 2.8Å; A6-Y10 WeakPolarHBondContact O-CB 3.4Å; A6-Y10 PolarHBondContact O-N 2.94Å
7	A	80	Confident	75.5	Confident	50 Å²	50	98.7 Å²	98.7	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-42	175.1	0	0	0	0	0	111.7	N3 G4 Y10 L11	N3-A7 WeakPolarHBondContact O-CB 3.47Å; N3-A7 PolarHBondContact O-N 2.85Å; G4-A7 PolarHBondContact O-N 3.23Å; A7-Y10 PolarHBondContact O-N 3.14Å; A7-L11 WeakPolarHBondContact O-CB 3.37Å; A7-L11 VanDerWaalsContact O-CG 3.28Å; A7-L11 WeakPolarHBondContact O-CG 3.28Å; A7-L11 PolarHBondContact O-N 3.35Å
8	V	75.4	Confident	75	Confident	15 Å²	15	102.4 Å²	102.4	9%	0.091	53%	0.532	C	S	.	.	H	α-helix	trans	-60.7	-47.7	173.6	160.1	0	0	0	0	110.6	G4 F5 A6 Y10 L11 Q12 L24 L28	G4-V8 VanDerWaalsContact O-CB 3.26Å; G4-V8 WeakPolarHBondContact O-CB 3.43Å; G4-V8 WeakPolarHBondContact O-CG2 3.33Å; G4-V8 PolarHBondContact O-N 2.92Å; F5-V8 PolarHBondContact O-N 3.18Å; A6-V8 VanDerWaalsContact C-N 3.35Å; V8-Y10 VanDerWaalsContact C-N 3.35Å; V8-Y10 PolarHBondContact O-N 3.5Å; V8-L11 PolarHBondContact O-N 3.48Å; V8-Q12 WeakPolarHBondContact O-CB 3.43Å; V8-Q12 PolarHBondContact O-N 3.36Å; V8-L24 HydrophobicContact CB-CD2 4.35Å; V8-L24 HydrophobicContact CG1-CD1 4.47Å; V8-L24 HydrophobicContact CG1-CD2 3.2Å; V8-L24 HydrophobicContact CG1-CG 3.66Å; V8-L24 WeakPolarHBondContact O-CD1 3.33Å; V8-L28 HydrophobicContact CG1-CB 4.24Å; V8-L28 HydrophobicContact CG1-CD1 4.43Å
9	R	77.6	Confident	74.6	Confident	156 Å²	156	102.4 Å²	102.4	59%	0.589	54%	0.537	S	S	*	.	H	α-helix	trans	-62.1	-38.3	174.9	-86.2	-95.9	-175.5	152.5	-0.9	113	F5 A6 Q12 S13	F5-R9 HydrophobicContact CD1-CG 4.2Å; F5-R9 HydrophobicContact CE1-CG 3.77Å; F5-R9 HydrophobicContact CE2-CG 4.37Å; F5-R9 HydrophobicContact CZ-CG 3.88Å; F5-R9 WeakPolarHBondContact O-CB 3.46Å; F5-R9 WeakPolarHBondContact O-CG 3.38Å; F5-R9 PolarHBondContact O-N 3.43Å; A6-R9 PolarHBondContact O-N 2.8Å; R9-Q12 WeakPolarHBondContact O-CB 3.42Å; R9-Q12 PolarHBondContact O-N 3.49Å; R9-S13 PolarHBondContact O-N 3.17Å; R9-S13 VanDerWaalsContact O-N 3.08Å
10	Y	81.7	Confident	74.4	Confident	158 Å²	158	100.1 Å²	100.1	62%	0.62	52%	0.522	S	S	*	.	H	α-helix	trans	-68	-43.8	176.1	177.4	-101.1	0	0	0	111.7	A6 A7 V8 Q12 S13 V14	A6-Y10 WeakPolarHBondContact O-CB 3.4Å; A6-Y10 PolarHBondContact O-N 2.94Å; A7-Y10 PolarHBondContact O-N 3.14Å; V8-Y10 VanDerWaalsContact C-N 3.35Å; V8-Y10 PolarHBondContact O-N 3.5Å; Y10-Q12 PolarHBondContact O-N 3.08Å; Y10-S13 PolarHBondContact O-N 2.85Å; Y10-S13 PolarHBondContact O-OG 2.92Å; Y10-V14 HydrophobicContact CE1-CG2 4.24Å; Y10-V14 HydrophobicContact CE2-CG2 4.39Å; Y10-V14 WeakPolarHBondContact O-CG2 3.34Å; Y10-V14 PolarHBondContact O-N 3.46Å
11	L	75.8	Confident	74.2	Confident	80 Å²	80	100.2 Å²	100.2	42%	0.419	52%	0.52	S	S	.	.	H	α-helix	trans	-62.9	-34.9	172.9	-71.7	169.1	0	0	0	111.4	A7 V8 S13 V14 L15 L24	A7-L11 WeakPolarHBondContact O-CB 3.37Å; A7-L11 VanDerWaalsContact O-CG 3.28Å; A7-L11 WeakPolarHBondContact O-CG 3.28Å; A7-L11 PolarHBondContact O-N 3.35Å; V8-L11 PolarHBondContact O-N 3.48Å; L11-S13 VanDerWaalsContact C-N 3.34Å; L11-S13 PolarHBondContact O-N 2.86Å; L11-V14 PolarHBondContact O-N 3.37Å; L11-L15 HydrophobicContact CD2-CD1 4.26Å; L11-L15 VanDerWaalsContact O-CD1 3.24Å; L11-L15 WeakPolarHBondContact O-CD1 3.24Å; L11-L15 PolarHBondContact O-N 2.99Å; L11-L24 HydrophobicContact CB-CD1 3.99Å
12	Q	73.6	Confident	74.5	Confident	75 Å²	75	103.9 Å²	103.9	35%	0.35	53%	0.527	S	S	.	.	H	α-helix	trans	-65.1	-34.3	174.9	-169.5	-178	-2.9	0	0	112.7	V8 R9 Y10 L24	V8-Q12 WeakPolarHBondContact O-CB 3.43Å; V8-Q12 PolarHBondContact O-N 3.36Å; R9-Q12 WeakPolarHBondContact O-CB 3.42Å; R9-Q12 PolarHBondContact O-N 3.49Å; Y10-Q12 PolarHBondContact O-N 3.08Å; Q12-L24 HydrophobicContact CB-CD1 4.05Å; Q12-L24 HydrophobicContact CB-CD2 3.87Å; Q12-L24 HydrophobicContact CG-CD2 4.22Å
13	S	78.3	Confident	74.4	Confident	85 Å²	85	101.4 Å²	101.4	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-76.5	-28.1	177.2	66.1	0	0	0	0	112.8	R9 Y10 L11	R9-S13 PolarHBondContact O-N 3.17Å; R9-S13 VanDerWaalsContact O-N 3.08Å; Y10-S13 PolarHBondContact O-N 2.85Å; Y10-S13 PolarHBondContact O-OG 2.92Å; L11-S13 VanDerWaalsContact C-N 3.34Å; L11-S13 PolarHBondContact O-N 2.86Å
14	V	79.3	Confident	73.9	Confident	91 Å²	91	95.2 Å²	95.2	55%	0.552	48%	0.481	S	S	*	.	H	α-helix	trans	-83.1	-31.7	179.2	177.3	0	0	0	0	112.3	Y10 L11	Y10-V14 HydrophobicContact CE1-CG2 4.24Å; Y10-V14 HydrophobicContact CE2-CG2 4.39Å; Y10-V14 WeakPolarHBondContact O-CG2 3.34Å; Y10-V14 PolarHBondContact O-N 3.46Å; L11-V14 PolarHBondContact O-N 3.37Å
15	L	67.4	Low	74	Confident	72 Å²	72	101.3 Å²	101.3	38%	0.377	50%	0.496	S	S	.	.			trans	-107	103.6	-176.9	-72.4	100	0	0	0	112.8	L11 Q17 F20	L11-L15 HydrophobicContact CD2-CD1 4.26Å; L11-L15 VanDerWaalsContact O-CD1 3.24Å; L11-L15 WeakPolarHBondContact O-CD1 3.24Å; L11-L15 PolarHBondContact O-N 2.99Å; L15-Q17 PolarHBondContact O-N 3.17Å; L15-Q17 VanDerWaalsContact O-N 3.14Å; L15-F20 HydrophobicContact CB-CD1 3.74Å; L15-F20 HydrophobicContact CB-CE1 4Å; L15-F20 HydrophobicContact CB-CG 4.41Å; L15-F20 HydrophobicContact CD1-CE1 4.09Å; L15-F20 HydrophobicContact CD2-CD1 4.21Å; L15-F20 HydrophobicContact CD2-CE1 4.02Å; L15-F20 HydrophobicContact CD2-CE2 4.36Å; L15-F20 HydrophobicContact CD2-CG 4.45Å; L15-F20 HydrophobicContact CD2-CZ 4.11Å; L15-F20 HydrophobicContact CG-CD1 4.42Å; L15-F20 HydrophobicContact CG-CE1 4.26Å
16	L	58.9	Low	74.2	Confident	173 Å²	173	98.8 Å²	98.8	91%	0.906	50%	0.495	S	S	*	.			trans	-84.6	44.4	-171	-147.7	99.6	0	0	0	115.5
17	Q	66.3	Low	74.1	Confident	138 Å²	138	100.3 Å²	100.3	65%	0.645	50%	0.496	S	S	*	.			trans	-130	125.6	-179.3	-70.8	-172.5	-12	0	0	113.5	L15 T19 F20 Q21	L15-Q17 PolarHBondContact O-N 3.17Å; L15-Q17 VanDerWaalsContact O-N 3.14Å; Q17-T19 PolarHBondContact O-N 3.47Å; Q17-T19 VanDerWaalsContact O-N 3.11Å; Q17-F20 WeakPolarHBondContact O-CA 3.35Å; Q17-F20 WeakPolarHBondContact O-CB 3.2Å; Q17-F20 PolarHBondContact O-N 3.42Å; Q17-Q21 PolarHBondContact O-N 3.3Å
18	Q	67	Low	74.1	Confident	165 Å²	165	99.5 Å²	99.5	77%	0.771	48%	0.484	S	S	*	.	H	α-helix	trans	-52.1	-32.5	178.7	-71.3	177	-15.6	0	0	113.4	F20 Q21	Q18-F20 VanDerWaalsContact C-N 3.32Å; Q18-F20 PolarHBondContact O-N 2.86Å; Q18-Q21 PolarHBondContact O-N 2.84Å
19	T	66.6	Low	74.6	Confident	103 Å²	103	101.4 Å²	101.4	63%	0.632	50%	0.496	S	S	*	.	H	α-helix	trans	-64.4	-38.8	175	-34.3	0	0	0	0	111.7	Q17 R22 I23	Q17-T19 PolarHBondContact O-N 3.47Å; Q17-T19 VanDerWaalsContact O-N 3.11Å; T19-R22 PolarHBondContact O-N 3.42Å; T19-I23 PolarHBondContact O-N 2.76Å
20	F	70.8	Confident	75	Confident	56 Å²	56	96.9 Å²	96.9	25%	0.246	49%	0.492	C	S	.	.	H	α-helix	trans	-72.5	-28.8	179.8	-161.4	-108.9	0	0	0	111.9	L15 Q17 Q18 R22 I23 L24	L15-F20 HydrophobicContact CB-CD1 3.74Å; L15-F20 HydrophobicContact CB-CE1 4Å; L15-F20 HydrophobicContact CB-CG 4.41Å; L15-F20 HydrophobicContact CD1-CE1 4.09Å; L15-F20 HydrophobicContact CD2-CD1 4.21Å; L15-F20 HydrophobicContact CD2-CE1 4.02Å; L15-F20 HydrophobicContact CD2-CE2 4.36Å; L15-F20 HydrophobicContact CD2-CG 4.45Å; L15-F20 HydrophobicContact CD2-CZ 4.11Å; L15-F20 HydrophobicContact CG-CD1 4.42Å; L15-F20 HydrophobicContact CG-CE1 4.26Å; Q17-F20 WeakPolarHBondContact O-CA 3.35Å; Q17-F20 WeakPolarHBondContact O-CB 3.2Å; Q17-F20 PolarHBondContact O-N 3.42Å; Q18-F20 VanDerWaalsContact C-N 3.32Å; Q18-F20 PolarHBondContact O-N 2.86Å; F20-R22 VanDerWaalsContact C-N 3.32Å; F20-R22 PolarHBondContact O-N 3.43Å; F20-I23 PolarHBondContact O-N 2.68Å; F20-L24 HydrophobicContact CD1-CB 4.44Å; F20-L24 HydrophobicContact CD1-CD1 3.92Å; F20-L24 HydrophobicContact CE1-CB 4.49Å; F20-L24 HydrophobicContact CE1-CD1 3.51Å; F20-L24 HydrophobicContact CZ-CD1 4.42Å; F20-L24 WeakPolarHBondContact O-CB 3.41Å; F20-L24 PolarHBondContact O-N 2.85Å
21	Q	70.3	Confident	75.1	Confident	103 Å²	103	92.8 Å²	92.8	48%	0.481	48%	0.483	S	S	.	.	H	α-helix	trans	-59.1	-40.8	174.5	-66.9	-175.5	-16.9	0	0	112.6	Q17 Q18 L24 Y25	Q17-Q21 PolarHBondContact O-N 3.3Å; Q18-Q21 PolarHBondContact O-N 2.84Å; Q21-L24 PolarHBondContact O-N 3.21Å; Q21-Y25 WeakPolarHBondContact O-CB 3.29Å; Q21-Y25 PolarHBondContact O-N 2.91Å
22	R	74.3	Confident	75.6	Confident	210 Å²	210	92 Å²	92	79%	0.792	48%	0.482	S	S	*	.	H	α-helix	trans	-67.5	-42.7	176.3	-67.8	-174.8	-177.3	176.6	1.3	111.9	T19 F20 L24 Y25 G26	T19-R22 PolarHBondContact O-N 3.42Å; F20-R22 VanDerWaalsContact C-N 3.32Å; F20-R22 PolarHBondContact O-N 3.43Å; R22-L24 VanDerWaalsContact C-N 3.3Å; R22-L24 PolarHBondContact O-N 2.94Å; R22-Y25 PolarHBondContact O-N 3.22Å; R22-G26 PolarHBondContact O-N 3.42Å
23	I	77	Confident	76.3	Confident	90 Å²	90	92.7 Å²	92.7	46%	0.462	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-43.4	176.6	-65.7	171.7	0	0	0	110.1	T19 F20 G26 I27	T19-I23 PolarHBondContact O-N 2.76Å; F20-I23 PolarHBondContact O-N 2.68Å; I23-G26 CarbonylContact O-C 3.51Å; I23-G26 WeakPolarHBondContact O-CA 3.16Å; I23-G26 PolarHBondContact O-N 3.41Å; I23-I27 HydrophobicContact CG2-CD1 3.86Å; I23-I27 HydrophobicContact CG2-CG1 4.43Å; I23-I27 WeakPolarHBondContact O-CG1 3.5Å; I23-I27 PolarHBondContact O-N 3.48Å
24	L	73.7	Confident	76.8	Confident	9 Å²	9	90.4 Å²	90.4	5%	0.047	48%	0.478	C	S	.	.	H	α-helix	trans	-70.6	-37.9	-176.8	-170.3	134.8	0	0	0	112.3	V8 L11 Q12 F20 Q21 R22 I27 L28	V8-L24 HydrophobicContact CB-CD2 4.35Å; V8-L24 HydrophobicContact CG1-CD1 4.47Å; V8-L24 HydrophobicContact CG1-CD2 3.2Å; V8-L24 HydrophobicContact CG1-CG 3.66Å; V8-L24 WeakPolarHBondContact O-CD1 3.33Å; L11-L24 HydrophobicContact CB-CD1 3.99Å; Q12-L24 HydrophobicContact CB-CD1 4.05Å; Q12-L24 HydrophobicContact CB-CD2 3.87Å; Q12-L24 HydrophobicContact CG-CD2 4.22Å; F20-L24 HydrophobicContact CD1-CB 4.44Å; F20-L24 HydrophobicContact CD1-CD1 3.92Å; F20-L24 HydrophobicContact CE1-CB 4.49Å; F20-L24 HydrophobicContact CE1-CD1 3.51Å; F20-L24 HydrophobicContact CZ-CD1 4.42Å; F20-L24 WeakPolarHBondContact O-CB 3.41Å; F20-L24 PolarHBondContact O-N 2.85Å; Q21-L24 PolarHBondContact O-N 3.21Å; R22-L24 VanDerWaalsContact C-N 3.3Å; R22-L24 PolarHBondContact O-N 2.94Å; L24-I27 PolarHBondContact O-N 2.82Å; L24-L28 WeakPolarHBondContact O-CB 3.44Å; L24-L28 PolarHBondContact O-N 2.79Å
25	Y	78.7	Confident	77.2	Confident	157 Å²	157	87.2 Å²	87.2	62%	0.616	46%	0.463	S	S	*	.	H	α-helix	trans	-63.7	-41.5	167.8	-175.1	-96.8	0	0	0	111.8	Q21 R22 L28 V29	Q21-Y25 WeakPolarHBondContact O-CB 3.29Å; Q21-Y25 PolarHBondContact O-N 2.91Å; R22-Y25 PolarHBondContact O-N 3.22Å; Y25-L28 WeakPolarHBondContact O-CB 3.35Å; Y25-L28 PolarHBondContact O-N 2.94Å; Y25-V29 HydrophobicContact CD1-CG2 4.13Å; Y25-V29 HydrophobicContact CE1-CG2 3.73Å; Y25-V29 HydrophobicContact CE2-CG2 4.5Å; Y25-V29 WeakPolarHBondContact O-CG2 3.07Å; Y25-V29 PolarHBondContact O-N 3.44Å
26	G	82.2	Confident	78.2	Confident	37 Å²	37	89.3 Å²	89.3	38%	0.381	47%	0.469	S	S	.	.	H	α-helix	trans	-59.9	-44.3	173.8	0	0	0	0	0	112.8	R22 I23 L28 V29 A30	R22-G26 PolarHBondContact O-N 3.42Å; I23-G26 CarbonylContact O-C 3.51Å; I23-G26 WeakPolarHBondContact O-CA 3.16Å; I23-G26 PolarHBondContact O-N 3.41Å; G26-L28 VanDerWaalsContact C-N 3.34Å; G26-V29 PolarHBondContact O-N 3.34Å; G26-A30 WeakPolarHBondContact O-CB 3.26Å; G26-A30 PolarHBondContact O-N 2.83Å
27	I	82	Confident	79.7	Confident	83 Å²	83	87.3 Å²	87.3	43%	0.426	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-40.8	174.7	-69.6	167.2	0	0	0	110.6	I23 L24 A30 T31	I23-I27 HydrophobicContact CG2-CD1 3.86Å; I23-I27 HydrophobicContact CG2-CG1 4.43Å; I23-I27 WeakPolarHBondContact O-CG1 3.5Å; I23-I27 PolarHBondContact O-N 3.48Å; L24-I27 PolarHBondContact O-N 2.82Å; I27-A30 PolarHBondContact O-N 3.18Å; I27-T31 VanDerWaalsContact O-CB 3.29Å; I27-T31 WeakPolarHBondContact O-CB 3.49Å; I27-T31 PolarHBondContact O-N 2.84Å; I27-T31 PolarHBondContact O-OG1 2.87Å
28	L	80.2	Confident	80.8	Confident	33 Å²	33	82.9 Å²	82.9	17%	0.173	44%	0.44	C	S	.	.	H	α-helix	trans	-61	-51.4	176.9	179.7	66.7	0	0	0	111.2	F5 V8 L24 Y25 G26 A30 T31 V32	F5-L28 HydrophobicContact CB-CD1 4.19Å; F5-L28 HydrophobicContact CD2-CD1 3.76Å; F5-L28 HydrophobicContact CD2-CD2 3.79Å; F5-L28 HydrophobicContact CD2-CG 4.44Å; F5-L28 HydrophobicContact CE2-CD2 4Å; F5-L28 HydrophobicContact CG-CD1 4.48Å; V8-L28 HydrophobicContact CG1-CB 4.24Å; V8-L28 HydrophobicContact CG1-CD1 4.43Å; L24-L28 WeakPolarHBondContact O-CB 3.44Å; L24-L28 PolarHBondContact O-N 2.79Å; Y25-L28 WeakPolarHBondContact O-CB 3.35Å; Y25-L28 PolarHBondContact O-N 2.94Å; G26-L28 VanDerWaalsContact C-N 3.34Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.42Å; L28-T31 PolarHBondContact O-N 2.84Å; L28-V32 HydrophobicContact CD1-CG2 4.49Å; L28-V32 WeakPolarHBondContact O-CG2 3.38Å; L28-V32 PolarHBondContact O-N 3.31Å
29	V	85.2	Confident	81.9	Confident	55 Å²	55	79.1 Å²	79.1	33%	0.333	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-43.7	178	174	0	0	0	0	110.5	Y25 G26 T31 V32 L33	Y25-V29 HydrophobicContact CD1-CG2 4.13Å; Y25-V29 HydrophobicContact CE1-CG2 3.73Å; Y25-V29 HydrophobicContact CE2-CG2 4.5Å; Y25-V29 WeakPolarHBondContact O-CG2 3.07Å; Y25-V29 PolarHBondContact O-N 3.44Å; G26-V29 PolarHBondContact O-N 3.34Å; V29-T31 VanDerWaalsContact C-N 3.32Å; V29-T31 PolarHBondContact O-N 3.32Å; V29-V32 PolarHBondContact O-N 2.92Å; V29-L33 HydrophobicContact CG1-CD1 3.72Å; V29-L33 HydrophobicContact CG1-CG 4.23Å; V29-L33 WeakPolarHBondContact O-CB 3.36Å; V29-L33 WeakPolarHBondContact O-CG 3.35Å; V29-L33 PolarHBondContact O-N 2.84Å
30	A	85.6	Confident	83	Confident	61 Å²	61	77.7 Å²	77.7	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-35.9	176.3	0	0	0	0	0	112.6	G26 I27 L28 G34	G26-A30 WeakPolarHBondContact O-CB 3.26Å; G26-A30 PolarHBondContact O-N 2.83Å; I27-A30 PolarHBondContact O-N 3.18Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.42Å; A30-G34 WeakPolarHBondContact O-CA 3.49Å; A30-G34 PolarHBondContact O-N 3.38Å
31	T	84.2	Confident	84	Confident	72 Å²	72	83 Å²	83	44%	0.442	44%	0.435	S	S	.	.	H	α-helix	trans	-72.6	-38.2	177.1	-55.3	0	0	0	0	111.3	I27 L28 V29 G35	I27-T31 VanDerWaalsContact O-CB 3.29Å; I27-T31 WeakPolarHBondContact O-CB 3.49Å; I27-T31 PolarHBondContact O-N 2.84Å; I27-T31 PolarHBondContact O-OG1 2.87Å; L28-T31 PolarHBondContact O-N 2.84Å; V29-T31 VanDerWaalsContact C-N 3.32Å; V29-T31 PolarHBondContact O-N 3.32Å; T31-G35 WeakPolarHBondContact O-CA 3.48Å; T31-G35 PolarHBondContact O-N 3.39Å
32	V	85.8	Confident	85.1	Confident	65 Å²	65	81.3 Å²	81.3	39%	0.394	43%	0.429	S	S	.	.	H	α-helix	trans	-68.5	-49	176.4	172.3	0	0	0	0	110.6	L28 V29 G35 F36	L28-V32 HydrophobicContact CD1-CG2 4.49Å; L28-V32 WeakPolarHBondContact O-CG2 3.38Å; L28-V32 PolarHBondContact O-N 3.31Å; V29-V32 PolarHBondContact O-N 2.92Å; V32-G35 PolarHBondContact O-N 3.43Å; V32-F36 WeakPolarHBondContact O-CB 3.36Å; V32-F36 PolarHBondContact O-N 3.09Å
33	L	88.2	Confident	85.9	Confident	88 Å²	88	73.7 Å²	73.7	46%	0.461	41%	0.406	S	S	.	.	H	α-helix	trans	-64.7	-46	176.6	-70.3	175.8	0	0	0	111.3	V29 G35 F36 F37	V29-L33 HydrophobicContact CG1-CD1 3.72Å; V29-L33 HydrophobicContact CG1-CG 4.23Å; V29-L33 WeakPolarHBondContact O-CB 3.36Å; V29-L33 WeakPolarHBondContact O-CG 3.35Å; V29-L33 PolarHBondContact O-N 2.84Å; L33-G35 VanDerWaalsContact C-N 3.32Å; L33-G35 PolarHBondContact O-N 3Å; L33-F36 WeakPolarHBondContact O-CB 3.16Å; L33-F36 PolarHBondContact O-N 3.28Å; L33-F37 HydrophobicContact CB-CD2 4.38Å; L33-F37 HydrophobicContact CB-CE2 4.33Å; L33-F37 WeakPolarHBondContact O-CD2 3.2Å; L33-F37 PolarHBondContact O-N 3.07Å
34	G	89	Confident	86.5	Confident	38 Å²	38	79.3 Å²	79.3	39%	0.392	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-41.1	176	0	0	0	0	0	112.1	A30 A38	A30-G34 WeakPolarHBondContact O-CA 3.49Å; A30-G34 PolarHBondContact O-N 3.38Å; G34-A38 WeakPolarHBondContact O-CB 3.47Å; G34-A38 PolarHBondContact O-N 2.82Å
35	G	86.9	Confident	87.4	Confident	24 Å²	24	81.6 Å²	81.6	25%	0.247	44%	0.443	C	S	.	.	H	α-helix	trans	-64.3	-41.8	173.3	0	0	0	0	0	112.8	T31 V32 L33 A38 I39	T31-G35 WeakPolarHBondContact O-CA 3.48Å; T31-G35 PolarHBondContact O-N 3.39Å; V32-G35 PolarHBondContact O-N 3.43Å; L33-G35 VanDerWaalsContact C-N 3.32Å; L33-G35 PolarHBondContact O-N 3Å; G35-A38 PolarHBondContact O-N 3.21Å; G35-I39 VanDerWaalsContact O-CG1 3.28Å; G35-I39 WeakPolarHBondContact O-CG1 3.49Å; G35-I39 PolarHBondContact O-N 2.85Å
36	F	88.7	Confident	87.9	Confident	116 Å²	116	76.9 Å²	76.9	51%	0.509	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-50.8	175.4	177.7	-98.7	0	0	0	111.7	V32 L33 A38 I39 V40	V32-F36 WeakPolarHBondContact O-CB 3.36Å; V32-F36 PolarHBondContact O-N 3.09Å; L33-F36 WeakPolarHBondContact O-CB 3.16Å; L33-F36 PolarHBondContact O-N 3.28Å; F36-A38 VanDerWaalsContact C-N 3.3Å; F36-A38 PolarHBondContact O-N 2.94Å; F36-I39 PolarHBondContact O-N 3.2Å; F36-V40 HydrophobicContact CD1-CG2 4.31Å; F36-V40 HydrophobicContact CE1-CG2 3.93Å; F36-V40 HydrophobicContact CE2-CG2 4.3Å; F36-V40 HydrophobicContact CZ-CG2 3.93Å; F36-V40 WeakPolarHBondContact O-CG2 3.41Å; F36-V40 PolarHBondContact O-N 3.4Å
37	F	91.1	Very high	88.3	Confident	130 Å²	130	80.3 Å²	80.3	57%	0.57	46%	0.455	S	S	*	.	H	α-helix	trans	-63.9	-35	177.1	-73.9	-63.4	0	0	0	112.4	L33 V40 Y41	L33-F37 HydrophobicContact CB-CD2 4.38Å; L33-F37 HydrophobicContact CB-CE2 4.33Å; L33-F37 WeakPolarHBondContact O-CD2 3.2Å; L33-F37 PolarHBondContact O-N 3.07Å; F37-V40 PolarHBondContact O-N 3.44Å; F37-Y41 WeakPolarHBondContact O-CB 3.28Å; F37-Y41 PolarHBondContact O-N 3.45Å
38	A	89.4	Confident	88.6	Confident	45 Å²	45	79.6 Å²	79.6	37%	0.372	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-43.6	173.8	0	0	0	0	0	111.6	G34 G35 F36 Y41 L42	G34-A38 WeakPolarHBondContact O-CB 3.47Å; G34-A38 PolarHBondContact O-N 2.82Å; G35-A38 PolarHBondContact O-N 3.21Å; F36-A38 VanDerWaalsContact C-N 3.3Å; F36-A38 PolarHBondContact O-N 2.94Å; A38-Y41 PolarHBondContact O-N 3Å; A38-L42 VanDerWaalsContact O-CB 3.28Å; A38-L42 WeakPolarHBondContact O-CB 3.28Å; A38-L42 WeakPolarHBondContact O-CD1 3.17Å; A38-L42 WeakPolarHBondContact O-CG 3.5Å; A38-L42 PolarHBondContact O-N 3.12Å
39	I	90.1	Very high	89	Confident	87 Å²	87	82 Å²	82	45%	0.446	48%	0.476	S	S	.	.	H	α-helix	trans	-63.1	-48.4	175.7	-67.8	164	0	0	0	110.1	G35 F36 Y41 L42 T43	G35-I39 VanDerWaalsContact O-CG1 3.28Å; G35-I39 WeakPolarHBondContact O-CG1 3.49Å; G35-I39 PolarHBondContact O-N 2.85Å; F36-I39 PolarHBondContact O-N 3.2Å; I39-Y41 VanDerWaalsContact C-N 3.32Å; I39-Y41 PolarHBondContact O-N 3.45Å; I39-L42 PolarHBondContact O-N 3.39Å; I39-T43 WeakPolarHBondContact O-CB 3.43Å; I39-T43 PolarHBondContact O-N 3.27Å; I39-T43 PolarHBondContact O-OG1 2.81Å
40	V	90.5	Very high	89.2	Confident	72 Å²	72	84.3 Å²	84.3	44%	0.436	49%	0.492	S	S	.	.	H	α-helix	trans	-59	-44.4	178.4	173.3	0	0	0	0	111.2	F36 F37 T43 Y44	F36-V40 HydrophobicContact CD1-CG2 4.31Å; F36-V40 HydrophobicContact CE1-CG2 3.93Å; F36-V40 HydrophobicContact CE2-CG2 4.3Å; F36-V40 HydrophobicContact CZ-CG2 3.93Å; F36-V40 WeakPolarHBondContact O-CG2 3.41Å; F36-V40 PolarHBondContact O-N 3.4Å; F37-V40 PolarHBondContact O-N 3.44Å; V40-T43 PolarHBondContact O-N 2.82Å; V40-Y44 WeakPolarHBondContact O-CB 3.3Å; V40-Y44 PolarHBondContact O-N 3.39Å
41	Y	91.7	Very high	89.3	Confident	167 Å²	167	91.1 Å²	91.1	66%	0.655	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-43	177	-178.8	-97.3	0	0	0	112	F37 A38 I39 T43 Y44 A45	F37-Y41 WeakPolarHBondContact O-CB 3.28Å; F37-Y41 PolarHBondContact O-N 3.45Å; A38-Y41 PolarHBondContact O-N 3Å; I39-Y41 VanDerWaalsContact C-N 3.32Å; I39-Y41 PolarHBondContact O-N 3.45Å; Y41-T43 VanDerWaalsContact C-N 3.35Å; Y41-Y44 PolarHBondContact O-N 3.11Å; Y41-A45 WeakPolarHBondContact O-CB 3.45Å; Y41-A45 PolarHBondContact O-N 3.45Å
42	L	92.1	Very high	89.4	Confident	68 Å²	68	90.6 Å²	90.6	36%	0.356	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-35.4	177.5	-74.9	169.3	0	0	0	112.6	A38 I39 G46 V47 I48	A38-L42 VanDerWaalsContact O-CB 3.28Å; A38-L42 WeakPolarHBondContact O-CB 3.28Å; A38-L42 WeakPolarHBondContact O-CD1 3.17Å; A38-L42 WeakPolarHBondContact O-CG 3.5Å; A38-L42 PolarHBondContact O-N 3.12Å; I39-L42 PolarHBondContact O-N 3.39Å; L42-G46 PolarHBondContact O-N 3.03Å; L42-V47 HydrophobicContact CD2-CB 4.17Å; L42-V47 HydrophobicContact CD2-CG1 4.37Å; L42-V47 HydrophobicContact CD2-CG2 4.28Å; L42-V47 PolarHBondContact O-N 3.25Å; L42-I48 HydrophobicContact CB-CD1 3.71Å; L42-I48 HydrophobicContact CB-CG1 4.07Å; L42-I48 HydrophobicContact CD1-CD1 4.22Å; L42-I48 PolarHBondContact O-N 3.18Å
43	T	91.2	Very high	89.3	Confident	50 Å²	50	88.5 Å²	88.5	31%	0.307	50%	0.496	S	S	.	.	H	α-helix	trans	-68.6	-43.8	173.2	-58.1	0	0	0	0	110.7	I39 V40 Y41 A45 G46	I39-T43 WeakPolarHBondContact O-CB 3.43Å; I39-T43 PolarHBondContact O-N 3.27Å; I39-T43 PolarHBondContact O-OG1 2.81Å; V40-T43 PolarHBondContact O-N 2.82Å; Y41-T43 VanDerWaalsContact C-N 3.35Å; T43-A45 VanDerWaalsContact C-N 3.35Å; T43-A45 PolarHBondContact O-N 3.42Å; T43-G46 PolarHBondContact O-N 2.94Å; T43-G46 VanDerWaalsContact O-N 3.11Å
44	Y	90.8	Very high	89.1	Confident	209 Å²	209	90.5 Å²	90.5	82%	0.82	50%	0.498	S	S	*	.	H	α-helix	trans	-66.2	-36.6	176.2	-173.7	-99.1	0	0	0	112.6	V40 Y41 G46	V40-Y44 WeakPolarHBondContact O-CB 3.3Å; V40-Y44 PolarHBondContact O-N 3.39Å; Y41-Y44 PolarHBondContact O-N 3.11Å; Y44-G46 PolarHBondContact O-N 3.45Å
45	A	91.1	Very high	89.1	Confident	56 Å²	56	95 Å²	95	46%	0.463	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.5	174.2	0	0	0	0	0	113.4	Y41 T43 V47	Y41-A45 WeakPolarHBondContact O-CB 3.45Å; Y41-A45 PolarHBondContact O-N 3.45Å; T43-A45 VanDerWaalsContact C-N 3.35Å; T43-A45 PolarHBondContact O-N 3.42Å; A45-V47 VanDerWaalsContact C-N 3.27Å; A45-V47 HydrophobicContact CB-CG2 4.41Å; A45-V47 PolarHBondContact O-N 2.89Å
46	G	90.4	Very high	89.2	Confident	58 Å²	58	98 Å²	98	60%	0.598	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	7.1	177.7	0	0	0	0	0	115.1	L42 T43 Y44	L42-G46 PolarHBondContact O-N 3.03Å; T43-G46 PolarHBondContact O-N 2.94Å; T43-G46 VanDerWaalsContact O-N 3.11Å; Y44-G46 PolarHBondContact O-N 3.45Å
47	V	90.3	Very high	89.2	Confident	109 Å²	109	93 Å²	93	66%	0.661	49%	0.491	S	S	*	.	S	Bend	trans	-72	-36.8	175.5	-178.3	0	0	0	0	110.4	L42 A45	L42-V47 HydrophobicContact CD2-CB 4.17Å; L42-V47 HydrophobicContact CD2-CG1 4.37Å; L42-V47 HydrophobicContact CD2-CG2 4.28Å; L42-V47 PolarHBondContact O-N 3.25Å; A45-V47 VanDerWaalsContact C-N 3.27Å; A45-V47 HydrophobicContact CB-CG2 4.41Å; A45-V47 PolarHBondContact O-N 2.89Å
48	I	88.9	Confident	89	Confident	69 Å²	69	88 Å²	88	35%	0.354	47%	0.47	S	S	.	.	S	Bend	trans	-104.1	120.2	173	-60.6	173.5	0	0	0	107.7	L42	L42-I48 HydrophobicContact CB-CD1 3.71Å; L42-I48 HydrophobicContact CB-CG1 4.07Å; L42-I48 HydrophobicContact CD1-CD1 4.22Å; L42-I48 PolarHBondContact O-N 3.18Å
49	A	88.4	Confident	89.1	Confident	82 Å²	82	95.5 Å²	95.5	68%	0.678	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-58.7	142	176.9	0	0	0	0	0	111.2
50	P	89.6	Confident	89	Confident	104 Å²	104	94 Å²	94	68%	0.675	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-65.8	168.5	174.7	29.7	-35.5	0	0	0	111.3	S52	P50-S52 PolarHBondContact O-N 3.21Å
51	W	87.3	Confident	88.6	Confident	204 Å²	204	95.3 Å²	95.3	77%	0.773	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-53.8	136.3	174.6	-64.3	95.6	0	0	0	111	F55	W51-F55 HydrophobicContact CE3-CB 4.19Å
52	S	87	Confident	88.3	Confident	62 Å²	62	93 Å²	93	43%	0.434	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-65.4	149.5	174.3	77.7	0	0	0	0	110.1	P50 R54 F55 Y56	P50-S52 PolarHBondContact O-N 3.21Å; S52-R54 PolarHBondContact O-N 3.35Å; S52-R54 VanDerWaalsContact O-N 3.07Å; S52-F55 PolarHBondContact O-N 3.44Å; S52-F55 WeakPolarHBondContact OG-CD2 3.41Å; S52-Y56 PolarHBondContact O-N 2.74Å
53	G	82.4	Confident	88.1	Confident	21 Å²	21	93.3 Å²	93.3	22%	0.216	48%	0.482	C	S	.	.	H	α-helix	trans	-54.5	-32.4	-177.2	0	0	0	0	0	113.8	Y56 S57	G53-Y56 PolarHBondContact O-N 3.25Å; G53-S57 WeakPolarHBondContact O-CB 3.25Å; G53-S57 PolarHBondContact O-N 3.32Å; G53-S57 PolarHBondContact O-OG 3.4Å
54	R	84.1	Confident	87.6	Confident	129 Å²	129	91.3 Å²	91.3	49%	0.487	47%	0.47	S	S	.	.	H	α-helix	trans	-67.8	-34	176.8	-67.8	-174.6	-178.7	177.8	2.3	113.6	S52 S57 I71 N305 T306	S52-R54 PolarHBondContact O-N 3.35Å; S52-R54 VanDerWaalsContact O-N 3.07Å; R54-S57 PolarHBondContact O-OG 3.35Å; R54-I71 HydrophobicContact CG-CD1 3.87Å; R54-I71 HydrophobicContact CG-CG1 4.3Å; R54-N305 PolarHBondContact NH2-O 3.39Å; R54-T306 PolarHBondContact NH2-OG1 2.97Å
55	F	88.7	Confident	87.1	Confident	133 Å²	133	90.8 Å²	90.8	58%	0.583	47%	0.467	S	S	*	.	H	α-helix	trans	-83.1	-36.7	174.4	-71.6	-65.6	0	0	0	111.3	W51 S52 S57 L58	W51-F55 HydrophobicContact CE3-CB 4.19Å; S52-F55 PolarHBondContact O-N 3.44Å; S52-F55 WeakPolarHBondContact OG-CD2 3.41Å; F55-S57 VanDerWaalsContact C-N 3.27Å; F55-S57 PolarHBondContact O-N 3.37Å; F55-L58 WeakPolarHBondContact O-CB 3.32Å; F55-L58 PolarHBondContact O-N 3.22Å; F55-L58 VanDerWaalsContact O-N 3.16Å
56	Y	90.1	Very high	86.8	Confident	86 Å²	86	93.1 Å²	93.1	34%	0.337	47%	0.471	S	S	.	.	H	α-helix	trans	-63.3	-34.5	178.1	-167.3	-105	0	0	0	112	S52 G53 L58 W59 D60 Y63	S52-Y56 PolarHBondContact O-N 2.74Å; G53-Y56 PolarHBondContact O-N 3.25Å; Y56-L58 PolarHBondContact O-N 3.31Å; Y56-L58 VanDerWaalsContact O-N 3.14Å; Y56-W59 WeakPolarHBondContact O-CB 3.39Å; Y56-W59 PolarHBondContact O-N 3.11Å; Y56-D60 HydrophobicContact CD1-CB 4.33Å; Y56-D60 HydrophobicContact CE1-CB 3.83Å; Y56-D60 PolarHBondContact O-N 2.79Å; Y56-Y63 AromaticContact CD1-CD1 3.84Å; Y56-Y63 HydrophobicContact CD1-CD1 3.84Å; Y56-Y63 AromaticContact CD1-CD2 3.9Å; Y56-Y63 HydrophobicContact CD1-CD2 3.9Å; Y56-Y63 HydrophobicContact CD1-CE1 4.28Å; Y56-Y63 HydrophobicContact CD1-CE2 4.33Å; Y56-Y63 AromaticContact CD1-CG 3.63Å; Y56-Y63 HydrophobicContact CD1-CG 3.63Å; Y56-Y63 HydrophobicContact CE1-CD1 4.45Å; Y56-Y63 AromaticContact CE1-CD2 3.67Å; Y56-Y63 HydrophobicContact CE1-CD2 3.67Å; Y56-Y63 HydrophobicContact CE1-CE2 4.19Å; Y56-Y63 AromaticContact CE1-CG 3.82Å; Y56-Y63 HydrophobicContact CE1-CG 3.82Å
57	S	87.5	Confident	86.4	Confident	13 Å²	13	95.9 Å²	95.9	9%	0.091	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.5	176.3	64.7	0	0	0	0	114.8	G53 R54 F55 D60	G53-S57 WeakPolarHBondContact O-CB 3.25Å; G53-S57 PolarHBondContact O-N 3.32Å; G53-S57 PolarHBondContact O-OG 3.4Å; R54-S57 PolarHBondContact O-OG 3.35Å; F55-S57 VanDerWaalsContact C-N 3.27Å; F55-S57 PolarHBondContact O-N 3.37Å; S57-D60 CarbonylContact C-O 3.59Å; S57-D60 WeakPolarHBondContact CA-O 3.48Å
58	L	88.7	Confident	86.1	Confident	23 Å²	23	92.5 Å²	92.5	12%	0.12	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-19.5	173.6	-60.7	175.2	0	0	0	112.3	F55 Y56 F124 V127 M128 L131	F55-L58 WeakPolarHBondContact O-CB 3.32Å; F55-L58 PolarHBondContact O-N 3.22Å; F55-L58 VanDerWaalsContact O-N 3.16Å; Y56-L58 PolarHBondContact O-N 3.31Å; Y56-L58 VanDerWaalsContact O-N 3.14Å; L58-F124 HydrophobicContact CB-CD1 4.19Å; L58-F124 HydrophobicContact CB-CE1 3.99Å; L58-F124 HydrophobicContact CD1-CD1 4.1Å; L58-F124 HydrophobicContact CD1-CE1 4.12Å; L58-V127 HydrophobicContact CD2-CG1 4.19Å; L58-M128 HydrophobicContact CD2-CB 4.21Å; L58-M128 HydrophobicContact CD2-SD 4.19Å; L58-L131 HydrophobicContact CD1-CD1 4.1Å; L58-L131 HydrophobicContact CD2-CD1 3.85Å
59	W	89.5	Confident	86	Confident	203 Å²	203	90.4 Å²	90.4	77%	0.769	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-51.7	175.1	-175.8	-88.6	0	0	0	110.8	Y56	Y56-W59 WeakPolarHBondContact O-CB 3.39Å; Y56-W59 PolarHBondContact O-N 3.11Å
60	D	89.1	Confident	85.9	Confident	57 Å²	57	87.1 Å²	87.1	31%	0.305	41%	0.407	S	S	.	.	S	Bend	trans	-107.4	100.2	174.1	-176.7	-4.6	0	0	0	109.5	Y56 S57 E62 Y63	Y56-D60 HydrophobicContact CD1-CB 4.33Å; Y56-D60 HydrophobicContact CE1-CB 3.83Å; Y56-D60 PolarHBondContact O-N 2.79Å; S57-D60 CarbonylContact C-O 3.59Å; S57-D60 WeakPolarHBondContact CA-O 3.48Å; D60-E62 PolarHBondContact O-N 3.32Å; D60-E62 PolarHBondContact OD1-N 3.49Å; D60-E62 VanDerWaalsContact OD1-N 3.13Å; D60-Y63 PolarHBondContact O-N 3.02Å; D60-Y63 PolarHBondContact OD1-N 2.99Å
61	T	82.9	Confident	85.6	Confident	98 Å²	98	82.9 Å²	82.9	60%	0.601	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.8	-175	54.1	0	0	0	0	113.3	V127	T61-V127 HydrophobicContact CG2-CG1 3.77Å
62	E	85.1	Confident	85.6	Confident	118 Å²	118	73.8 Å²	73.8	55%	0.551	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-24.8	-178.4	-161	170.6	-175.9	0	0	112.3	D60 A64 R65 I66	D60-E62 PolarHBondContact O-N 3.32Å; D60-E62 PolarHBondContact OD1-N 3.49Å; D60-E62 VanDerWaalsContact OD1-N 3.13Å; E62-A64 VanDerWaalsContact C-N 3.32Å; E62-A64 PolarHBondContact O-N 3.24Å; E62-R65 PolarHBondContact O-N 2.84Å; E62-R65 VanDerWaalsContact O-N 3.1Å; E62-I66 HydrophobicContact CG-CD1 3.77Å; E62-I66 HydrophobicContact CG-CG1 4.28Å; E62-I66 PolarHBondContact O-N 3.03Å
63	Y	86.7	Confident	85.6	Confident	75 Å²	75	72 Å²	72	29%	0.294	33%	0.334	S	S	.	.	H	α-helix	trans	-53.5	-45	-176.1	-174.2	-93.7	0	0	0	113.5	Y56 D60 R65 I66 H67 I68	Y56-Y63 AromaticContact CD1-CD1 3.84Å; Y56-Y63 HydrophobicContact CD1-CD1 3.84Å; Y56-Y63 AromaticContact CD1-CD2 3.9Å; Y56-Y63 HydrophobicContact CD1-CD2 3.9Å; Y56-Y63 HydrophobicContact CD1-CE1 4.28Å; Y56-Y63 HydrophobicContact CD1-CE2 4.33Å; Y56-Y63 AromaticContact CD1-CG 3.63Å; Y56-Y63 HydrophobicContact CD1-CG 3.63Å; Y56-Y63 HydrophobicContact CE1-CD1 4.45Å; Y56-Y63 AromaticContact CE1-CD2 3.67Å; Y56-Y63 HydrophobicContact CE1-CD2 3.67Å; Y56-Y63 HydrophobicContact CE1-CE2 4.19Å; Y56-Y63 AromaticContact CE1-CG 3.82Å; Y56-Y63 HydrophobicContact CE1-CG 3.82Å; D60-Y63 PolarHBondContact O-N 3.02Å; D60-Y63 PolarHBondContact OD1-N 2.99Å; Y63-R65 PolarHBondContact O-N 3.25Å; Y63-I66 PolarHBondContact O-N 3.44Å; Y63-H67 AromaticContact CD2-ND1 3.62Å; Y63-H67 HydrophobicContact CE1-CB 4.3Å; Y63-H67 HydrophobicContact CE2-CB 4.45Å; Y63-H67 AromaticContact CE2-ND1 3.7Å; Y63-H67 PolarHBondContact O-N 2.83Å; Y63-H67 PolarHBondContact O-ND1 3.47Å; Y63-I68 HydrophobicContact CE1-CD1 4.04Å; Y63-I68 HydrophobicContact CE1-CG1 4.46Å
64	A	81.6	Confident	85.8	Confident	8 Å²	8	72.3 Å²	72.3	7%	0.066	33%	0.332	C	S	.	.	H	α-helix	trans	-65.3	-38.7	-178.4	0	0	0	0	0	112.5	E62 I66 I68 I71	E62-A64 VanDerWaalsContact C-N 3.32Å; E62-A64 PolarHBondContact O-N 3.24Å; A64-I66 VanDerWaalsContact C-N 3.33Å; A64-I66 PolarHBondContact O-N 3.45Å; A64-I68 CarbonylContact O-C 3.56Å; A64-I68 PolarHBondContact O-N 3.29Å; A64-I71 HydrophobicContact CB-CB 4.12Å; A64-I71 HydrophobicContact CB-CG2 3.88Å
65	R	81	Confident	86	Confident	198 Å²	198	70.6 Å²	70.6	75%	0.747	34%	0.339	S	S	*	.	H	α-helix	trans	-66.6	-36.4	-178.6	-176.3	179.6	176.5	179.2	-0.9	112	E62 Y63	E62-R65 PolarHBondContact O-N 2.84Å; E62-R65 VanDerWaalsContact O-N 3.1Å; Y63-R65 PolarHBondContact O-N 3.25Å
66	I	83.2	Confident	86	Confident	106 Å²	106	68.4 Å²	68.4	54%	0.544	33%	0.331	S	S	.	.	H	α-helix	trans	-85.6	-48.1	-175.4	-62.3	174.7	0	0	0	111.6	E62 Y63 A64	E62-I66 HydrophobicContact CG-CD1 3.77Å; E62-I66 HydrophobicContact CG-CG1 4.28Å; E62-I66 PolarHBondContact O-N 3.03Å; Y63-I66 PolarHBondContact O-N 3.44Å; A64-I66 VanDerWaalsContact C-N 3.33Å; A64-I66 PolarHBondContact O-N 3.45Å
67	H	83.6	Confident	85.9	Confident	116 Å²	116	66.3 Å²	66.3	54%	0.537	32%	0.324	S	S	.	.	H	α-helix	trans	-100.6	-27.8	-166.8	-60.8	89.9	0	0	0	114	Y63	Y63-H67 AromaticContact CD2-ND1 3.62Å; Y63-H67 HydrophobicContact CE1-CB 4.3Å; Y63-H67 HydrophobicContact CE2-CB 4.45Å; Y63-H67 AromaticContact CE2-ND1 3.7Å; Y63-H67 PolarHBondContact O-N 2.83Å; Y63-H67 PolarHBondContact O-ND1 3.47Å
68	I	84.2	Confident	85.9	Confident	38 Å²	38	69.9 Å²	69.9	20%	0.195	34%	0.339	C	S	.	.			trans	-136	74.6	-171.7	-51.2	-179.5	0	0	0	109.2	Y63 A64 I70 I71	Y63-I68 HydrophobicContact CE1-CD1 4.04Å; Y63-I68 HydrophobicContact CE1-CG1 4.46Å; A64-I68 CarbonylContact O-C 3.56Å; A64-I68 PolarHBondContact O-N 3.29Å; I68-I70 HydrophobicContact CG2-CG2 3.46Å; I68-I70 VanDerWaalsContact CG2-CG2 3.46Å; I68-I70 PolarHBondContact O-N 2.87Å; I68-I71 HydrophobicContact CB-CD1 4.06Å; I68-I71 HydrophobicContact CB-CG1 4.39Å; I68-I71 HydrophobicContact CD1-CD1 4.13Å; I68-I71 HydrophobicContact CG2-CB 4.37Å; I68-I71 HydrophobicContact CG2-CD1 3.65Å; I68-I71 HydrophobicContact CG2-CG1 3.7Å; I68-I71 PolarHBondContact O-N 2.86Å
69	P	85.5	Confident	86	Confident	25 Å²	25	72.6 Å²	72.6	16%	0.162	36%	0.358	C	S	.	.	H	α-helix	trans	-57	-28	-173.4	20.5	-32.3	0	0	0	113	I71 S72 S73 W358 R361 I362	P69-I71 VanDerWaalsContact C-N 3.3Å; P69-I71 PolarHBondContact O-N 3.44Å; P69-S72 WeakPolarHBondContact CA-OG 3.19Å; P69-S72 CarbonylContact O-C 3.07Å; P69-S72 PolarHBondContact O-N 3.39Å; P69-S72 VanDerWaalsContact O-N 3.13Å; P69-S72 PolarHBondContact O-OG 2.92Å; P69-S73 PolarHBondContact O-N 2.91Å; P69-W358 HydrophobicContact CB-CZ3 4.48Å; P69-R361 HydrophobicContact CB-CB 4.35Å; P69-I362 HydrophobicContact CB-CG1 4.33Å; P69-I362 HydrophobicContact CG-CG1 4.14Å
70	I	86.3	Confident	86.1	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-29.1	176.9	-168.2	162.7	0	0	0	114.3	I68 S73 T306 I312 I362	I68-I70 HydrophobicContact CG2-CG2 3.46Å; I68-I70 VanDerWaalsContact CG2-CG2 3.46Å; I68-I70 PolarHBondContact O-N 2.87Å; I70-S73 WeakPolarHBondContact CA-OG 3.45Å; I70-S73 PolarHBondContact O-OG 3.01Å; I70-T306 HydrophobicContact CD1-CG2 3.69Å; I70-T306 HydrophobicContact CG1-CG2 4.29Å; I70-I312 HydrophobicContact CD1-CD1 3.39Å; I70-I362 HydrophobicContact CB-CD1 4.25Å; I70-I362 HydrophobicContact CG1-CD1 4.45Å
71	I	84.6	Confident	86.3	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.077	34%	0.34	C	S	.	.	H	α-helix	trans	-74.4	-41.6	174.2	-65.8	172	0	0	0	109.2	R54 A64 I68 P69 S73 H77	R54-I71 HydrophobicContact CG-CD1 3.87Å; R54-I71 HydrophobicContact CG-CG1 4.3Å; A64-I71 HydrophobicContact CB-CB 4.12Å; A64-I71 HydrophobicContact CB-CG2 3.88Å; I68-I71 HydrophobicContact CB-CD1 4.06Å; I68-I71 HydrophobicContact CB-CG1 4.39Å; I68-I71 HydrophobicContact CD1-CD1 4.13Å; I68-I71 HydrophobicContact CG2-CB 4.37Å; I68-I71 HydrophobicContact CG2-CD1 3.65Å; I68-I71 HydrophobicContact CG2-CG1 3.7Å; I68-I71 PolarHBondContact O-N 2.86Å; P69-I71 VanDerWaalsContact C-N 3.3Å; P69-I71 PolarHBondContact O-N 3.44Å; I71-S73 VanDerWaalsContact C-N 3.33Å; I71-S73 PolarHBondContact O-N 3.29Å; I71-H77 WeakPolarHBondContact O-CB 2.8Å
72	S	85.8	Confident	86.8	Confident	14 Å²	14	70.6 Å²	70.6	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-73.4	-21.3	-179.5	68	0	0	0	0	114.3	P69 V74 Q78 W358	P69-S72 WeakPolarHBondContact CA-OG 3.19Å; P69-S72 CarbonylContact O-C 3.07Å; P69-S72 PolarHBondContact O-N 3.39Å; P69-S72 VanDerWaalsContact O-N 3.13Å; P69-S72 PolarHBondContact O-OG 2.92Å; S72-V74 VanDerWaalsContact C-N 3.25Å; S72-V74 PolarHBondContact O-N 2.81Å; S72-Q78 PolarHBondContact O-NE2 3.01Å; S72-W358 VanDerWaalsContact OG-CZ3 3.31Å; S72-W358 WeakPolarHBondContact OG-CZ3 3.42Å
73	S	87	Confident	87.1	Confident	24 Å²	24	70.5 Å²	70.5	17%	0.168	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.6	180	60.2	0	0	0	0	113.6	P69 I70 I71	P69-S73 PolarHBondContact O-N 2.91Å; I70-S73 WeakPolarHBondContact CA-OG 3.45Å; I70-S73 PolarHBondContact O-OG 3.01Å; I71-S73 VanDerWaalsContact C-N 3.33Å; I71-S73 PolarHBondContact O-N 3.29Å
74	V	87.7	Confident	87.4	Confident	28 Å²	28	68.1 Å²	68.1	17%	0.17	34%	0.341	C	S	.	.	S	Bend	trans	-81.2	121.2	179.9	-177.6	0	0	0	0	109.3	S72 E76 H77 W286	S72-V74 VanDerWaalsContact C-N 3.25Å; S72-V74 PolarHBondContact O-N 2.81Å; V74-E76 HydrophobicContact CG1-CB 4.16Å; V74-E76 PolarHBondContact O-N 3.39Å; V74-E76 VanDerWaalsContact O-N 3.13Å; V74-H77 VanDerWaalsContact CB-CD2 3.49Å; V74-H77 WeakPolarHBondContact CB-CD2 3.38Å; V74-H77 WeakPolarHBondContact O-CB 3.31Å; V74-H77 PolarHBondContact O-N 3.4Å; V74-W286 HydrophobicContact CG2-CH2 3.91Å; V74-W286 HydrophobicContact CG2-CZ2 4.5Å
75	S	86.9	Confident	87.8	Confident	92 Å²	92	69.1 Å²	69.1	64%	0.643	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-57.6	-30.7	-177.6	56.5	0	0	0	0	113.7	H77 Q78	S75-H77 PolarHBondContact O-N 3.13Å; S75-Q78 WeakPolarHBondContact O-CB 3.42Å; S75-Q78 VanDerWaalsContact O-CG 3.3Å; S75-Q78 WeakPolarHBondContact O-CG 3.31Å; S75-Q78 PolarHBondContact O-N 2.98Å
76	E	88.5	Confident	88.4	Confident	88 Å²	88	64.5 Å²	64.5	41%	0.411	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-72.2	-14.5	179	-62.9	175.9	-127.8	0	0	114.2	V74 Q78 M128 R130	V74-E76 HydrophobicContact CG1-CB 4.16Å; V74-E76 PolarHBondContact O-N 3.39Å; V74-E76 VanDerWaalsContact O-N 3.13Å; E76-Q78 VanDerWaalsContact C-N 3.3Å; E76-M128 WeakPolarHBondContact O-CE 3.34Å; E76-M128 WeakPolarHBondContact O-CG 3.27Å; E76-R130 HydrophobicContact CB-CB 4.29Å; E76-R130 PolarHBondContact O-N 3.07Å; E76-R130 IonicContact OE1-NH2 2.84Å; E76-R130 PolarHBondContact OE1-NH2 2.97Å; E76-R130 IonicContact OE2-CZ 3.63Å; E76-R130 IonicContact OE2-NE 3.1Å; E76-R130 PolarHBondContact OE2-NE 3.45Å; E76-R130 IonicContact OE2-NH2 3.59Å; E76-R130 PolarHBondContact OE2-NH2 3.41Å
77	H	88.3	Confident	89	Confident	42 Å²	42	61.5 Å²	61.5	19%	0.194	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-85.1	-1.6	174.9	-74.9	-96.2	0	0	0	113.5	I71 V74 S75 M128 R130	I71-H77 WeakPolarHBondContact O-CB 2.8Å; V74-H77 VanDerWaalsContact CB-CD2 3.49Å; V74-H77 WeakPolarHBondContact CB-CD2 3.38Å; V74-H77 WeakPolarHBondContact O-CB 3.31Å; V74-H77 PolarHBondContact O-N 3.4Å; S75-H77 PolarHBondContact O-N 3.13Å; H77-M128 HydrophobicContact CB-CE 4.13Å; H77-M128 VanDerWaalsContact CD2-CE 3.45Å; H77-M128 WeakPolarHBondContact CD2-CE 3.41Å; H77-M128 WeakPolarHBondContact CE1-CE 3.27Å; H77-M128 WeakPolarHBondContact ND1-CE 3.4Å; H77-M128 WeakPolarHBondContact NE2-CE 3.41Å; H77-R130 PolarHBondContact NE2-NH1 3.3Å
78	Q	88.1	Confident	89.4	Confident	87 Å²	87	58.6 Å²	58.6	41%	0.407	31%	0.305	S	S	.	.	S	Bend	trans	-73.9	155.9	176	-61.3	-61.9	-37.8	0	0	111.2	S72 S75 E76 I129	S72-Q78 PolarHBondContact O-NE2 3.01Å; S75-Q78 WeakPolarHBondContact O-CB 3.42Å; S75-Q78 VanDerWaalsContact O-CG 3.3Å; S75-Q78 WeakPolarHBondContact O-CG 3.31Å; S75-Q78 PolarHBondContact O-N 2.98Å; E76-Q78 VanDerWaalsContact C-N 3.3Å; Q78-I129 HydrophobicContact CB-CD1 3.96Å; Q78-I129 WeakPolarHBondContact O-CD1 3.4Å; Q78-I129 VanDerWaalsContact O-CG1 3.24Å; Q78-I129 WeakPolarHBondContact O-CG1 3.16Å; Q78-I129 PolarHBondContact O-N 3.35Å
79	P	90.9	Very high	89.8	Confident	80 Å²	80	57.1 Å²	57.1	52%	0.519	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-69.4	153.2	177.5	28.3	-35.3	0	0	0	112.3	V127	P79-V127 WeakPolarHBondContact CA-O 3.25Å
80	T	90.9	Very high	90.2	Very high	27 Å²	27	57.5 Å²	57.5	17%	0.166	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-81.1	135.3	178.4	50	0	0	0	0	111.4	A125 G126 I129 M132	T80-A125 WeakPolarHBondContact CG2-O 3.39Å; T80-A125 PolarHBondContact OG1-O 3.26Å; T80-G126 WeakPolarHBondContact OG1-CA 3.49Å; T80-G126 PolarHBondContact OG1-O 2.9Å; T80-I129 HydrophobicContact CG2-CB 3.97Å; T80-I129 HydrophobicContact CG2-CG1 3.51Å; T80-M132 HydrophobicContact CG2-CE 3.92Å
81	T	93.5	Very high	90.5	Very high	85 Å²	85	58.6 Å²	58.6	52%	0.521	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-86.7	153.9	167.8	62.8	0	0	0	0	109.8	F83 A84 S85	T81-F83 PolarHBondContact O-N 3.15Å; T81-F83 VanDerWaalsContact O-N 3.14Å; T81-A84 WeakPolarHBondContact O-CB 3.38Å; T81-A84 PolarHBondContact O-N 3.47Å; T81-S85 PolarHBondContact O-N 3.15Å
82	W	92.8	Very high	90.9	Very high	205 Å²	205	58.7 Å²	58.7	78%	0.777	30%	0.304	S	S	*	.	H	α-helix	trans	-56.6	-31.3	177.1	70.3	-93	0	0	0	112.6	S85 F86	W82-S85 PolarHBondContact O-N 3.49Å; W82-F86 PolarHBondContact O-N 3.09Å; W82-F86 VanDerWaalsContact O-N 3.07Å
83	F	93.3	Very high	91.3	Very high	116 Å²	116	60.7 Å²	60.7	51%	0.509	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-43.6	176.8	176.2	-97.5	0	0	0	111.3	T81 S85 F86 F87	T81-F83 PolarHBondContact O-N 3.15Å; T81-F83 VanDerWaalsContact O-N 3.14Å; F83-S85 VanDerWaalsContact C-N 3.34Å; F83-S85 PolarHBondContact O-N 3.22Å; F83-F86 PolarHBondContact O-N 2.99Å; F83-F87 HydrophobicContact CE1-CB 4.34Å; F83-F87 HydrophobicContact CE1-CD2 4.31Å; F83-F87 HydrophobicContact CE1-CG 4.45Å; F83-F87 HydrophobicContact CZ-CD2 4.08Å; F83-F87 VanDerWaalsContact O-CB 3.27Å; F83-F87 WeakPolarHBondContact O-CB 3.33Å; F83-F87 PolarHBondContact O-N 2.97Å
84	A	91.9	Very high	91.5	Very high	24 Å²	24	63 Å²	63	20%	0.198	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-43.2	176.8	0	0	0	0	0	111.3	T81 F86 F87 D88	T81-A84 WeakPolarHBondContact O-CB 3.38Å; T81-A84 PolarHBondContact O-N 3.47Å; A84-F86 VanDerWaalsContact C-N 3.33Å; A84-F86 PolarHBondContact O-N 2.8Å; A84-F87 PolarHBondContact O-N 3.46Å; A84-D88 WeakPolarHBondContact O-CB 3.26Å; A84-D88 PolarHBondContact O-N 3.45Å
85	S	90.6	Very high	91.6	Very high	30 Å²	30	62.3 Å²	62.3	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-42.6	175.1	-53.7	0	0	0	0	112.6	T81 W82 F83 L89 V93 M132	T81-S85 PolarHBondContact O-N 3.15Å; W82-S85 PolarHBondContact O-N 3.49Å; F83-S85 VanDerWaalsContact C-N 3.34Å; F83-S85 PolarHBondContact O-N 3.22Å; S85-L89 WeakPolarHBondContact O-CB 3.43Å; S85-L89 PolarHBondContact O-N 3.37Å; S85-L89 VanDerWaalsContact O-N 3.16Å; S85-V93 WeakPolarHBondContact O-CG2 3.43Å; S85-M132 WeakPolarHBondContact OG-CE 3.4Å
86	F	93.6	Very high	91.9	Very high	101 Å²	101	59.4 Å²	59.4	44%	0.443	31%	0.308	S	S	.	.	H	α-helix	trans	-70.8	-38.2	177.4	-175.7	-99.1	0	0	0	112.5	W82 F83 A84 H90	W82-F86 PolarHBondContact O-N 3.09Å; W82-F86 VanDerWaalsContact O-N 3.07Å; F83-F86 PolarHBondContact O-N 2.99Å; A84-F86 VanDerWaalsContact C-N 3.33Å; A84-F86 PolarHBondContact O-N 2.8Å; F86-H90 VanDerWaalsContact O-CA 3.23Å; F86-H90 WeakPolarHBondContact O-CA 3.45Å; F86-H90 PolarHBondContact O-N 3.38Å
87	F	94.2	Very high	92.1	Very high	43 Å²	43	58.6 Å²	58.6	19%	0.189	31%	0.31	C	S	.	.	H	α-helix	trans	-62.8	-43.2	178.7	-171.5	-101.6	0	0	0	111.6	F83 A84 H234 W237 V238 A242 Y243	F83-F87 HydrophobicContact CE1-CB 4.34Å; F83-F87 HydrophobicContact CE1-CD2 4.31Å; F83-F87 HydrophobicContact CE1-CG 4.45Å; F83-F87 HydrophobicContact CZ-CD2 4.08Å; F83-F87 VanDerWaalsContact O-CB 3.27Å; F83-F87 WeakPolarHBondContact O-CB 3.33Å; F83-F87 PolarHBondContact O-N 2.97Å; A84-F87 PolarHBondContact O-N 3.46Å; F87-H234 PolarHBondContact O-NE2 2.9Å; F87-W237 HydrophobicContact CE2-CZ3 4.11Å; F87-V238 HydrophobicContact CD1-CG1 4.11Å; F87-V238 HydrophobicContact CD2-CG2 4.3Å; F87-V238 HydrophobicContact CE1-CB 4.44Å; F87-V238 HydrophobicContact CE1-CG1 3.44Å; F87-V238 VanDerWaalsContact CE1-CG1 3.44Å; F87-V238 HydrophobicContact CE1-CG2 4.25Å; F87-V238 HydrophobicContact CE2-CG1 4.46Å; F87-V238 HydrophobicContact CE2-CG2 3.8Å; F87-V238 HydrophobicContact CZ-CB 4.21Å; F87-V238 HydrophobicContact CZ-CG1 3.65Å; F87-V238 HydrophobicContact CZ-CG2 3.77Å; F87-A242 HydrophobicContact CE1-CB 3.93Å; F87-A242 HydrophobicContact CZ-CB 3.76Å; F87-Y243 HydrophobicContact CE1-CE2 4.33Å
88	D	93.8	Very high	92.3	Very high	54 Å²	54	60 Å²	60	29%	0.289	32%	0.322	S	S	.	.	H	α-helix	trans	-76.8	-37.6	-177.1	-64.8	6.8	0	0	0	112.6	A84 M132 Y243	A84-D88 WeakPolarHBondContact O-CB 3.26Å; A84-D88 PolarHBondContact O-N 3.45Å; D88-M132 WeakPolarHBondContact OD2-CG 3.44Å; D88-Y243 PolarHBondContact OD1-OH 3.4Å
89	L	92.3	Very high	92.4	Very high	8 Å²	8	55.9 Å²	55.9	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-115.5	-10.3	-167	-63.4	170.8	0	0	0	114.3	S85 I91 L92 V93 M132 T136 V139	S85-L89 WeakPolarHBondContact O-CB 3.43Å; S85-L89 PolarHBondContact O-N 3.37Å; S85-L89 VanDerWaalsContact O-N 3.16Å; L89-I91 PolarHBondContact O-N 3Å; L89-I91 VanDerWaalsContact O-N 3.1Å; L89-L92 HydrophobicContact CB-CB 4.29Å; L89-L92 HydrophobicContact CD2-CD1 4.46Å; L89-L92 VanDerWaalsContact O-CB 3.27Å; L89-L92 WeakPolarHBondContact O-CB 3.4Å; L89-L92 WeakPolarHBondContact O-CG 3.25Å; L89-L92 PolarHBondContact O-N 3.46Å; L89-V93 HydrophobicContact CB-CG2 3.45Å; L89-V93 VanDerWaalsContact CB-CG2 3.45Å; L89-V93 HydrophobicContact CD1-CG2 4.15Å; L89-V93 HydrophobicContact CG-CG2 4.43Å; L89-M132 HydrophobicContact CD1-SD 4.25Å; L89-T136 HydrophobicContact CD2-CG2 4.03Å; L89-V139 HydrophobicContact CD1-CG1 4.2Å; L89-V139 HydrophobicContact CD1-CG2 4.36Å; L89-V139 HydrophobicContact CD2-CG1 4.17Å
90	H	93.3	Very high	92.5	Very high	33 Å²	33	53.6 Å²	53.6	15%	0.153	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	44.4	-114.4	179.1	-168.1	-100	0	0	0	112.4	F86 L92 F231 H234	F86-H90 VanDerWaalsContact O-CA 3.23Å; F86-H90 WeakPolarHBondContact O-CA 3.45Å; F86-H90 PolarHBondContact O-N 3.38Å; H90-L92 VanDerWaalsContact C-N 3.3Å; H90-L92 PolarHBondContact O-N 3.37Å; H90-F231 HydrophobicContact CB-CD2 4Å; H90-F231 HydrophobicContact CB-CE2 4.38Å; H90-H234 AromaticContact CD2-CD2 3.78Å; H90-H234 AromaticContact CD2-CE1 3.8Å; H90-H234 AromaticContact CD2-CG 3.39Å; H90-H234 AromaticContact CD2-ND1 3.44Å; H90-H234 PolarHBondContact CD2-ND1 3.3Å; H90-H234 AromaticContact CD2-NE2 3.99Å; H90-H234 AromaticContact CG-CD2 3.79Å; H90-H234 AromaticContact CG-CG 3.77Å
91	I	92.9	Very high	92.6	Very high	34 Å²	34	58.9 Å²	58.9	17%	0.174	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.2	-178.9	-173.9	159.7	0	0	0	113.6	L89 V93 A94 S95 F147 V227 F231	L89-I91 PolarHBondContact O-N 3Å; L89-I91 VanDerWaalsContact O-N 3.1Å; I91-V93 PolarHBondContact O-N 3.49Å; I91-V93 VanDerWaalsContact O-N 3.12Å; I91-A94 WeakPolarHBondContact O-CB 3.41Å; I91-A94 PolarHBondContact O-N 3.29Å; I91-S95 PolarHBondContact O-N 3.34Å; I91-S95 VanDerWaalsContact O-N 3.12Å; I91-S95 PolarHBondContact O-OG 3.46Å; I91-F147 HydrophobicContact CD1-CE1 4.38Å; I91-F147 HydrophobicContact CD1-CZ 3.88Å; I91-F147 HydrophobicContact CG1-CZ 4.11Å; I91-F147 HydrophobicContact CG2-CZ 4.41Å; I91-V227 HydrophobicContact CD1-CB 4.39Å; I91-V227 HydrophobicContact CD1-CG1 2.94Å; I91-V227 HydrophobicContact CG1-CG1 4.28Å; I91-F231 HydrophobicContact CG2-CB 4.1Å; I91-F231 HydrophobicContact CG2-CD2 3.91Å; I91-F231 HydrophobicContact CG2-CG 4.17Å
92	L	93.7	Very high	92.5	Very high	18 Å²	18	56.2 Å²	56.2	9%	0.094	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-26.7	-175.7	-52.6	176.6	0	0	0	111.7	L89 H90 A94 S95 F96 V139 S143 F147 F231	L89-L92 HydrophobicContact CB-CB 4.29Å; L89-L92 HydrophobicContact CD2-CD1 4.46Å; L89-L92 VanDerWaalsContact O-CB 3.27Å; L89-L92 WeakPolarHBondContact O-CB 3.4Å; L89-L92 WeakPolarHBondContact O-CG 3.25Å; L89-L92 PolarHBondContact O-N 3.46Å; H90-L92 VanDerWaalsContact C-N 3.3Å; H90-L92 PolarHBondContact O-N 3.37Å; L92-A94 VanDerWaalsContact C-N 3.28Å; L92-A94 PolarHBondContact O-N 3.24Å; L92-S95 WeakPolarHBondContact CA-OG 3.46Å; L92-F96 WeakPolarHBondContact O-CB 3.34Å; L92-F96 PolarHBondContact O-N 3Å; L92-V139 HydrophobicContact CB-CG1 3.54Å; L92-V139 HydrophobicContact CD1-CG1 4.46Å; L92-S143 PolarHBondContact O-OG 2.93Å; L92-F147 HydrophobicContact CD2-CE2 4.4Å; L92-F231 HydrophobicContact CD1-CE2 3.97Å; L92-F231 HydrophobicContact CD1-CZ 3.83Å; L92-F231 HydrophobicContact CG-CE2 3.96Å; L92-F231 HydrophobicContact CG-CZ 4.18Å
93	V	92.6	Very high	92.4	Very high	56 Å²	56	46.5 Å²	46.5	34%	0.339	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-37.8	173	-173.9	0	0	0	0	111.6	S85 L89 I91 P97	S85-V93 WeakPolarHBondContact O-CG2 3.43Å; L89-V93 HydrophobicContact CB-CG2 3.45Å; L89-V93 VanDerWaalsContact CB-CG2 3.45Å; L89-V93 HydrophobicContact CD1-CG2 4.15Å; L89-V93 HydrophobicContact CG-CG2 4.43Å; I91-V93 PolarHBondContact O-N 3.49Å; I91-V93 VanDerWaalsContact O-N 3.12Å; V93-P97 WeakPolarHBondContact O-CD 3.45Å
94	A	90.8	Very high	92.3	Very high	73 Å²	73	44.8 Å²	44.8	60%	0.603	25%	0.245	S	C	*	.	H	α-helix	trans	-81.7	-34.9	-178.1	0	0	0	0	0	112.8	I91 L92 P97	I91-A94 WeakPolarHBondContact O-CB 3.41Å; I91-A94 PolarHBondContact O-N 3.29Å; L92-A94 VanDerWaalsContact C-N 3.28Å; L92-A94 PolarHBondContact O-N 3.24Å; A94-P97 WeakPolarHBondContact O-CD 3.47Å
95	S	91	Very high	92.3	Very high	13 Å²	13	49.1 Å²	49.1	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-83.3	-18.6	177.7	54.7	0	0	0	0	113.6	I91 L92 V98 G99 S143	I91-S95 PolarHBondContact O-N 3.34Å; I91-S95 VanDerWaalsContact O-N 3.12Å; I91-S95 PolarHBondContact O-OG 3.46Å; L92-S95 WeakPolarHBondContact CA-OG 3.46Å; S95-V98 WeakPolarHBondContact O-CB 3.41Å; S95-V98 PolarHBondContact O-N 3.05Å; S95-G99 PolarHBondContact O-N 2.94Å; S95-S143 WeakPolarHBondContact OG-CB 3.4Å; S95-S143 PolarHBondContact OG-OG 2.84Å; S95-S143 VanDerWaalsContact OG-OG 3.06Å
96	F	92.2	Very high	92.1	Very high	30 Å²	30	54.3 Å²	54.3	13%	0.132	28%	0.281	C	S	.	.	H	α-helix	trans	-54.7	-50.6	178.2	160.4	-101.8	0	0	0	114	L92 V98 G99 L100 A118 V122 V139 L142	L92-F96 WeakPolarHBondContact O-CB 3.34Å; L92-F96 PolarHBondContact O-N 3Å; F96-V98 VanDerWaalsContact C-N 3.26Å; F96-V98 PolarHBondContact O-N 3.35Å; F96-G99 PolarHBondContact O-N 2.77Å; F96-L100 PolarHBondContact O-N 3.25Å; F96-A118 HydrophobicContact CE2-CB 4.02Å; F96-A118 HydrophobicContact CZ-CB 4.28Å; F96-V122 HydrophobicContact CE1-CG2 3.91Å; F96-V122 HydrophobicContact CE2-CG2 4.41Å; F96-V122 HydrophobicContact CZ-CG2 3.57Å; F96-V139 HydrophobicContact CB-CG1 4.39Å; F96-V139 HydrophobicContact CD2-CG2 3.91Å; F96-V139 HydrophobicContact CE2-CG2 4.34Å; F96-V139 HydrophobicContact CG-CG2 4.34Å; F96-L142 HydrophobicContact CD2-CB 4.23Å; F96-L142 HydrophobicContact CD2-CD1 3.65Å; F96-L142 HydrophobicContact CE2-CD1 3.42Å; F96-L142 VanDerWaalsContact CE2-CD1 3.42Å
97	P	92.9	Very high	92	Very high	71 Å²	71	55.2 Å²	55.2	46%	0.461	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-31.9	178.9	-23	35	0	0	0	113	V93 A94 L100 Y101	V93-P97 WeakPolarHBondContact O-CD 3.45Å; A94-P97 WeakPolarHBondContact O-CD 3.47Å; P97-L100 PolarHBondContact O-N 3.12Å; P97-Y101 WeakPolarHBondContact O-CB 3.24Å; P97-Y101 PolarHBondContact O-N 2.91Å
98	V	92.4	Very high	91.8	Very high	72 Å²	72	57.1 Å²	57.1	44%	0.436	30%	0.302	S	S	.	.	H	α-helix	trans	-66.2	-45	176.2	-177.4	0	0	0	0	110.3	S95 F96 L100 Y101 L102 A146	S95-V98 WeakPolarHBondContact O-CB 3.41Å; S95-V98 PolarHBondContact O-N 3.05Å; F96-V98 VanDerWaalsContact C-N 3.26Å; F96-V98 PolarHBondContact O-N 3.35Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 3.39Å; V98-Y101 PolarHBondContact O-N 3.43Å; V98-L102 HydrophobicContact CG1-CD1 4.42Å; V98-L102 WeakPolarHBondContact O-CG 3.44Å; V98-L102 PolarHBondContact O-N 2.88Å; V98-A146 HydrophobicContact CB-CB 4.19Å; V98-A146 HydrophobicContact CG1-CB 4.11Å
99	G	91.7	Very high	91.7	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-42.2	174.8	0	0	0	0	0	112.5	S95 F96 L102 C103 L142	S95-G99 PolarHBondContact O-N 2.94Å; F96-G99 PolarHBondContact O-N 2.77Å; G99-L102 PolarHBondContact O-N 2.85Å; G99-C103 PolarHBondContact O-N 3.41Å; G99-C103 VanDerWaalsContact O-N 3.09Å; G99-C103 PolarHBondContact O-SG 2.99Å; G99-L142 WeakPolarHBondContact CA-O 3.45Å
100	L	92.7	Very high	91.6	Very high	33 Å²	33	67.8 Å²	67.8	17%	0.173	35%	0.354	C	S	.	.	H	α-helix	trans	-62.2	-44.1	176.1	-172.9	66.5	0	0	0	111.6	F96 P97 V98 C103 L104 I115 A118 L142	F96-L100 PolarHBondContact O-N 3.25Å; P97-L100 PolarHBondContact O-N 3.12Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 3.39Å; L100-C103 PolarHBondContact O-N 2.62Å; L100-L104 HydrophobicContact CG-CD1 4.45Å; L100-L104 WeakPolarHBondContact O-CG 3.36Å; L100-L104 PolarHBondContact O-N 3.2Å; L100-I115 HydrophobicContact CD1-CB 4.34Å; L100-I115 HydrophobicContact CD1-CG1 3.98Å; L100-I115 HydrophobicContact CD1-CG2 4.25Å; L100-A118 HydrophobicContact CD1-CB 4.14Å; L100-L142 HydrophobicContact CB-CD1 4.4Å; L100-L142 HydrophobicContact CD1-CD1 4.3Å
101	Y	93.6	Very high	91.5	Very high	137 Å²	137	70 Å²	70	54%	0.537	36%	0.361	S	S	.	.	H	α-helix	trans	-61	-44.1	176.8	-179.2	-97.9	0	0	0	112.3	P97 V98 C103 L104 M105	P97-Y101 WeakPolarHBondContact O-CB 3.24Å; P97-Y101 PolarHBondContact O-N 2.91Å; V98-Y101 PolarHBondContact O-N 3.43Å; Y101-C103 VanDerWaalsContact C-N 3.31Å; Y101-C103 PolarHBondContact O-N 2.83Å; Y101-L104 WeakPolarHBondContact O-CB 3.25Å; Y101-L104 PolarHBondContact O-N 3.31Å; Y101-L104 VanDerWaalsContact O-N 3.13Å; Y101-M105 HydrophobicContact CD1-CG 4.29Å; Y101-M105 HydrophobicContact CD2-CE 4.28Å; Y101-M105 HydrophobicContact CE1-CE 4.27Å; Y101-M105 HydrophobicContact CE1-CG 3.91Å; Y101-M105 HydrophobicContact CE1-SD 4.33Å; Y101-M105 HydrophobicContact CE2-CE 3.56Å; Y101-M105 WeakPolarHBondContact O-CG 3.4Å; Y101-M105 PolarHBondContact O-N 2.83Å; Y101-M105 VanDerWaalsContact O-N 3.07Å
102	L	90.9	Very high	91.5	Very high	29 Å²	29	72 Å²	72	15%	0.152	37%	0.371	C	S	.	.	H	α-helix	trans	-63.1	-36.3	176.6	-69.4	171.9	0	0	0	112.5	V98 G99 M105 K106 Y149	V98-L102 HydrophobicContact CG1-CD1 4.42Å; V98-L102 WeakPolarHBondContact O-CG 3.44Å; V98-L102 PolarHBondContact O-N 2.88Å; G99-L102 PolarHBondContact O-N 2.85Å; L102-M105 PolarHBondContact O-N 3.32Å; L102-K106 PolarHBondContact O-N 3.04Å; L102-Y149 HydrophobicContact CD1-CD1 3.98Å; L102-Y149 HydrophobicContact CD1-CD2 4.42Å; L102-Y149 HydrophobicContact CD1-CG 3.77Å; L102-Y149 HydrophobicContact CD2-CD1 3.99Å; L102-Y149 HydrophobicContact CD2-CD2 4.24Å; L102-Y149 HydrophobicContact CD2-CE1 4Å; L102-Y149 HydrophobicContact CD2-CE2 4.22Å; L102-Y149 HydrophobicContact CD2-CG 4.12Å
103	C	90.7	Very high	91.5	Very high	1 Å²	1	77.9 Å²	77.9	1%	0.007	40%	0.396	C	S	.	.	H	α-helix	trans	-67.6	-34.5	173.7	-75.3	0	0	0	0	112.7	G99 L100 Y101 K106 I115	G99-C103 PolarHBondContact O-N 3.41Å; G99-C103 VanDerWaalsContact O-N 3.09Å; G99-C103 PolarHBondContact O-SG 2.99Å; L100-C103 PolarHBondContact O-N 2.62Å; Y101-C103 VanDerWaalsContact C-N 3.31Å; Y101-C103 PolarHBondContact O-N 2.83Å; C103-K106 CarbonylContact O-C 3.6Å; C103-I115 HydrophobicContact CB-CD1 4.29Å; C103-I115 HydrophobicContact CB-CG1 4.2Å
104	L	91.3	Very high	91.5	Very high	80 Å²	80	76.7 Å²	76.7	42%	0.419	39%	0.389	S	S	.	.	H	α-helix	trans	-69	-33.1	175.3	-74.2	165.7	0	0	0	112.7	L100 Y101 I107 I115	L100-L104 HydrophobicContact CG-CD1 4.45Å; L100-L104 WeakPolarHBondContact O-CG 3.36Å; L100-L104 PolarHBondContact O-N 3.2Å; Y101-L104 WeakPolarHBondContact O-CB 3.25Å; Y101-L104 PolarHBondContact O-N 3.31Å; Y101-L104 VanDerWaalsContact O-N 3.13Å; L104-I107 VanDerWaalsContact O-CG1 3.25Å; L104-I107 WeakPolarHBondContact O-CG1 3.38Å; L104-I115 HydrophobicContact CD2-CD1 3.74Å; L104-I115 HydrophobicContact CD2-CG1 4.45Å; L104-I115 HydrophobicContact CD2-CG2 4.37Å; L104-I115 HydrophobicContact CG-CD1 4.11Å
105	M	90.4	Very high	91.6	Very high	116 Å²	116	74.2 Å²	74.2	57%	0.571	37%	0.366	S	S	*	.	H	α-helix	trans	-70	-35.4	179.4	-69.2	-68.6	120.8	0	0	112.9	Y101 L102	Y101-M105 HydrophobicContact CD1-CG 4.29Å; Y101-M105 HydrophobicContact CD2-CE 4.28Å; Y101-M105 HydrophobicContact CE1-CE 4.27Å; Y101-M105 HydrophobicContact CE1-CG 3.91Å; Y101-M105 HydrophobicContact CE1-SD 4.33Å; Y101-M105 HydrophobicContact CE2-CE 3.56Å; Y101-M105 WeakPolarHBondContact O-CG 3.4Å; Y101-M105 PolarHBondContact O-N 2.83Å; Y101-M105 VanDerWaalsContact O-N 3.07Å; L102-M105 PolarHBondContact O-N 3.32Å
106	K	87.8	Confident	91.7	Very high	139 Å²	139	78.4 Å²	78.4	60%	0.604	39%	0.386	S	S	*	.	S	Bend	trans	-112.9	77	179.5	-68.5	-176.1	179.7	178.6	0	109.8	L102 C103 N108 R111	L102-K106 PolarHBondContact O-N 3.04Å; C103-K106 CarbonylContact O-C 3.6Å; K106-N108 PolarHBondContact O-N 3.2Å; K106-R111 WeakPolarHBondContact O-CD 3.35Å; K106-R111 PolarHBondContact O-NE 3.47Å
107	I	90.4	Very high	91.9	Very high	120 Å²	120	80.7 Å²	80.7	62%	0.615	40%	0.395	S	S	*	.			trans	-67.7	126.8	-177.2	-57.2	178.2	0	0	0	110.2	L104 I112	L104-I107 VanDerWaalsContact O-CG1 3.25Å; L104-I107 WeakPolarHBondContact O-CG1 3.38Å; I107-I112 HydrophobicContact CG2-CD1 3.93Å; I107-I112 HydrophobicContact CG2-CG1 3.9Å
108	N	90.3	Very high	92	Very high	83 Å²	83	77.3 Å²	77.3	44%	0.444	37%	0.373	S	S	.	.			trans	-140.2	160.2	170.6	-163.6	14.1	0	0	0	108.6	K106 E110 R111 I112	K106-N108 PolarHBondContact O-N 3.2Å; N108-E110 PolarHBondContact O-N 2.99Å; N108-R111 HydrophobicContact CB-CG 4.36Å; N108-R111 PolarHBondContact O-N 3.32Å; N108-I112 WeakPolarHBondContact O-CG1 3.44Å; N108-I112 PolarHBondContact O-N 2.96Å
109	D	91	Very high	92	Very high	136 Å²	136	79.5 Å²	79.5	73%	0.727	38%	0.38	S	S	*	.	H	α-helix	trans	-54.8	-41.6	-177.1	-69.3	-10.2	0	0	0	111.9
110	E	92	Very high	92.1	Very high	149 Å²	149	82.8 Å²	82.8	70%	0.696	40%	0.4	S	S	*	.	H	α-helix	trans	-66.3	-36.8	176.3	-61.7	173.1	179.8	0	0	112.9	N108 F113 V114	N108-E110 PolarHBondContact O-N 2.99Å; E110-F113 WeakPolarHBondContact O-CB 3.48Å; E110-F113 PolarHBondContact O-N 3.34Å; E110-V114 PolarHBondContact O-N 2.95Å
111	R	90.5	Very high	92.2	Very high	79 Å²	79	81.5 Å²	81.5	30%	0.298	39%	0.394	S	S	.	.	H	α-helix	trans	-74.9	-30.1	-177.7	-69.3	170.5	-175.1	-92.4	3.2	111.7	K106 N108 F113 V114 I115	K106-R111 WeakPolarHBondContact O-CD 3.35Å; K106-R111 PolarHBondContact O-NE 3.47Å; N108-R111 HydrophobicContact CB-CG 4.36Å; N108-R111 PolarHBondContact O-N 3.32Å; R111-F113 VanDerWaalsContact C-N 3.28Å; R111-F113 PolarHBondContact O-N 2.9Å; R111-V114 PolarHBondContact O-N 2.89Å; R111-I115 WeakPolarHBondContact O-CD1 3.29Å; R111-I115 VanDerWaalsContact O-CG1 3.25Å; R111-I115 WeakPolarHBondContact O-CG1 3.24Å; R111-I115 PolarHBondContact O-N 3.33Å
112	I	92.4	Very high	92.2	Very high	76 Å²	76	78 Å²	78	39%	0.39	39%	0.386	S	S	.	.	H	α-helix	trans	-59.5	-43.5	172.2	-65.8	168.6	0	0	0	109.9	I107 N108 V114 I115 L116	I107-I112 HydrophobicContact CG2-CD1 3.93Å; I107-I112 HydrophobicContact CG2-CG1 3.9Å; N108-I112 WeakPolarHBondContact O-CG1 3.44Å; N108-I112 PolarHBondContact O-N 2.96Å; I112-V114 PolarHBondContact O-N 3.45Å; I112-I115 PolarHBondContact O-N 3.06Å; I112-L116 HydrophobicContact CG2-CD1 4.1Å; I112-L116 WeakPolarHBondContact O-CG 3.45Å; I112-L116 PolarHBondContact O-N 3.36Å
113	F	93.3	Very high	92.4	Very high	142 Å²	142	82 Å²	82	62%	0.623	40%	0.4	S	S	*	.	H	α-helix	trans	-59.9	-46.3	175.4	174.3	-100.2	0	0	0	112	E110 R111 I115 L116 Y117	E110-F113 WeakPolarHBondContact O-CB 3.48Å; E110-F113 PolarHBondContact O-N 3.34Å; R111-F113 VanDerWaalsContact C-N 3.28Å; R111-F113 PolarHBondContact O-N 2.9Å; F113-I115 PolarHBondContact O-N 3.45Å; F113-L116 PolarHBondContact O-N 2.98Å; F113-Y117 WeakPolarHBondContact O-CB 3.11Å; F113-Y117 PolarHBondContact O-N 2.94Å
114	V	93.4	Very high	92.5	Very high	32 Å²	32	85.7 Å²	85.7	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-63.4	-40.4	179.1	178.7	0	0	0	0	111.9	E110 R111 I112 Y117 A118 V138 L142	E110-V114 PolarHBondContact O-N 2.95Å; R111-V114 PolarHBondContact O-N 2.89Å; I112-V114 PolarHBondContact O-N 3.45Å; V114-Y117 PolarHBondContact O-N 3.35Å; V114-A118 VanDerWaalsContact O-CB 3.29Å; V114-A118 WeakPolarHBondContact O-CB 3.36Å; V114-A118 PolarHBondContact O-N 3.44Å; V114-V138 HydrophobicContact CG1-CG2 4.29Å; V114-L142 HydrophobicContact CG1-CD2 3.76Å; V114-L142 HydrophobicContact CG1-CG 4.16Å
115	I	93.3	Very high	92.5	Very high	21 Å²	21	82 Å²	82	11%	0.108	40%	0.397	C	S	.	.	H	α-helix	trans	-64.1	-47	177.7	-69.2	158.8	0	0	0	110.7	L100 C103 L104 R111 I112 F113 A118 M119	L100-I115 HydrophobicContact CD1-CB 4.34Å; L100-I115 HydrophobicContact CD1-CG1 3.98Å; L100-I115 HydrophobicContact CD1-CG2 4.25Å; C103-I115 HydrophobicContact CB-CD1 4.29Å; C103-I115 HydrophobicContact CB-CG1 4.2Å; L104-I115 HydrophobicContact CD2-CD1 3.74Å; L104-I115 HydrophobicContact CD2-CG1 4.45Å; L104-I115 HydrophobicContact CD2-CG2 4.37Å; L104-I115 HydrophobicContact CG-CD1 4.11Å; R111-I115 WeakPolarHBondContact O-CD1 3.29Å; R111-I115 VanDerWaalsContact O-CG1 3.25Å; R111-I115 WeakPolarHBondContact O-CG1 3.24Å; R111-I115 PolarHBondContact O-N 3.33Å; I112-I115 PolarHBondContact O-N 3.06Å; F113-I115 PolarHBondContact O-N 3.45Å; I115-A118 PolarHBondContact O-N 2.96Å; I115-M119 HydrophobicContact CG2-SD 4.14Å; I115-M119 WeakPolarHBondContact O-CG 3.39Å; I115-M119 PolarHBondContact O-N 3.25Å
116	L	93.7	Very high	92.6	Very high	101 Å²	101	78.3 Å²	78.3	53%	0.529	39%	0.389	S	S	.	.	H	α-helix	trans	-61.2	-46.5	177.3	-73.2	173.4	0	0	0	110.9	I112 F113 A118 M119 T120	I112-L116 HydrophobicContact CG2-CD1 4.1Å; I112-L116 WeakPolarHBondContact O-CG 3.45Å; I112-L116 PolarHBondContact O-N 3.36Å; F113-L116 PolarHBondContact O-N 2.98Å; L116-A118 PolarHBondContact O-N 3.21Å; L116-M119 PolarHBondContact O-N 3.25Å; L116-T120 WeakPolarHBondContact O-CG2 3.43Å; L116-T120 PolarHBondContact O-N 3.2Å; L116-T120 PolarHBondContact O-OG1 2.98Å
117	Y	95.4	Very high	92.8	Very high	78 Å²	78	73 Å²	73	31%	0.306	37%	0.368	S	S	.	.	H	α-helix	trans	-59.3	-46	177.1	179.8	-143.5	0	0	0	111.8	F113 V114 T120 S121 T134 V138	F113-Y117 WeakPolarHBondContact O-CB 3.11Å; F113-Y117 PolarHBondContact O-N 2.94Å; V114-Y117 PolarHBondContact O-N 3.35Å; Y117-T120 PolarHBondContact O-N 3.4Å; Y117-T120 PolarHBondContact O-OG1 3.28Å; Y117-S121 VanDerWaalsContact CD2-OG 3.23Å; Y117-S121 WeakPolarHBondContact CD2-OG 3.37Å; Y117-S121 WeakPolarHBondContact CE2-OG 3.38Å; Y117-S121 VanDerWaalsContact O-CB 3.24Å; Y117-S121 WeakPolarHBondContact O-CB 3.33Å; Y117-S121 PolarHBondContact O-N 3.03Å; Y117-S121 PolarHBondContact O-OG 3.41Å; Y117-T134 PolarHBondContact OH-O 3.27Å; Y117-V138 HydrophobicContact CD1-CB 3.65Å; Y117-V138 HydrophobicContact CD1-CG1 4.32Å; Y117-V138 HydrophobicContact CD1-CG2 3.83Å; Y117-V138 HydrophobicContact CE1-CB 3.56Å; Y117-V138 HydrophobicContact CE1-CG1 4.14Å; Y117-V138 HydrophobicContact CE1-CG2 4.27Å; Y117-V138 HydrophobicContact CG-CB 4.47Å; Y117-V138 HydrophobicContact CG-CG2 4.49Å
118	A	94.5	Very high	92.8	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-49.9	177.3	0	0	0	0	0	112.1	F96 L100 V114 I115 L116 S121 V122 V138 L142	F96-A118 HydrophobicContact CE2-CB 4.02Å; F96-A118 HydrophobicContact CZ-CB 4.28Å; L100-A118 HydrophobicContact CD1-CB 4.14Å; V114-A118 VanDerWaalsContact O-CB 3.29Å; V114-A118 WeakPolarHBondContact O-CB 3.36Å; V114-A118 PolarHBondContact O-N 3.44Å; I115-A118 PolarHBondContact O-N 2.96Å; L116-A118 PolarHBondContact O-N 3.21Å; A118-S121 PolarHBondContact O-N 3.02Å; A118-V122 WeakPolarHBondContact O-CB 3.26Å; A118-V122 VanDerWaalsContact O-CG2 3.24Å; A118-V122 WeakPolarHBondContact O-CG2 3.1Å; A118-V122 PolarHBondContact O-N 2.87Å; A118-V138 HydrophobicContact CB-CG2 3.73Å; A118-L142 HydrophobicContact CB-CD1 3.75Å
119	M	93.7	Very high	92.9	Very high	118 Å²	118	67.2 Å²	67.2	58%	0.581	34%	0.337	S	S	*	.	H	α-helix	trans	-62.9	-44.9	179.9	-74.3	178.2	46.9	0	0	112.3	I115 L116 Y123	I115-M119 HydrophobicContact CG2-SD 4.14Å; I115-M119 WeakPolarHBondContact O-CG 3.39Å; I115-M119 PolarHBondContact O-N 3.25Å; L116-M119 PolarHBondContact O-N 3.25Å; M119-Y123 PolarHBondContact O-N 3.13Å
120	T	93.9	Very high	93	Very high	68 Å²	68	66 Å²	66	42%	0.417	32%	0.323	S	S	.	.	H	α-helix	trans	-66.6	-42.5	179.2	52.8	0	0	0	0	111.8	L116 Y117 Y123 F124	L116-T120 WeakPolarHBondContact O-CG2 3.43Å; L116-T120 PolarHBondContact O-N 3.2Å; L116-T120 PolarHBondContact O-OG1 2.98Å; Y117-T120 PolarHBondContact O-N 3.4Å; Y117-T120 PolarHBondContact O-OG1 3.28Å; T120-Y123 PolarHBondContact O-N 3.29Å; T120-F124 WeakPolarHBondContact O-CD2 3.23Å; T120-F124 PolarHBondContact O-N 3.43Å
121	S	94.1	Very high	93	Very high	7 Å²	7	60.7 Å²	60.7	5%	0.049	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-36.5	-178.4	-64.7	0	0	0	0	112.2	Y117 A118 Y123 F124 A125	Y117-S121 VanDerWaalsContact CD2-OG 3.23Å; Y117-S121 WeakPolarHBondContact CD2-OG 3.37Å; Y117-S121 WeakPolarHBondContact CE2-OG 3.38Å; Y117-S121 VanDerWaalsContact O-CB 3.24Å; Y117-S121 WeakPolarHBondContact O-CB 3.33Å; Y117-S121 PolarHBondContact O-N 3.03Å; Y117-S121 PolarHBondContact O-OG 3.41Å; A118-S121 PolarHBondContact O-N 3.02Å; S121-Y123 VanDerWaalsContact C-N 3.34Å; S121-F124 PolarHBondContact O-N 2.73Å; S121-A125 WeakPolarHBondContact O-CB 3.24Å; S121-A125 PolarHBondContact O-N 2.98Å
122	V	93.8	Very high	93.1	Very high	63 Å²	63	57.2 Å²	57.2	38%	0.382	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-42.9	174.3	168.8	0	0	0	0	110.9	F96 A118 G126 L135	F96-V122 HydrophobicContact CE1-CG2 3.91Å; F96-V122 HydrophobicContact CE2-CG2 4.41Å; F96-V122 HydrophobicContact CZ-CG2 3.57Å; A118-V122 WeakPolarHBondContact O-CB 3.26Å; A118-V122 VanDerWaalsContact O-CG2 3.24Å; A118-V122 WeakPolarHBondContact O-CG2 3.1Å; A118-V122 PolarHBondContact O-N 2.87Å; V122-G126 PolarHBondContact O-N 2.87Å; V122-L135 HydrophobicContact CB-CD1 4.48Å; V122-L135 HydrophobicContact CG2-CD1 3.6Å
123	Y	93.6	Very high	93.1	Very high	112 Å²	112	60.3 Å²	60.3	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-52.6	175.8	175.9	-92.4	0	0	0	111.5	M119 T120 S121 A125 G126 V127	M119-Y123 PolarHBondContact O-N 3.13Å; T120-Y123 PolarHBondContact O-N 3.29Å; S121-Y123 VanDerWaalsContact C-N 3.34Å; Y123-A125 PolarHBondContact O-N 3.03Å; Y123-G126 PolarHBondContact O-N 3.43Å; Y123-G126 VanDerWaalsContact O-N 3.17Å; Y123-V127 HydrophobicContact CE1-CG2 4.18Å; Y123-V127 PolarHBondContact O-N 3.22Å
124	F	93.4	Very high	93.2	Very high	80 Å²	80	56.3 Å²	56.3	35%	0.351	29%	0.29	S	S	.	.	H	α-helix	trans	-66.8	-37.3	-177	-76.1	-58.8	0	0	0	113.5	L58 T120 S121 G126 V127 M128 L131	L58-F124 HydrophobicContact CB-CD1 4.19Å; L58-F124 HydrophobicContact CB-CE1 3.99Å; L58-F124 HydrophobicContact CD1-CD1 4.1Å; L58-F124 HydrophobicContact CD1-CE1 4.12Å; T120-F124 WeakPolarHBondContact O-CD2 3.23Å; T120-F124 PolarHBondContact O-N 3.43Å; S121-F124 PolarHBondContact O-N 2.73Å; F124-G126 VanDerWaalsContact C-N 3.29Å; F124-G126 PolarHBondContact O-N 3.47Å; F124-V127 PolarHBondContact O-N 3.39Å; F124-M128 PolarHBondContact O-N 3.02Å; F124-M128 VanDerWaalsContact O-N 3.15Å; F124-L131 HydrophobicContact CB-CB 4.48Å; F124-L131 HydrophobicContact CB-CD1 3.83Å; F124-L131 HydrophobicContact CD1-CD1 4.38Å; F124-L131 HydrophobicContact CG-CD1 4.42Å
125	A	92.6	Very high	93.2	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-29.8	174	0	0	0	0	0	112.5	T80 S121 Y123 V127 M132 L135	T80-A125 WeakPolarHBondContact CG2-O 3.39Å; T80-A125 PolarHBondContact OG1-O 3.26Å; S121-A125 WeakPolarHBondContact O-CB 3.24Å; S121-A125 PolarHBondContact O-N 2.98Å; Y123-A125 PolarHBondContact O-N 3.03Å; A125-V127 VanDerWaalsContact C-N 3.35Å; A125-M132 HydrophobicContact CB-SD 4.47Å; A125-L135 HydrophobicContact CB-CB 3.9Å; A125-L135 HydrophobicContact CB-CD2 3.75Å; A125-L135 HydrophobicContact CB-CG 4.4Å
126	G	91.4	Very high	93.2	Very high	39 Å²	39	56.6 Å²	56.6	40%	0.402	29%	0.292	S	S	.	.	H	α-helix	trans	-65.2	-37.4	171.9	0	0	0	0	0	112.8	T80 V122 Y123 F124	T80-G126 WeakPolarHBondContact OG1-CA 3.49Å; T80-G126 PolarHBondContact OG1-O 2.9Å; V122-G126 PolarHBondContact O-N 2.87Å; Y123-G126 PolarHBondContact O-N 3.43Å; Y123-G126 VanDerWaalsContact O-N 3.17Å; F124-G126 VanDerWaalsContact C-N 3.29Å; F124-G126 PolarHBondContact O-N 3.47Å
127	V	91.5	Very high	93.3	Very high	28 Å²	28	55.1 Å²	55.1	17%	0.17	29%	0.289	C	S	.	.	H	α-helix	trans	-77	-35.6	-178.4	176	0	0	0	0	112.6	L58 T61 P79 Y123 F124 A125	L58-V127 HydrophobicContact CD2-CG1 4.19Å; T61-V127 HydrophobicContact CG2-CG1 3.77Å; P79-V127 WeakPolarHBondContact CA-O 3.25Å; Y123-V127 HydrophobicContact CE1-CG2 4.18Å; Y123-V127 PolarHBondContact O-N 3.22Å; F124-V127 PolarHBondContact O-N 3.39Å; A125-V127 VanDerWaalsContact C-N 3.35Å
128	M	91.7	Very high	93.3	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.059	28%	0.275	C	S	.	.			trans	-142.6	128.9	-171.6	-176.9	176.5	-177.9	0	0	112.8	L58 E76 H77 F124 R130 L131	L58-M128 HydrophobicContact CD2-CB 4.21Å; L58-M128 HydrophobicContact CD2-SD 4.19Å; E76-M128 WeakPolarHBondContact O-CE 3.34Å; E76-M128 WeakPolarHBondContact O-CG 3.27Å; H77-M128 HydrophobicContact CB-CE 4.13Å; H77-M128 VanDerWaalsContact CD2-CE 3.45Å; H77-M128 WeakPolarHBondContact CD2-CE 3.41Å; H77-M128 WeakPolarHBondContact CE1-CE 3.27Å; H77-M128 WeakPolarHBondContact ND1-CE 3.4Å; H77-M128 WeakPolarHBondContact NE2-CE 3.41Å; F124-M128 PolarHBondContact O-N 3.02Å; F124-M128 VanDerWaalsContact O-N 3.15Å; M128-R130 HydrophobicContact CE-CB 3.63Å; M128-R130 HydrophobicContact CE-CG 4.42Å; M128-R130 HydrophobicContact CG-CB 4.24Å; M128-R130 PolarHBondContact O-N 2.87Å; M128-R130 HydrophobicContact SD-CB 4.36Å; M128-L131 HydrophobicContact CB-CD1 4.09Å; M128-L131 HydrophobicContact CB-CG 4.2Å; M128-L131 HydrophobicContact CG-CG 4.39Å; M128-L131 PolarHBondContact O-N 3.36Å; M128-L131 VanDerWaalsContact O-N 3.11Å; M128-L131 HydrophobicContact SD-CD1 4.32Å; M128-L131 HydrophobicContact SD-CG 4.22Å
129	I	91.9	Very high	93.3	Very high	68 Å²	68	51.7 Å²	51.7	35%	0.349	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-57	-43.8	-179.5	-66.2	157.3	0	0	0	112.9	Q78 T80 L131 M132	Q78-I129 HydrophobicContact CB-CD1 3.96Å; Q78-I129 WeakPolarHBondContact O-CD1 3.4Å; Q78-I129 VanDerWaalsContact O-CG1 3.24Å; Q78-I129 WeakPolarHBondContact O-CG1 3.16Å; Q78-I129 PolarHBondContact O-N 3.35Å; T80-I129 HydrophobicContact CG2-CB 3.97Å; T80-I129 HydrophobicContact CG2-CG1 3.51Å; I129-L131 PolarHBondContact O-N 3.43Å; I129-L131 VanDerWaalsContact O-N 3.12Å; I129-M132 WeakPolarHBondContact O-CB 3.35Å; I129-M132 PolarHBondContact O-N 2.9Å
130	R	92.2	Very high	93.4	Very high	111 Å²	111	48.9 Å²	48.9	42%	0.419	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-55.9	-32.7	178.9	-170.6	178.3	-79.3	163.3	-5.7	113.3	E76 H77 M128 M132 L133	E76-R130 HydrophobicContact CB-CB 4.29Å; E76-R130 PolarHBondContact O-N 3.07Å; E76-R130 IonicContact OE1-NH2 2.84Å; E76-R130 PolarHBondContact OE1-NH2 2.97Å; E76-R130 IonicContact OE2-CZ 3.63Å; E76-R130 IonicContact OE2-NE 3.1Å; E76-R130 PolarHBondContact OE2-NE 3.45Å; E76-R130 IonicContact OE2-NH2 3.59Å; E76-R130 PolarHBondContact OE2-NH2 3.41Å; H77-R130 PolarHBondContact NE2-NH1 3.3Å; M128-R130 HydrophobicContact CE-CB 3.63Å; M128-R130 HydrophobicContact CE-CG 4.42Å; M128-R130 HydrophobicContact CG-CB 4.24Å; M128-R130 PolarHBondContact O-N 2.87Å; M128-R130 HydrophobicContact SD-CB 4.36Å; R130-M132 PolarHBondContact O-N 3.35Å; R130-L133 PolarHBondContact O-N 2.94Å
131	L	92.6	Very high	93.4	Very high	37 Å²	37	49.6 Å²	49.6	19%	0.194	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-78	-5.9	-176	-63.3	178.6	0	0	0	113	L58 F124 M128 I129 L133 T134 L135	L58-L131 HydrophobicContact CD1-CD1 4.1Å; L58-L131 HydrophobicContact CD2-CD1 3.85Å; F124-L131 HydrophobicContact CB-CB 4.48Å; F124-L131 HydrophobicContact CB-CD1 3.83Å; F124-L131 HydrophobicContact CD1-CD1 4.38Å; F124-L131 HydrophobicContact CG-CD1 4.42Å; M128-L131 HydrophobicContact CB-CD1 4.09Å; M128-L131 HydrophobicContact CB-CG 4.2Å; M128-L131 HydrophobicContact CG-CG 4.39Å; M128-L131 PolarHBondContact O-N 3.36Å; M128-L131 VanDerWaalsContact O-N 3.11Å; M128-L131 HydrophobicContact SD-CD1 4.32Å; M128-L131 HydrophobicContact SD-CG 4.22Å; I129-L131 PolarHBondContact O-N 3.43Å; I129-L131 VanDerWaalsContact O-N 3.12Å; L131-L133 PolarHBondContact O-N 3.13Å; L131-T134 PolarHBondContact O-N 3.27Å; L131-T134 PolarHBondContact O-OG1 3.17Å; L131-L135 PolarHBondContact O-N 3.49Å
132	M	92.2	Very high	93.4	Very high	7 Å²	7	49.2 Å²	49.2	3%	0.034	27%	0.269	C	S	.	.	H	α-helix	trans	-54	-37	168.2	-171	63.6	76.3	0	0	111.8	T80 S85 D88 L89 A125 I129 R130 T134 L135 T136	T80-M132 HydrophobicContact CG2-CE 3.92Å; S85-M132 WeakPolarHBondContact OG-CE 3.4Å; D88-M132 WeakPolarHBondContact OD2-CG 3.44Å; L89-M132 HydrophobicContact CD1-SD 4.25Å; A125-M132 HydrophobicContact CB-SD 4.47Å; I129-M132 WeakPolarHBondContact O-CB 3.35Å; I129-M132 PolarHBondContact O-N 2.9Å; R130-M132 PolarHBondContact O-N 3.35Å; M132-T134 PolarHBondContact O-N 3.22Å; M132-L135 WeakPolarHBondContact O-CB 3.33Å; M132-L135 PolarHBondContact O-N 3.04Å; M132-L135 HydrophobicContact SD-CD2 3.84Å; M132-T136 PolarHBondContact O-N 3.48Å; M132-T136 VanDerWaalsContact O-N 3.12Å; M132-T136 PolarHBondContact O-OG1 3.38Å
133	L	93.4	Very high	93.4	Very high	140 Å²	140	46.2 Å²	46.2	73%	0.733	25%	0.251	S	S	*	.	H	α-helix	trans	-56.9	-35.2	177	-178.6	65.4	0	0	0	112.8	R130 L131 P137	R130-L133 PolarHBondContact O-N 2.94Å; L131-L133 PolarHBondContact O-N 3.13Å; L133-P137 VanDerWaalsContact O-CD 3.28Å; L133-P137 WeakPolarHBondContact O-CD 3.45Å
134	T	94.1	Very high	93.5	Very high	58 Å²	58	42.8 Å²	42.8	36%	0.356	25%	0.249	S	C	.	.	H	α-helix	trans	-80.2	-21.6	178.8	67.3	0	0	0	0	112.8	Y117 L131 M132	Y117-T134 PolarHBondContact OH-O 3.27Å; L131-T134 PolarHBondContact O-N 3.27Å; L131-T134 PolarHBondContact O-OG1 3.17Å; M132-T134 PolarHBondContact O-N 3.22Å
135	L	94.2	Very high	93.5	Very high	14 Å²	14	41.4 Å²	41.4	7%	0.073	25%	0.245	C	C	.	.	H	α-helix	trans	-76.7	-36.4	174.4	175.8	64.2	0	0	0	111.9	V122 A125 L131 M132 V138 V139	V122-L135 HydrophobicContact CB-CD1 4.48Å; V122-L135 HydrophobicContact CG2-CD1 3.6Å; A125-L135 HydrophobicContact CB-CB 3.9Å; A125-L135 HydrophobicContact CB-CD2 3.75Å; A125-L135 HydrophobicContact CB-CG 4.4Å; L131-L135 PolarHBondContact O-N 3.49Å; M132-L135 WeakPolarHBondContact O-CB 3.33Å; M132-L135 PolarHBondContact O-N 3.04Å; M132-L135 HydrophobicContact SD-CD2 3.84Å; L135-V138 HydrophobicContact CD1-CG1 3.93Å; L135-V138 WeakPolarHBondContact O-CG1 3.48Å; L135-V138 PolarHBondContact O-N 2.94Å; L135-V139 HydrophobicContact CD1-CG2 3.68Å; L135-V139 HydrophobicContact CD2-CG2 4.36Å; L135-V139 HydrophobicContact CG-CG2 3.69Å; L135-V139 WeakPolarHBondContact O-CG2 3.48Å; L135-V139 PolarHBondContact O-N 3.47Å; L135-V139 VanDerWaalsContact O-N 3.13Å
136	T	94.2	Very high	93.5	Very high	46 Å²	46	41.4 Å²	41.4	28%	0.282	24%	0.244	S	C	.	.	H	α-helix	trans	-52.3	-46.7	-174.1	-56.2	0	0	0	0	114.3	L89 M132 V138 V139 C140	L89-T136 HydrophobicContact CD2-CG2 4.03Å; M132-T136 PolarHBondContact O-N 3.48Å; M132-T136 VanDerWaalsContact O-N 3.12Å; M132-T136 PolarHBondContact O-OG1 3.38Å; T136-V138 PolarHBondContact O-N 3.12Å; T136-V139 PolarHBondContact O-N 3.3Å; T136-C140 PolarHBondContact O-N 2.93Å; T136-C140 PolarHBondContact O-SG 2.9Å
137	P	95.1	Very high	93.5	Very high	69 Å²	69	40.4 Å²	40.4	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-60.3	-42.8	-179	-25.4	35.1	0	0	0	113.9	L133 C140 V141	L133-P137 VanDerWaalsContact O-CD 3.28Å; L133-P137 WeakPolarHBondContact O-CD 3.45Å; P137-C140 PolarHBondContact O-N 2.97Å; P137-V141 WeakPolarHBondContact O-CG2 3.28Å; P137-V141 PolarHBondContact O-N 3.14Å; P137-V141 VanDerWaalsContact O-N 3.08Å
138	V	94.4	Very high	93.6	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-71.4	-35	-179.8	60.5	0	0	0	0	111.8	V114 Y117 A118 L135 T136 V141 L142	V114-V138 HydrophobicContact CG1-CG2 4.29Å; Y117-V138 HydrophobicContact CD1-CB 3.65Å; Y117-V138 HydrophobicContact CD1-CG1 4.32Å; Y117-V138 HydrophobicContact CD1-CG2 3.83Å; Y117-V138 HydrophobicContact CE1-CB 3.56Å; Y117-V138 HydrophobicContact CE1-CG1 4.14Å; Y117-V138 HydrophobicContact CE1-CG2 4.27Å; Y117-V138 HydrophobicContact CG-CB 4.47Å; Y117-V138 HydrophobicContact CG-CG2 4.49Å; A118-V138 HydrophobicContact CB-CG2 3.73Å; L135-V138 HydrophobicContact CD1-CG1 3.93Å; L135-V138 WeakPolarHBondContact O-CG1 3.48Å; L135-V138 PolarHBondContact O-N 2.94Å; T136-V138 PolarHBondContact O-N 3.12Å; V138-V141 PolarHBondContact O-N 3.16Å; V138-L142 HydrophobicContact CG2-CD1 3.95Å; V138-L142 HydrophobicContact CG2-CG 4.31Å; V138-L142 WeakPolarHBondContact O-CB 3.46Å; V138-L142 WeakPolarHBondContact O-CG 3.47Å; V138-L142 PolarHBondContact O-N 3.38Å
139	V	95.1	Very high	93.5	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-43.4	173.4	168.7	0	0	0	0	110.8	L89 L92 F96 L135 T136 S143	L89-V139 HydrophobicContact CD1-CG1 4.2Å; L89-V139 HydrophobicContact CD1-CG2 4.36Å; L89-V139 HydrophobicContact CD2-CG1 4.17Å; L92-V139 HydrophobicContact CB-CG1 3.54Å; L92-V139 HydrophobicContact CD1-CG1 4.46Å; F96-V139 HydrophobicContact CB-CG1 4.39Å; F96-V139 HydrophobicContact CD2-CG2 3.91Å; F96-V139 HydrophobicContact CE2-CG2 4.34Å; F96-V139 HydrophobicContact CG-CG2 4.34Å; L135-V139 HydrophobicContact CD1-CG2 3.68Å; L135-V139 HydrophobicContact CD2-CG2 4.36Å; L135-V139 HydrophobicContact CG-CG2 3.69Å; L135-V139 WeakPolarHBondContact O-CG2 3.48Å; L135-V139 PolarHBondContact O-N 3.47Å; L135-V139 VanDerWaalsContact O-N 3.13Å; T136-V139 PolarHBondContact O-N 3.3Å; V139-S143 WeakPolarHBondContact O-CB 3.1Å; V139-S143 PolarHBondContact O-N 3.17Å; V139-S143 PolarHBondContact O-OG 3.41Å
140	C	95.2	Very high	93.3	Very high	59 Å²	59	45 Å²	45	40%	0.399	25%	0.253	S	S	.	.	H	α-helix	trans	-61.6	-44.5	175.9	-68.9	0	0	0	0	112.1	T136 P137 G144	T136-C140 PolarHBondContact O-N 2.93Å; T136-C140 PolarHBondContact O-SG 2.9Å; P137-C140 PolarHBondContact O-N 2.97Å; C140-G144 PolarHBondContact O-N 3.44Å
141	V	94.5	Very high	93.1	Very high	82 Å²	82	42 Å²	42	50%	0.497	24%	0.243	S	C	.	.	H	α-helix	trans	-64.1	-49.5	178.8	171.5	0	0	0	0	111.4	P137 V138 G144 I145	P137-V141 WeakPolarHBondContact O-CG2 3.28Å; P137-V141 PolarHBondContact O-N 3.14Å; P137-V141 VanDerWaalsContact O-N 3.08Å; V138-V141 PolarHBondContact O-N 3.16Å; V141-G144 PolarHBondContact O-N 2.74Å; V141-I145 HydrophobicContact CG1-CD1 4.15Å; V141-I145 WeakPolarHBondContact O-CG1 3.43Å; V141-I145 PolarHBondContact O-N 3.47Å
142	L	94.5	Very high	92.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.8	-41.3	-179.1	-71.9	174.5	0	0	0	112.1	F96 G99 L100 V114 A118 V138 G144 I145 A146	F96-L142 HydrophobicContact CD2-CB 4.23Å; F96-L142 HydrophobicContact CD2-CD1 3.65Å; F96-L142 HydrophobicContact CE2-CD1 3.42Å; F96-L142 VanDerWaalsContact CE2-CD1 3.42Å; G99-L142 WeakPolarHBondContact CA-O 3.45Å; L100-L142 HydrophobicContact CB-CD1 4.4Å; L100-L142 HydrophobicContact CD1-CD1 4.3Å; V114-L142 HydrophobicContact CG1-CD2 3.76Å; V114-L142 HydrophobicContact CG1-CG 4.16Å; A118-L142 HydrophobicContact CB-CD1 3.75Å; V138-L142 HydrophobicContact CG2-CD1 3.95Å; V138-L142 HydrophobicContact CG2-CG 4.31Å; V138-L142 WeakPolarHBondContact O-CB 3.46Å; V138-L142 WeakPolarHBondContact O-CG 3.47Å; V138-L142 PolarHBondContact O-N 3.38Å; L142-G144 VanDerWaalsContact C-N 3.3Å; L142-G144 PolarHBondContact O-N 2.88Å; L142-I145 PolarHBondContact O-N 2.98Å; L142-A146 PolarHBondContact O-N 2.85Å
143	S	94.5	Very high	92.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-40.9	172.9	-61.7	0	0	0	0	111.4	L92 S95 V139 I145 A146 F147	L92-S143 PolarHBondContact O-OG 2.93Å; S95-S143 WeakPolarHBondContact OG-CB 3.4Å; S95-S143 PolarHBondContact OG-OG 2.84Å; S95-S143 VanDerWaalsContact OG-OG 3.06Å; V139-S143 WeakPolarHBondContact O-CB 3.1Å; V139-S143 PolarHBondContact O-N 3.17Å; V139-S143 PolarHBondContact O-OG 3.41Å; S143-I145 PolarHBondContact O-N 2.89Å; S143-A146 WeakPolarHBondContact O-CB 3.45Å; S143-A146 PolarHBondContact O-N 3.5Å; S143-F147 WeakPolarHBondContact O-CD2 3.49Å; S143-F147 PolarHBondContact O-N 3.15Å
144	G	94.3	Very high	91.9	Very high	39 Å²	39	44 Å²	44	40%	0.402	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-42.9	175.1	0	0	0	0	0	112.6	C140 V141 L142 S148	C140-G144 PolarHBondContact O-N 3.44Å; V141-G144 PolarHBondContact O-N 2.74Å; L142-G144 VanDerWaalsContact C-N 3.3Å; L142-G144 PolarHBondContact O-N 2.88Å; G144-S148 WeakPolarHBondContact O-CB 3.21Å; G144-S148 PolarHBondContact O-N 2.91Å
145	I	93.4	Very high	91.1	Very high	52 Å²	52	46.8 Å²	46.8	27%	0.267	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-42.8	174	-67.1	167	0	0	0	110.9	V141 L142 S143 S148 Y149	V141-I145 HydrophobicContact CG1-CD1 4.15Å; V141-I145 WeakPolarHBondContact O-CG1 3.43Å; V141-I145 PolarHBondContact O-N 3.47Å; L142-I145 PolarHBondContact O-N 2.98Å; S143-I145 PolarHBondContact O-N 2.89Å; I145-S148 PolarHBondContact O-N 3.24Å; I145-Y149 WeakPolarHBondContact O-CB 3.48Å; I145-Y149 PolarHBondContact O-N 2.85Å
146	A	92.6	Very high	89.9	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-50.6	178.2	0	0	0	0	0	111.8	V98 L142 S143 Y149 I150	V98-A146 HydrophobicContact CB-CB 4.19Å; V98-A146 HydrophobicContact CG1-CB 4.11Å; L142-A146 PolarHBondContact O-N 2.85Å; S143-A146 WeakPolarHBondContact O-CB 3.45Å; S143-A146 PolarHBondContact O-N 3.5Å; A146-Y149 PolarHBondContact O-N 2.87Å; A146-I150 WeakPolarHBondContact O-CD1 3.1Å; A146-I150 VanDerWaalsContact O-CG1 3.28Å; A146-I150 WeakPolarHBondContact O-CG1 3.47Å; A146-I150 PolarHBondContact O-N 2.96Å; A146-I150 VanDerWaalsContact O-N 3.13Å
147	F	92.4	Very high	88.3	Confident	18 Å²	18	53.7 Å²	53.7	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-41	177.1	-71.9	-61.8	0	0	0	111.9	I91 L92 S143 Y149 I150 F151 F224 L228	I91-F147 HydrophobicContact CD1-CE1 4.38Å; I91-F147 HydrophobicContact CD1-CZ 3.88Å; I91-F147 HydrophobicContact CG1-CZ 4.11Å; I91-F147 HydrophobicContact CG2-CZ 4.41Å; L92-F147 HydrophobicContact CD2-CE2 4.4Å; S143-F147 WeakPolarHBondContact O-CD2 3.49Å; S143-F147 PolarHBondContact O-N 3.15Å; F147-Y149 VanDerWaalsContact C-N 3.33Å; F147-Y149 PolarHBondContact O-N 2.84Å; F147-I150 PolarHBondContact O-N 3.07Å; F147-F151 HydrophobicContact CB-CD2 4.31Å; F147-F151 HydrophobicContact CB-CE2 4.19Å; F147-F151 WeakPolarHBondContact O-CD2 3.08Å; F147-F151 PolarHBondContact O-N 2.9Å; F147-F224 AromaticContact CD1-CD1 3.92Å; F147-F224 HydrophobicContact CD1-CD1 3.92Å; F147-F224 HydrophobicContact CD1-CE1 4.35Å; F147-F224 AromaticContact CE1-CD1 3.69Å; F147-F224 HydrophobicContact CE1-CD1 3.69Å; F147-F224 HydrophobicContact CE1-CE1 4.01Å; F147-L228 HydrophobicContact CD2-CD2 4.47Å; F147-L228 HydrophobicContact CE2-CD2 4.29Å; F147-L228 HydrophobicContact CZ-CD2 4.34Å
148	S	92.5	Very high	86.5	Confident	73 Å²	73	54.3 Å²	54.3	51%	0.51	29%	0.287	S	S	.	.	H	α-helix	trans	-59.9	-42.4	176.4	-174.5	0	0	0	0	112	G144 I145 I150 F151 E152	G144-S148 WeakPolarHBondContact O-CB 3.21Å; G144-S148 PolarHBondContact O-N 2.91Å; I145-S148 PolarHBondContact O-N 3.24Å; S148-I150 VanDerWaalsContact C-N 3.34Å; S148-F151 PolarHBondContact O-N 3.28Å; S148-E152 WeakPolarHBondContact O-CB 3.37Å; S148-E152 PolarHBondContact O-N 3.23Å
149	Y	89.7	Confident	84.2	Confident	90 Å²	90	57.2 Å²	57.2	35%	0.353	31%	0.312	S	S	.	.	H	α-helix	trans	-64.6	-40	178.3	-175.9	-94.4	0	0	0	112.1	L102 I145 A146 F147 H153	L102-Y149 HydrophobicContact CD1-CD1 3.98Å; L102-Y149 HydrophobicContact CD1-CD2 4.42Å; L102-Y149 HydrophobicContact CD1-CG 3.77Å; L102-Y149 HydrophobicContact CD2-CD1 3.99Å; L102-Y149 HydrophobicContact CD2-CD2 4.24Å; L102-Y149 HydrophobicContact CD2-CE1 4Å; L102-Y149 HydrophobicContact CD2-CE2 4.22Å; L102-Y149 HydrophobicContact CD2-CG 4.12Å; I145-Y149 WeakPolarHBondContact O-CB 3.48Å; I145-Y149 PolarHBondContact O-N 2.85Å; A146-Y149 PolarHBondContact O-N 2.87Å; F147-Y149 VanDerWaalsContact C-N 3.33Å; F147-Y149 PolarHBondContact O-N 2.84Å; Y149-H153 AromaticContact CE1-CE1 3.67Å; Y149-H153 AromaticContact CE1-ND1 3.79Å; Y149-H153 AromaticContact CE2-CE1 3.45Å; Y149-H153 VanDerWaalsContact CE2-CE1 3.45Å; Y149-H153 WeakPolarHBondContact CE2-CE1 3.23Å; Y149-H153 AromaticContact CZ-CE1 3.2Å; Y149-H153 AromaticContact CZ-ND1 3.78Å; Y149-H153 AromaticContact CZ-NE2 3.86Å; Y149-H153 PolarHBondContact O-N 2.93Å; Y149-H153 PolarHBondContact O-ND1 3.13Å; Y149-H153 PolarHBondContact OH-CE1 2.95Å; Y149-H153 VanDerWaalsContact OH-CE1 3.3Å
150	I	87.5	Confident	82	Confident	41 Å²	41	59.9 Å²	59.9	21%	0.21	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-46.8	175.9	-67.4	165.4	0	0	0	110.4	A146 F147 S148 H153 C154 F224	A146-I150 WeakPolarHBondContact O-CD1 3.1Å; A146-I150 VanDerWaalsContact O-CG1 3.28Å; A146-I150 WeakPolarHBondContact O-CG1 3.47Å; A146-I150 PolarHBondContact O-N 2.96Å; A146-I150 VanDerWaalsContact O-N 3.13Å; F147-I150 PolarHBondContact O-N 3.07Å; S148-I150 VanDerWaalsContact C-N 3.34Å; I150-H153 PolarHBondContact O-N 3.49Å; I150-C154 WeakPolarHBondContact O-CB 3.12Å; I150-C154 PolarHBondContact O-N 3.37Å; I150-C154 PolarHBondContact O-SG 2.73Å; I150-F224 HydrophobicContact CD1-CE1 3.88Å; I150-F224 HydrophobicContact CD1-CE2 4.34Å; I150-F224 HydrophobicContact CD1-CZ 3.73Å; I150-F224 HydrophobicContact CG2-CD2 3.61Å; I150-F224 HydrophobicContact CG2-CE2 3.53Å; I150-F224 HydrophobicContact CG2-CG 4.2Å; I150-F224 HydrophobicContact CG2-CZ 4.04Å
151	F	88.4	Confident	79.8	Confident	48 Å²	48	62.3 Å²	62.3	21%	0.211	34%	0.34	C	S	.	.	H	α-helix	trans	-65.7	-38	178.1	-75.6	-57.8	0	0	0	112.5	F147 S148 H153 C154 L155 F224 L228	F147-F151 HydrophobicContact CB-CD2 4.31Å; F147-F151 HydrophobicContact CB-CE2 4.19Å; F147-F151 WeakPolarHBondContact O-CD2 3.08Å; F147-F151 PolarHBondContact O-N 2.9Å; S148-F151 PolarHBondContact O-N 3.28Å; F151-H153 VanDerWaalsContact C-N 3.32Å; F151-H153 PolarHBondContact O-N 3.38Å; F151-C154 PolarHBondContact O-N 3.08Å; F151-L155 HydrophobicContact CB-CD1 4.18Å; F151-L155 HydrophobicContact CD1-CD1 4.3Å; F151-L155 VanDerWaalsContact O-CB 3.23Å; F151-L155 WeakPolarHBondContact O-CB 3.02Å; F151-L155 WeakPolarHBondContact O-CG 3.09Å; F151-L155 PolarHBondContact O-N 3.38Å; F151-F224 HydrophobicContact CE1-CB 4.19Å; F151-F224 HydrophobicContact CZ-CB 4Å; F151-L228 HydrophobicContact CE2-CD1 3.94Å; F151-L228 HydrophobicContact CZ-CD1 3.92Å
152	E	88.3	Confident	77.3	Confident	108 Å²	108	64.4 Å²	64.4	51%	0.505	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-41.1	174.7	-171	-178.4	175.7	0	0	111.4	S148 R156	S148-E152 WeakPolarHBondContact O-CB 3.37Å; S148-E152 PolarHBondContact O-N 3.23Å; E152-R156 WeakPolarHBondContact O-CB 3.4Å; E152-R156 PolarHBondContact O-N 2.95Å
153	H	83.8	Confident	74.8	Confident	101 Å²	101	68 Å²	68	47%	0.468	37%	0.366	S	S	.	.	H	α-helix	trans	-74.7	-32	177.5	-78.9	71.8	0	0	0	113.8	Y149 I150 F151	Y149-H153 AromaticContact CE1-CE1 3.67Å; Y149-H153 AromaticContact CE1-ND1 3.79Å; Y149-H153 AromaticContact CE2-CE1 3.45Å; Y149-H153 VanDerWaalsContact CE2-CE1 3.45Å; Y149-H153 WeakPolarHBondContact CE2-CE1 3.23Å; Y149-H153 AromaticContact CZ-CE1 3.2Å; Y149-H153 AromaticContact CZ-ND1 3.78Å; Y149-H153 AromaticContact CZ-NE2 3.86Å; Y149-H153 PolarHBondContact O-N 2.93Å; Y149-H153 PolarHBondContact O-ND1 3.13Å; Y149-H153 PolarHBondContact OH-CE1 2.95Å; Y149-H153 VanDerWaalsContact OH-CE1 3.3Å; I150-H153 PolarHBondContact O-N 3.49Å; F151-H153 VanDerWaalsContact C-N 3.32Å; F151-H153 PolarHBondContact O-N 3.38Å
154	C	80.6	Confident	72.5	Confident	19 Å²	19	71.7 Å²	71.7	13%	0.128	39%	0.392	C	S	.	.	H	α-helix	trans	-83.6	-34.4	-178.5	-63.3	0	0	0	0	113	I150 F151	I150-C154 WeakPolarHBondContact O-CB 3.12Å; I150-C154 PolarHBondContact O-N 3.37Å; I150-C154 PolarHBondContact O-SG 2.73Å; F151-C154 PolarHBondContact O-N 3.08Å
155	L	77.6	Confident	70.1	Confident	115 Å²	115	72.9 Å²	72.9	60%	0.602	39%	0.394	S	S	*	.	H	α-helix	trans	-93	-14	-175.9	-64.3	173.7	0	0	0	113.7	F151 D157	F151-L155 HydrophobicContact CB-CD1 4.18Å; F151-L155 HydrophobicContact CD1-CD1 4.3Å; F151-L155 VanDerWaalsContact O-CB 3.23Å; F151-L155 WeakPolarHBondContact O-CB 3.02Å; F151-L155 WeakPolarHBondContact O-CG 3.09Å; F151-L155 PolarHBondContact O-N 3.38Å; L155-D157 PolarHBondContact O-N 3.28Å
156	R	69.5	Low	67.9	Low	117 Å²	117	75.1 Å²	75.1	44%	0.442	41%	0.405	S	S	.	.			trans	-75.3	97.6	175	-167.1	172.1	178.8	166	1.7	109.3	E152 D158 E161 K217	E152-R156 WeakPolarHBondContact O-CB 3.4Å; E152-R156 PolarHBondContact O-N 2.95Å; R156-D158 PolarHBondContact O-N 2.95Å; R156-E161 IonicContact CZ-OE2 3.53Å; R156-E161 IonicContact NE-OE2 3.81Å; R156-E161 IonicContact NH2-OE1 2.72Å; R156-E161 IonicContact NH2-OE2 3.72Å; R156-E161 PolarHBondContact NH2-OE2 3.45Å; R156-K217 PolarHBondContact O-NZ 3.38Å
157	D	60.1	Low	65.7	Low	89 Å²	89	81.6 Å²	81.6	48%	0.476	44%	0.435	S	S	.	.			trans	-75.6	98	165.5	-85.2	-24.6	0	0	0	108.8	L155 A159 A160	L155-D157 PolarHBondContact O-N 3.28Å; D157-A159 PolarHBondContact O-N 3.48Å; D157-A160 PolarHBondContact O-N 2.94Å
158	D	56.7	Low	63.6	Low	82 Å²	82	84.9 Å²	84.9	44%	0.439	46%	0.461	S	S	.	.	H	α-helix	trans	-55.9	-21	172.6	-62.1	-48.5	0	0	0	111.8	R156 A160 Q162 K217	R156-D158 PolarHBondContact O-N 2.95Å; D158-A160 PolarHBondContact O-N 3.43Å; D158-Q162 WeakPolarHBondContact O-CG 3.49Å; D158-Q162 PolarHBondContact O-N 3.1Å; D158-Q162 VanDerWaalsContact O-N 3.15Å; D158-K217 IonicContact OD2-NZ 3.22Å
159	A	47.9	Very low	61.3	Low	64 Å²	64	90.2 Å²	90.2	53%	0.529	48%	0.475	S	S	.	.	H	α-helix	trans	-65	-31.6	174.8	0	0	0	0	0	114	D157 T163	D157-A159 PolarHBondContact O-N 3.48Å; A159-T163 WeakPolarHBondContact O-CB 3.2Å; A159-T163 PolarHBondContact O-N 3.43Å; A159-T163 VanDerWaalsContact O-N 3.15Å; A159-T163 PolarHBondContact O-OG1 3.12Å
160	A	48.3	Very low	59	Low	59 Å²	59	91.7 Å²	91.7	49%	0.488	49%	0.489	S	S	.	.	H	α-helix	trans	-77	-36.1	-179.2	0	0	0	0	0	112.3	D157 D158 S164	D157-A160 PolarHBondContact O-N 2.94Å; D158-A160 PolarHBondContact O-N 3.43Å; A160-S164 WeakPolarHBondContact O-CB 3.2Å; A160-S164 PolarHBondContact O-N 2.92Å; A160-S164 PolarHBondContact O-OG 3.42Å
161	E	48.7	Very low	56.3	Low	111 Å²	111	100.1 Å²	100.1	52%	0.519	52%	0.518	S	S	.	.	H	α-helix	trans	-72.9	-40.3	175.6	-75.3	-172.2	150.8	0	0	111.5	R156 S164 S165	R156-E161 IonicContact CZ-OE2 3.53Å; R156-E161 IonicContact NE-OE2 3.81Å; R156-E161 IonicContact NH2-OE1 2.72Å; R156-E161 IonicContact NH2-OE2 3.72Å; R156-E161 PolarHBondContact NH2-OE2 3.45Å; E161-S164 PolarHBondContact O-N 3.32Å; E161-S165 PolarHBondContact O-N 3.46Å
162	Q	41.3	Very low	53.6	Low	125 Å²	125	103.2 Å²	103.2	58%	0.584	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-42.3	177.1	-72.8	-174.9	18	0	0	112.2	D158 S164 S165 I166	D158-Q162 WeakPolarHBondContact O-CG 3.49Å; D158-Q162 PolarHBondContact O-N 3.1Å; D158-Q162 VanDerWaalsContact O-N 3.15Å; Q162-S164 VanDerWaalsContact C-N 3.3Å; Q162-S164 PolarHBondContact O-N 3.49Å; Q162-S165 PolarHBondContact O-N 3.22Å; Q162-S165 PolarHBondContact O-OG 3.41Å; Q162-I166 VanDerWaalsContact O-CG1 3.32Å; Q162-I166 WeakPolarHBondContact O-CG1 3.43Å; Q162-I166 PolarHBondContact O-N 2.75Å
163	T	43.7	Very low	51.1	Low	75 Å²	75	104.9 Å²	104.9	46%	0.46	56%	0.561	S	S	.	*	H	α-helix	trans	-62.9	-37.5	176.8	-54.8	0	0	0	0	112	A159 Q167	A159-T163 WeakPolarHBondContact O-CB 3.2Å; A159-T163 PolarHBondContact O-N 3.43Å; A159-T163 VanDerWaalsContact O-N 3.15Å; A159-T163 PolarHBondContact O-OG1 3.12Å; T163-Q167 WeakPolarHBondContact O-CB 3.5Å; T163-Q167 WeakPolarHBondContact O-CG 3.45Å; T163-Q167 PolarHBondContact O-N 2.89Å
164	S	44.2	Very low	48.5	Very low	78 Å²	78	106.2 Å²	106.2	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-68.7	-37.7	176.9	-58.5	0	0	0	0	112.3	A160 E161 Q162 S168	A160-S164 WeakPolarHBondContact O-CB 3.2Å; A160-S164 PolarHBondContact O-N 2.92Å; A160-S164 PolarHBondContact O-OG 3.42Å; E161-S164 PolarHBondContact O-N 3.32Å; Q162-S164 VanDerWaalsContact C-N 3.3Å; Q162-S164 PolarHBondContact O-N 3.49Å; S164-S168 WeakPolarHBondContact O-CB 3.41Å; S164-S168 PolarHBondContact O-N 3.3Å; S164-S168 VanDerWaalsContact O-N 3.12Å
165	S	44.2	Very low	46.3	Very low	64 Å²	64	110.6 Å²	110.6	45%	0.448	61%	0.607	S	S	.	*	H	α-helix	trans	-69.9	-40.1	176.6	71.4	0	0	0	0	112.7	E161 Q162 S168 F169	E161-S165 PolarHBondContact O-N 3.46Å; Q162-S165 PolarHBondContact O-N 3.22Å; Q162-S165 PolarHBondContact O-OG 3.41Å; S165-S168 PolarHBondContact O-N 3.39Å; S165-S168 PolarHBondContact O-OG 2.87Å; S165-F169 PolarHBondContact O-N 3.39Å
166	I	48.9	Very low	44.2	Very low	100 Å²	100	111.3 Å²	111.3	51%	0.513	62%	0.617	S	S	.	*	H	α-helix	trans	-69.7	-37.2	178.2	-64.2	166	0	0	0	111.3	Q162 S168 F169 N170	Q162-I166 VanDerWaalsContact O-CG1 3.32Å; Q162-I166 WeakPolarHBondContact O-CG1 3.43Å; Q162-I166 PolarHBondContact O-N 2.75Å; I166-S168 VanDerWaalsContact C-N 3.35Å; I166-F169 PolarHBondContact O-N 3.06Å; I166-N170 PolarHBondContact O-N 2.99Å
167	Q	45.8	Very low	42.4	Very low	136 Å²	136	111.1 Å²	111.1	64%	0.636	63%	0.63	S	S	*	*	H	α-helix	trans	-71	-28.3	174.8	-76.2	-177.2	-1	0	0	113.3	T163	T163-Q167 WeakPolarHBondContact O-CB 3.5Å; T163-Q167 WeakPolarHBondContact O-CG 3.45Å; T163-Q167 PolarHBondContact O-N 2.89Å
168	S	47.2	Very low	41.2	Very low	88 Å²	88	115.3 Å²	115.3	62%	0.615	65%	0.647	S	S	*	*	H	α-helix	trans	-72.3	-28.3	174.5	75.4	0	0	0	0	113.2	S164 S165 I166	S164-S168 WeakPolarHBondContact O-CB 3.41Å; S164-S168 PolarHBondContact O-N 3.3Å; S164-S168 VanDerWaalsContact O-N 3.12Å; S165-S168 PolarHBondContact O-N 3.39Å; S165-S168 PolarHBondContact O-OG 2.87Å; I166-S168 VanDerWaalsContact C-N 3.35Å
169	F	44.7	Very low	40	Very low	184 Å²	184	119.8 Å²	119.8	81%	0.807	67%	0.666	S	S	*	*	H	α-helix	trans	-79.9	-22.7	177.5	-156.1	-96.3	0	0	0	113.1	S165 I166	S165-F169 PolarHBondContact O-N 3.39Å; I166-F169 PolarHBondContact O-N 3.06Å
170	N	41.4	Very low	39.3	Very low	122 Å²	122	122.5 Å²	122.5	65%	0.652	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	15.7	-175.7	-80.7	-21.7	0	0	0	114.9	I166 P172	I166-N170 PolarHBondContact O-N 2.99Å; N170-P172 WeakPolarHBondContact O-CD 3.1Å
171	R	31.4	Very low	38.5	Very low	217 Å²	217	127.6 Å²	127.6	82%	0.819	70%	0.699	S	S	*	*			trans	-82.5	115	171.4	-112.3	-177.8	-171.5	179.3	4.4	110.3	T173	R171-T173 PolarHBondContact O-N 3.48Å
172	P	32.2	Very low	37.8	Very low	113 Å²	113	131.6 Å²	131.6	73%	0.734	71%	0.714	S	S	*	*			trans	-71.7	118.4	176.3	20.9	-14.8	0	0	0	109	N170 T174	N170-P172 WeakPolarHBondContact O-CD 3.1Å; P172-T174 PolarHBondContact O-N 3.44Å; P172-T174 VanDerWaalsContact O-N 3.12Å
173	T	34.3	Very low	37.3	Very low	144 Å²	144	130.6 Å²	130.6	88%	0.883	72%	0.721	S	S	*	*			trans	-65.7	104.1	166.4	39.7	0	0	0	0	109.3	R171	R171-T173 PolarHBondContact O-N 3.48Å
174	T	30.8	Very low	36.7	Very low	128 Å²	128	136.1 Å²	136.1	79%	0.785	74%	0.739	S	S	*	*			trans	-79.6	148.5	170.6	-10.7	0	0	0	0	110.5	P172	P172-T174 PolarHBondContact O-N 3.44Å; P172-T174 VanDerWaalsContact O-N 3.12Å
175	S	34.4	Very low	36.1	Very low	111 Å²	111	138 Å²	138	78%	0.776	74%	0.743	S	S	*	*			trans	83.7	118	-173.6	74.6	0	0	0	0	113.6
176	T	33.5	Very low	35.7	Very low	130 Å²	130	143 Å²	143	80%	0.798	76%	0.757	S	S	*	*			cis	-160.3	146.1	38.9	-41.8	0	0	0	0	108.8
177	P	30.9	Very low	35	Very low	113 Å²	113	144 Å²	144	73%	0.734	77%	0.767	S	S	*	*			trans	-94.8	123.3	-173.3	33.9	-26.6	0	0	0	111.5
178	E	33.8	Very low	34.5	Very low	178 Å²	178	146.4 Å²	146.4	83%	0.832	78%	0.781	S	S	*	*			trans	-160	110.8	158.6	-114.2	164.2	-151.6	0	0	113.3
179	Q	31.9	Very low	34	Very low	176 Å²	176	153 Å²	153	82%	0.822	79%	0.794	S	S	*	*			trans	46.2	112.3	138.2	-61.7	177.6	0.6	0	0	119.6
180	S	33.1	Very low	33.7	Very low	121 Å²	121	150.2 Å²	150.2	85%	0.846	79%	0.788	S	S	*	*				172.8	132.5	99.9	47.2	0	0	0	0	112.7
181	L	31.1	Very low	33.4	Very low	165 Å²	165	152.2 Å²	152.2	86%	0.864	79%	0.79	S	S	*	*			trans	-63.7	147.6	171.5	-77.3	85.8	0	0	0	112
182	K	34.9	Very low	33.5	Very low	195 Å²	195	150.4 Å²	150.4	85%	0.848	79%	0.788	S	S	*	*				-178.8	126.9	115.7	-99.6	169.2	-176.9	-179.1	0	115.3
183	S	31.2	Very low	33.5	Very low	104 Å²	104	150.9 Å²	150.9	73%	0.727	79%	0.792	S	S	*	*			trans	58	115.5	143.5	59.7	0	0	0	0	120.6
184	K	31.1	Very low	33.4	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	78%	0.782	S	S	*	*				58.9	127.6	95.1	-84.8	-176.6	171.7	-179.4	0	112.7
185	D	31.6	Very low	33.7	Very low	118 Å²	118	151.3 Å²	151.3	63%	0.631	78%	0.783	S	S	*	*			cis	-174.5	161	45.2	-129.5	6.9	0	0	0	111
186	K	36.3	Very low	34	Very low	169 Å²	169	151.7 Å²	151.7	74%	0.735	78%	0.775	S	S	*	*			trans	83.5	98.3	146.4	-72.1	170.3	-176.6	174.1	0	123.1
187	T	32.5	Very low	34.4	Very low	120 Å²	120	148 Å²	148	74%	0.736	76%	0.762	S	S	*	*				37.6	120	117.5	60.6	0	0	0	0	120.6
188	M	37	Very low	34.7	Very low	187 Å²	187	148.8 Å²	148.8	92%	0.921	76%	0.761	S	S	*	*				-174.5	132.8	114	-100.7	-162.1	-80.9	0	0	112
189	Y	36.7	Very low	35.2	Very low	227 Å²	227	142.9 Å²	142.9	89%	0.89	74%	0.742	S	S	*	*			trans	-76.8	143.3	168.6	-64.3	-97.3	0	0	0	110.2
190	D	37.8	Very low	35.9	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	73%	0.727	S	S	*	*				-175.8	146.5	123.8	-142	-4	0	0	0	114.4
191	K	34.9	Very low	36.5	Very low	163 Å²	163	136.2 Å²	136.2	71%	0.709	71%	0.705	S	S	*	*			trans	70.6	102.2	150	-82.9	159.3	-174.5	138.2	0	122.7
192	K	34.5	Very low	37.3	Very low	179 Å²	179	137 Å²	137	78%	0.778	70%	0.697	S	S	*	*				153.5	122.4	89.6	-102.2	179.8	179.2	-179.2	0	112
193	P	31.6	Very low	38	Very low	124 Å²	124	133.8 Å²	133.8	81%	0.805	69%	0.685	S	S	*	*			trans	-97.9	100.2	171.7	34.2	-23.4	0	0	0	109.9
194	S	31.5	Very low	38.8	Very low	98 Å²	98	135.7 Å²	135.7	69%	0.685	68%	0.682	S	S	*	*			trans	-163.6	54	171.8	70.1	0	0	0	0	114
195	K	37.4	Very low	39.7	Very low	182 Å²	182	132.4 Å²	132.4	79%	0.791	67%	0.67	S	S	*	*	S	Bend	trans	-150.7	8	165.9	-77.4	-160.3	178.9	176.3	0	115.3
196	I	41.8	Very low	40.7	Very low	120 Å²	120	131.4 Å²	131.4	62%	0.615	66%	0.664	S	S	*	*	H	α-helix	trans	-76.3	-38.3	-172.8	-62.7	167.2	0	0	0	111.6	N198 A199 E200	I196-N198 VanDerWaalsContact C-N 3.31Å; I196-N198 PolarHBondContact O-N 3.2Å; I196-A199 PolarHBondContact O-N 3.03Å; I196-A199 VanDerWaalsContact O-N 3.11Å; I196-E200 PolarHBondContact O-N 2.99Å
197	G	40	Very low	41.7	Very low	52 Å²	52	127 Å²	127	54%	0.536	65%	0.651	S	S	.	*	H	α-helix	trans	-67.1	-23.3	179.6	0	0	0	0	0	115.7
198	N	38.6	Very low	42.6	Very low	130 Å²	130	125.3 Å²	125.3	70%	0.695	64%	0.641	S	S	*	*	H	α-helix	trans	-88.4	-15.4	175.4	-73.3	0.6	0	0	0	112.8	I196 R202	I196-N198 VanDerWaalsContact C-N 3.31Å; I196-N198 PolarHBondContact O-N 3.2Å; N198-R202 WeakPolarHBondContact O-CB 3.47Å; N198-R202 PolarHBondContact O-N 3.43Å
199	A	43.9	Very low	43.5	Very low	53 Å²	53	122.7 Å²	122.7	44%	0.438	63%	0.626	S	S	.	*	H	α-helix	trans	-79.7	-46.2	175.3	0	0	0	0	0	110	I196 A201 R202 E203	I196-A199 PolarHBondContact O-N 3.03Å; I196-A199 VanDerWaalsContact O-N 3.11Å; A199-A201 PolarHBondContact O-N 3.5Å; A199-R202 PolarHBondContact O-N 3.01Å; A199-E203 VanDerWaalsContact O-CB 3.3Å; A199-E203 WeakPolarHBondContact O-CB 3.32Å; A199-E203 PolarHBondContact O-N 2.94Å
200	E	45.8	Very low	44.6	Very low	111 Å²	111	116.8 Å²	116.8	52%	0.519	61%	0.61	S	S	.	*	H	α-helix	trans	-63.9	-38.4	177.4	-68.7	173.1	165.8	0	0	112.4	I196 E203 Q204	I196-E200 PolarHBondContact O-N 2.99Å; E200-E203 PolarHBondContact O-N 2.96Å; E200-Q204 WeakPolarHBondContact O-CB 3.48Å; E200-Q204 WeakPolarHBondContact O-CG 3.34Å; E200-Q204 PolarHBondContact O-N 3.35Å
201	A	47.2	Very low	45.6	Very low	46 Å²	46	116.4 Å²	116.4	38%	0.38	60%	0.604	S	S	.	*	H	α-helix	trans	-68.4	-34.4	174.9	0	0	0	0	0	112.9	A199 Q205	A199-A201 PolarHBondContact O-N 3.5Å; A201-Q205 WeakPolarHBondContact O-CB 3.41Å; A201-Q205 VanDerWaalsContact O-CG 3.31Å; A201-Q205 WeakPolarHBondContact O-CG 3.38Å; A201-Q205 PolarHBondContact O-N 3.18Å
202	R	47.8	Very low	46.8	Very low	181 Å²	181	115.7 Å²	115.7	68%	0.683	60%	0.601	S	S	*	*	H	α-helix	trans	-72	-37	173	-97	-177.8	167.1	-176.5	-5.1	112.2	N198 A199 Q205 L206	N198-R202 WeakPolarHBondContact O-CB 3.47Å; N198-R202 PolarHBondContact O-N 3.43Å; A199-R202 PolarHBondContact O-N 3.01Å; R202-Q205 PolarHBondContact O-N 3.06Å; R202-L206 VanDerWaalsContact O-CB 3.31Å; R202-L206 WeakPolarHBondContact O-CB 3.27Å; R202-L206 WeakPolarHBondContact O-CD1 3.42Å; R202-L206 VanDerWaalsContact O-CG 3.27Å; R202-L206 WeakPolarHBondContact O-CG 3.2Å; R202-L206 PolarHBondContact O-N 3.39Å
203	E	49.1	Very low	48.6	Very low	129 Å²	129	109.2 Å²	109.2	60%	0.603	58%	0.578	S	S	*	*	H	α-helix	trans	-70.7	-40.7	179	-159.6	168.1	-157.9	0	0	110.4	A199 E200 L206 V207	A199-E203 VanDerWaalsContact O-CB 3.3Å; A199-E203 WeakPolarHBondContact O-CB 3.32Å; A199-E203 PolarHBondContact O-N 2.94Å; E200-E203 PolarHBondContact O-N 2.96Å; E203-L206 PolarHBondContact O-N 3.19Å; E203-V207 WeakPolarHBondContact O-CB 3.39Å; E203-V207 WeakPolarHBondContact O-CG2 3.32Å; E203-V207 PolarHBondContact O-N 3.4Å
204	Q	48.1	Very low	50.8	Low	143 Å²	143	105.5 Å²	105.5	67%	0.668	56%	0.556	S	S	*	*	H	α-helix	trans	-64.7	-41.1	170.8	-74	176.6	-4.5	0	0	112.3	E200 V207 T208	E200-Q204 WeakPolarHBondContact O-CB 3.48Å; E200-Q204 WeakPolarHBondContact O-CG 3.34Å; E200-Q204 PolarHBondContact O-N 3.35Å; Q204-V207 PolarHBondContact O-N 3.11Å; Q204-T208 PolarHBondContact O-N 3.24Å; Q204-T208 PolarHBondContact O-OG1 3.12Å
205	Q	48.7	Very low	53.2	Low	123 Å²	123	106 Å²	106	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-65	-42.5	174.6	-82.7	178.8	-31.6	0	0	112.8	A201 R202 T208 E209	A201-Q205 WeakPolarHBondContact O-CB 3.41Å; A201-Q205 VanDerWaalsContact O-CG 3.31Å; A201-Q205 WeakPolarHBondContact O-CG 3.38Å; A201-Q205 PolarHBondContact O-N 3.18Å; R202-Q205 PolarHBondContact O-N 3.06Å; Q205-T208 PolarHBondContact O-N 3.34Å; Q205-T208 PolarHBondContact O-OG1 3.47Å; Q205-E209 WeakPolarHBondContact O-CB 3.19Å; Q205-E209 WeakPolarHBondContact O-CG 3.28Å; Q205-E209 PolarHBondContact O-N 2.99Å
206	L	53.3	Low	55.5	Low	96 Å²	96	101.4 Å²	101.4	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-41.7	174.9	-79.7	159.5	0	0	0	111.2	R202 E203 E209 D210	R202-L206 VanDerWaalsContact O-CB 3.31Å; R202-L206 WeakPolarHBondContact O-CB 3.27Å; R202-L206 WeakPolarHBondContact O-CD1 3.42Å; R202-L206 VanDerWaalsContact O-CG 3.27Å; R202-L206 WeakPolarHBondContact O-CG 3.2Å; R202-L206 PolarHBondContact O-N 3.39Å; E203-L206 PolarHBondContact O-N 3.19Å; L206-E209 PolarHBondContact O-N 3.26Å; L206-D210 VanDerWaalsContact O-CB 3.26Å; L206-D210 WeakPolarHBondContact O-CB 3.27Å; L206-D210 PolarHBondContact O-N 3.02Å
207	V	57	Low	57.5	Low	77 Å²	77	98.2 Å²	98.2	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-37.7	175.5	172.5	0	0	0	0	111.5	E203 Q204 E211	E203-V207 WeakPolarHBondContact O-CB 3.39Å; E203-V207 WeakPolarHBondContact O-CG2 3.32Å; E203-V207 PolarHBondContact O-N 3.4Å; Q204-V207 PolarHBondContact O-N 3.11Å; V207-E211 WeakPolarHBondContact O-CB 3.18Å; V207-E211 WeakPolarHBondContact O-CG 3.45Å; V207-E211 PolarHBondContact O-N 3.07Å
208	T	52.5	Low	59.6	Low	85 Å²	85	99.8 Å²	99.8	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-71.9	-36.1	175.8	6.8	0	0	0	0	112.6	Q204 Q205 F212	Q204-T208 PolarHBondContact O-N 3.24Å; Q204-T208 PolarHBondContact O-OG1 3.12Å; Q205-T208 PolarHBondContact O-N 3.34Å; Q205-T208 PolarHBondContact O-OG1 3.47Å; T208-F212 VanDerWaalsContact O-CB 3.24Å; T208-F212 WeakPolarHBondContact O-CB 3.37Å; T208-F212 PolarHBondContact O-N 3.17Å
209	E	54.6	Low	62	Low	131 Å²	131	99 Å²	99	61%	0.612	51%	0.51	S	S	*	.	H	α-helix	trans	-68.2	-40.2	173.7	-76.1	-176.4	173.3	0	0	111.4	Q205 L206 F212 S213	Q205-E209 WeakPolarHBondContact O-CB 3.19Å; Q205-E209 WeakPolarHBondContact O-CG 3.28Å; Q205-E209 PolarHBondContact O-N 2.99Å; L206-E209 PolarHBondContact O-N 3.26Å; E209-F212 PolarHBondContact O-N 3.25Å; E209-S213 VanDerWaalsContact O-CB 3.25Å; E209-S213 WeakPolarHBondContact O-CB 3.24Å; E209-S213 PolarHBondContact O-N 2.97Å
210	D	60.1	Low	64.1	Low	103 Å²	103	98.8 Å²	98.8	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-68.4	-43.1	176.2	-78.9	-22.2	0	0	0	111.6	L206 S213 S214	L206-D210 VanDerWaalsContact O-CB 3.26Å; L206-D210 WeakPolarHBondContact O-CB 3.27Å; L206-D210 PolarHBondContact O-N 3.02Å; D210-S213 PolarHBondContact O-N 3.37Å; D210-S213 PolarHBondContact O-OG 3.46Å; D210-S214 WeakPolarHBondContact O-CB 3.3Å; D210-S214 PolarHBondContact O-N 3.14Å
211	E	59.6	Low	66	Low	119 Å²	119	94.6 Å²	94.6	56%	0.556	49%	0.486	S	S	*	.	H	α-helix	trans	-64.1	-41.4	173.5	-80.3	-169.3	165.4	0	0	112	V207 S213 S214 N215	V207-E211 WeakPolarHBondContact O-CB 3.18Å; V207-E211 WeakPolarHBondContact O-CG 3.45Å; V207-E211 PolarHBondContact O-N 3.07Å; E211-S213 VanDerWaalsContact C-N 3.34Å; E211-S214 PolarHBondContact O-N 3.02Å; E211-N215 WeakPolarHBondContact O-CB 3.46Å; E211-N215 PolarHBondContact O-N 3.26Å; E211-N215 PolarHBondContact O-ND2 3.35Å
212	F	59.6	Low	67.9	Low	148 Å²	148	97.2 Å²	97.2	65%	0.649	49%	0.494	S	S	*	.	H	α-helix	trans	-64.7	-40.5	175.2	-175.4	-102.2	0	0	0	111.2	T208 E209 L216	T208-F212 VanDerWaalsContact O-CB 3.24Å; T208-F212 WeakPolarHBondContact O-CB 3.37Å; T208-F212 PolarHBondContact O-N 3.17Å; E209-F212 PolarHBondContact O-N 3.25Å; F212-L216 VanDerWaalsContact O-CB 3.25Å; F212-L216 WeakPolarHBondContact O-CB 3.45Å; F212-L216 PolarHBondContact O-N 3.38Å
213	S	73	Confident	70	Confident	42 Å²	42	90.9 Å²	90.9	29%	0.294	48%	0.48	S	S	.	.	H	α-helix	trans	-66.3	-38.5	176.9	83.8	0	0	0	0	112.3	E209 D210 E211 L216 K217	E209-S213 VanDerWaalsContact O-CB 3.25Å; E209-S213 WeakPolarHBondContact O-CB 3.24Å; E209-S213 PolarHBondContact O-N 2.97Å; D210-S213 PolarHBondContact O-N 3.37Å; D210-S213 PolarHBondContact O-OG 3.46Å; E211-S213 VanDerWaalsContact C-N 3.34Å; S213-L216 PolarHBondContact O-N 3.22Å; S213-K217 WeakPolarHBondContact O-CB 3.36Å; S213-K217 VanDerWaalsContact O-CG 3.27Å; S213-K217 WeakPolarHBondContact O-CG 3.45Å; S213-K217 PolarHBondContact O-N 3Å
214	S	76.2	Confident	71.9	Confident	47 Å²	47	87.5 Å²	87.5	33%	0.329	46%	0.463	S	S	.	.	H	α-helix	trans	-69.4	-44.1	178.2	-179.8	0	0	0	0	111.8	D210 E211 L216 K217 T218	D210-S214 WeakPolarHBondContact O-CB 3.3Å; D210-S214 PolarHBondContact O-N 3.14Å; E211-S214 PolarHBondContact O-N 3.02Å; S214-L216 VanDerWaalsContact C-N 3.33Å; S214-L216 PolarHBondContact O-N 3.16Å; S214-K217 PolarHBondContact O-N 3.32Å; S214-T218 WeakPolarHBondContact O-CB 3.37Å; S214-T218 PolarHBondContact O-N 3.05Å; S214-T218 PolarHBondContact O-OG1 2.96Å
215	N	82.5	Confident	74	Confident	109 Å²	109	85.8 Å²	85.8	58%	0.583	46%	0.458	S	S	*	.	H	α-helix	trans	-61.7	-41.2	173.1	-74.5	-48.5	0	0	0	111.6	E211 T218 L219	E211-N215 WeakPolarHBondContact O-CB 3.46Å; E211-N215 PolarHBondContact O-N 3.26Å; E211-N215 PolarHBondContact O-ND2 3.35Å; N215-T218 PolarHBondContact O-N 2.81Å; N215-L219 WeakPolarHBondContact O-CB 3.28Å; N215-L219 PolarHBondContact O-N 2.67Å
216	L	85.2	Confident	76	Confident	85 Å²	85	83.2 Å²	83.2	45%	0.445	45%	0.451	S	S	.	.	H	α-helix	trans	-64.8	-46.2	176.2	-177.1	65.9	0	0	0	111.8	F212 S213 S214 T218 L219 V220	F212-L216 VanDerWaalsContact O-CB 3.25Å; F212-L216 WeakPolarHBondContact O-CB 3.45Å; F212-L216 PolarHBondContact O-N 3.38Å; S213-L216 PolarHBondContact O-N 3.22Å; S214-L216 VanDerWaalsContact C-N 3.33Å; S214-L216 PolarHBondContact O-N 3.16Å; L216-T218 VanDerWaalsContact C-N 3.29Å; L216-T218 PolarHBondContact O-N 2.83Å; L216-L219 PolarHBondContact O-N 3.1Å; L216-V220 HydrophobicContact CD1-CG2 4.41Å; L216-V220 HydrophobicContact CG-CG2 4.49Å; L216-V220 WeakPolarHBondContact O-CB 3.5Å; L216-V220 VanDerWaalsContact O-CG2 3.26Å; L216-V220 WeakPolarHBondContact O-CG2 3.37Å; L216-V220 PolarHBondContact O-N 3.28Å
217	K	85	Confident	77.9	Confident	52 Å²	52	80.8 Å²	80.8	23%	0.226	44%	0.44	C	S	.	.	H	α-helix	trans	-57.5	-42.6	175.5	-78.6	177.1	179.1	-176.1	0	111.6	R156 D158 S213 S214 V220 S221	R156-K217 PolarHBondContact O-NZ 3.38Å; D158-K217 IonicContact OD2-NZ 3.22Å; S213-K217 WeakPolarHBondContact O-CB 3.36Å; S213-K217 VanDerWaalsContact O-CG 3.27Å; S213-K217 WeakPolarHBondContact O-CG 3.45Å; S213-K217 PolarHBondContact O-N 3Å; S214-K217 PolarHBondContact O-N 3.32Å; K217-V220 PolarHBondContact O-N 3.38Å; K217-S221 WeakPolarHBondContact O-CB 3.27Å; K217-S221 PolarHBondContact O-N 2.97Å; K217-S221 PolarHBondContact O-OG 3.41Å
218	T	83.9	Confident	79.6	Confident	85 Å²	85	79.9 Å²	79.9	52%	0.521	43%	0.432	S	S	.	.	H	α-helix	trans	-66.6	-41.1	177	-55.2	0	0	0	0	112.1	S214 N215 L216 S221 L222	S214-T218 WeakPolarHBondContact O-CB 3.37Å; S214-T218 PolarHBondContact O-N 3.05Å; S214-T218 PolarHBondContact O-OG1 2.96Å; N215-T218 PolarHBondContact O-N 2.81Å; L216-T218 VanDerWaalsContact C-N 3.29Å; L216-T218 PolarHBondContact O-N 2.83Å; T218-S221 PolarHBondContact O-N 3.41Å; T218-S221 PolarHBondContact O-OG 3.1Å; T218-L222 WeakPolarHBondContact O-CB 3.23Å; T218-L222 PolarHBondContact O-N 3.46Å
219	L	88.1	Confident	81.6	Confident	114 Å²	114	78.2 Å²	78.2	60%	0.597	43%	0.427	S	S	*	.	H	α-helix	trans	-64.1	-42.3	175.8	-177.3	67.3	0	0	0	111.7	N215 L216 L222 A223	N215-L219 WeakPolarHBondContact O-CB 3.28Å; N215-L219 PolarHBondContact O-N 2.67Å; L216-L219 PolarHBondContact O-N 3.1Å; L219-L222 PolarHBondContact O-N 3.25Å; L219-A223 WeakPolarHBondContact O-CB 3.48Å; L219-A223 PolarHBondContact O-N 2.89Å
220	V	88.1	Confident	83.5	Confident	48 Å²	48	76.2 Å²	76.2	29%	0.291	42%	0.42	S	S	.	.	H	α-helix	trans	-65.8	-45.3	178	172.8	0	0	0	0	110.8	L216 K217 L222 A223 F224	L216-V220 HydrophobicContact CD1-CG2 4.41Å; L216-V220 HydrophobicContact CG-CG2 4.49Å; L216-V220 WeakPolarHBondContact O-CB 3.5Å; L216-V220 VanDerWaalsContact O-CG2 3.26Å; L216-V220 WeakPolarHBondContact O-CG2 3.37Å; L216-V220 PolarHBondContact O-N 3.28Å; K217-V220 PolarHBondContact O-N 3.38Å; V220-L222 VanDerWaalsContact C-N 3.32Å; V220-L222 PolarHBondContact O-N 3.21Å; V220-A223 WeakPolarHBondContact O-CB 3.37Å; V220-A223 PolarHBondContact O-N 3.3Å; V220-F224 HydrophobicContact CG1-CD2 3.69Å; V220-F224 HydrophobicContact CG1-CE2 3.65Å; V220-F224 VanDerWaalsContact O-CD2 3.27Å; V220-F224 WeakPolarHBondContact O-CD2 3.31Å; V220-F224 PolarHBondContact O-N 2.79Å
221	S	85.5	Confident	85.2	Confident	23 Å²	23	73.6 Å²	73.6	16%	0.161	40%	0.403	C	S	.	.	H	α-helix	trans	-62.2	-40.8	178	70.8	0	0	0	0	111.7	K217 T218 F224 L225	K217-S221 WeakPolarHBondContact O-CB 3.27Å; K217-S221 PolarHBondContact O-N 2.97Å; K217-S221 PolarHBondContact O-OG 3.41Å; T218-S221 PolarHBondContact O-N 3.41Å; T218-S221 PolarHBondContact O-OG 3.1Å; S221-F224 PolarHBondContact O-N 3.13Å; S221-L225 WeakPolarHBondContact O-CB 3.37Å; S221-L225 PolarHBondContact O-N 3.46Å
222	L	88.8	Confident	86.9	Confident	102 Å²	102	72 Å²	72	53%	0.534	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-43.6	174.2	-174.4	63.8	0	0	0	111.5	T218 L219 V220 F224 L225 T226	T218-L222 WeakPolarHBondContact O-CB 3.23Å; T218-L222 PolarHBondContact O-N 3.46Å; L219-L222 PolarHBondContact O-N 3.25Å; V220-L222 VanDerWaalsContact C-N 3.32Å; V220-L222 PolarHBondContact O-N 3.21Å; L222-F224 PolarHBondContact O-N 3.01Å; L222-L225 PolarHBondContact O-N 3.34Å; L222-T226 WeakPolarHBondContact O-CG2 3.46Å; L222-T226 PolarHBondContact O-N 2.96Å
223	A	90.9	Very high	88.7	Confident	47 Å²	47	70.6 Å²	70.6	39%	0.388	40%	0.399	S	S	.	.	H	α-helix	trans	-59.1	-48.1	176.9	0	0	0	0	0	111.6	L219 V220 L225 T226 V227	L219-A223 WeakPolarHBondContact O-CB 3.48Å; L219-A223 PolarHBondContact O-N 2.89Å; V220-A223 WeakPolarHBondContact O-CB 3.37Å; V220-A223 PolarHBondContact O-N 3.3Å; A223-L225 VanDerWaalsContact C-N 3.31Å; A223-L225 PolarHBondContact O-N 2.88Å; A223-T226 PolarHBondContact O-N 3.13Å; A223-T226 PolarHBondContact O-OG1 3.47Å; A223-V227 WeakPolarHBondContact O-CB 3.47Å; A223-V227 VanDerWaalsContact O-CG2 3.28Å; A223-V227 WeakPolarHBondContact O-CG2 3.44Å; A223-V227 PolarHBondContact O-N 3.38Å
224	F	90	Very high	89.8	Confident	59 Å²	59	70 Å²	70	26%	0.259	39%	0.392	S	S	.	.	H	α-helix	trans	-63.5	-35.7	176.5	-81.4	-72.3	0	0	0	112.9	F147 I150 F151 V220 S221 L222 V227 L228	F147-F224 AromaticContact CD1-CD1 3.92Å; F147-F224 HydrophobicContact CD1-CD1 3.92Å; F147-F224 HydrophobicContact CD1-CE1 4.35Å; F147-F224 AromaticContact CE1-CD1 3.69Å; F147-F224 HydrophobicContact CE1-CD1 3.69Å; F147-F224 HydrophobicContact CE1-CE1 4.01Å; I150-F224 HydrophobicContact CD1-CE1 3.88Å; I150-F224 HydrophobicContact CD1-CE2 4.34Å; I150-F224 HydrophobicContact CD1-CZ 3.73Å; I150-F224 HydrophobicContact CG2-CD2 3.61Å; I150-F224 HydrophobicContact CG2-CE2 3.53Å; I150-F224 HydrophobicContact CG2-CG 4.2Å; I150-F224 HydrophobicContact CG2-CZ 4.04Å; F151-F224 HydrophobicContact CE1-CB 4.19Å; F151-F224 HydrophobicContact CZ-CB 4Å; V220-F224 HydrophobicContact CG1-CD2 3.69Å; V220-F224 HydrophobicContact CG1-CE2 3.65Å; V220-F224 VanDerWaalsContact O-CD2 3.27Å; V220-F224 WeakPolarHBondContact O-CD2 3.31Å; V220-F224 PolarHBondContact O-N 2.79Å; S221-F224 PolarHBondContact O-N 3.13Å; L222-F224 PolarHBondContact O-N 3.01Å; F224-V227 PolarHBondContact O-N 3.29Å; F224-L228 WeakPolarHBondContact O-CG 3.46Å; F224-L228 PolarHBondContact O-N 2.98Å
225	L	90.6	Very high	90.7	Very high	106 Å²	106	69.7 Å²	69.7	56%	0.555	39%	0.389	S	S	*	.	H	α-helix	trans	-66.5	-41.6	175.1	-167.5	146.7	0	0	0	112.1	S221 L222 A223 V227 L228 A229	S221-L225 WeakPolarHBondContact O-CB 3.37Å; S221-L225 PolarHBondContact O-N 3.46Å; L222-L225 PolarHBondContact O-N 3.34Å; A223-L225 VanDerWaalsContact C-N 3.31Å; A223-L225 PolarHBondContact O-N 2.88Å; L225-V227 VanDerWaalsContact C-N 3.28Å; L225-V227 PolarHBondContact O-N 3.34Å; L225-L228 PolarHBondContact O-N 3.14Å; L225-A229 PolarHBondContact O-N 3.35Å
226	T	91.4	Very high	91.4	Very high	69 Å²	69	68.8 Å²	68.8	42%	0.423	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-39.4	174.9	61.1	0	0	0	0	111.9	L222 A223 A229 I230	L222-T226 WeakPolarHBondContact O-CG2 3.46Å; L222-T226 PolarHBondContact O-N 2.96Å; A223-T226 PolarHBondContact O-N 3.13Å; A223-T226 PolarHBondContact O-OG1 3.47Å; T226-A229 WeakPolarHBondContact O-CB 3.47Å; T226-A229 PolarHBondContact O-N 3Å; T226-I230 WeakPolarHBondContact O-CG1 3.48Å; T226-I230 PolarHBondContact O-N 3.35Å
227	V	92.7	Very high	92	Very high	45 Å²	45	71.8 Å²	71.8	27%	0.273	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-39.3	178.3	166.4	0	0	0	0	111.8	I91 A223 F224 L225 A229 I230 F231	I91-V227 HydrophobicContact CD1-CB 4.39Å; I91-V227 HydrophobicContact CD1-CG1 2.94Å; I91-V227 HydrophobicContact CG1-CG1 4.28Å; A223-V227 WeakPolarHBondContact O-CB 3.47Å; A223-V227 VanDerWaalsContact O-CG2 3.28Å; A223-V227 WeakPolarHBondContact O-CG2 3.44Å; A223-V227 PolarHBondContact O-N 3.38Å; F224-V227 PolarHBondContact O-N 3.29Å; L225-V227 VanDerWaalsContact C-N 3.28Å; L225-V227 PolarHBondContact O-N 3.34Å; V227-A229 VanDerWaalsContact C-N 3.32Å; V227-I230 PolarHBondContact O-N 3.28Å; V227-F231 PolarHBondContact O-N 3.12Å
228	L	93.5	Very high	92.5	Very high	59 Å²	59	69.5 Å²	69.5	31%	0.309	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-36.6	171.5	-70.1	174.9	0	0	0	111.8	F147 F151 F224 L225 F231 V232	F147-L228 HydrophobicContact CD2-CD2 4.47Å; F147-L228 HydrophobicContact CE2-CD2 4.29Å; F147-L228 HydrophobicContact CZ-CD2 4.34Å; F151-L228 HydrophobicContact CE2-CD1 3.94Å; F151-L228 HydrophobicContact CZ-CD1 3.92Å; F224-L228 WeakPolarHBondContact O-CG 3.46Å; F224-L228 PolarHBondContact O-N 2.98Å; L225-L228 PolarHBondContact O-N 3.14Å; L228-F231 WeakPolarHBondContact O-CB 3.4Å; L228-F231 PolarHBondContact O-N 3.46Å; L228-V232 PolarHBondContact O-N 2.72Å; L228-V232 VanDerWaalsContact O-N 3.14Å
229	A	94.6	Very high	93	Very high	49 Å²	49	69.4 Å²	69.4	41%	0.405	38%	0.383	S	S	.	.	H	α-helix	trans	-64.4	-41.6	173.7	0	0	0	0	0	112	L225 T226 V227 F231 V232 I233	L225-A229 PolarHBondContact O-N 3.35Å; T226-A229 WeakPolarHBondContact O-CB 3.47Å; T226-A229 PolarHBondContact O-N 3Å; V227-A229 VanDerWaalsContact C-N 3.32Å; A229-F231 VanDerWaalsContact C-N 3.31Å; A229-F231 PolarHBondContact O-N 3.4Å; A229-V232 PolarHBondContact O-N 3.34Å; A229-I233 WeakPolarHBondContact O-CG1 3.5Å; A229-I233 PolarHBondContact O-N 3.43Å; A229-I233 VanDerWaalsContact O-N 3.12Å
230	I	95	Very high	93.3	Very high	90 Å²	90	67.5 Å²	67.5	46%	0.462	38%	0.38	S	S	.	.	H	α-helix	trans	-61.9	-40.2	174.1	-65.9	166.7	0	0	0	110.8	T226 V227 V232 I233 H234	T226-I230 WeakPolarHBondContact O-CG1 3.48Å; T226-I230 PolarHBondContact O-N 3.35Å; V227-I230 PolarHBondContact O-N 3.28Å; I230-V232 VanDerWaalsContact C-N 3.32Å; I230-V232 PolarHBondContact O-N 2.75Å; I230-I233 PolarHBondContact O-N 2.65Å; I230-H234 WeakPolarHBondContact O-CB 3.48Å; I230-H234 PolarHBondContact O-N 3.38Å
231	F	95.3	Very high	93.5	Very high	47 Å²	47	70.2 Å²	70.2	21%	0.206	39%	0.393	C	S	.	.	H	α-helix	trans	-58	-42.7	175	172.9	-106.4	0	0	0	112.3	H90 I91 L92 V227 L228 A229 H234 C235	H90-F231 HydrophobicContact CB-CD2 4Å; H90-F231 HydrophobicContact CB-CE2 4.38Å; I91-F231 HydrophobicContact CG2-CB 4.1Å; I91-F231 HydrophobicContact CG2-CD2 3.91Å; I91-F231 HydrophobicContact CG2-CG 4.17Å; L92-F231 HydrophobicContact CD1-CE2 3.97Å; L92-F231 HydrophobicContact CD1-CZ 3.83Å; L92-F231 HydrophobicContact CG-CE2 3.96Å; L92-F231 HydrophobicContact CG-CZ 4.18Å; V227-F231 PolarHBondContact O-N 3.12Å; L228-F231 WeakPolarHBondContact O-CB 3.4Å; L228-F231 PolarHBondContact O-N 3.46Å; A229-F231 VanDerWaalsContact C-N 3.31Å; A229-F231 PolarHBondContact O-N 3.4Å; F231-H234 PolarHBondContact O-N 3.3Å; F231-C235 WeakPolarHBondContact CE2-SG 3.4Å; F231-C235 WeakPolarHBondContact CZ-SG 3.48Å; F231-C235 WeakPolarHBondContact O-CB 3.2Å; F231-C235 PolarHBondContact O-N 2.88Å; F231-C235 PolarHBondContact O-SG 3.44Å
232	V	95.9	Very high	93.8	Very high	87 Å²	87	71.3 Å²	71.3	53%	0.527	40%	0.403	S	S	.	.	H	α-helix	trans	-63.6	-42.4	176.1	175.5	0	0	0	0	111.6	L228 A229 I230 T236	L228-V232 PolarHBondContact O-N 2.72Å; L228-V232 VanDerWaalsContact O-N 3.14Å; A229-V232 PolarHBondContact O-N 3.34Å; I230-V232 VanDerWaalsContact C-N 3.32Å; I230-V232 PolarHBondContact O-N 2.75Å; V232-T236 WeakPolarHBondContact O-CB 3.49Å; V232-T236 PolarHBondContact O-N 3.17Å; V232-T236 PolarHBondContact O-OG1 3.37Å
233	I	96.1	Very high	93.9	Very high	117 Å²	117	72.9 Å²	72.9	60%	0.6	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-46.5	177.1	-64.9	168.4	0	0	0	110.5	A229 I230 T236 W237	A229-I233 WeakPolarHBondContact O-CG1 3.5Å; A229-I233 PolarHBondContact O-N 3.43Å; A229-I233 VanDerWaalsContact O-N 3.12Å; I230-I233 PolarHBondContact O-N 2.65Å; I233-T236 PolarHBondContact O-N 3.45Å; I233-W237 WeakPolarHBondContact O-CB 3.45Å; I233-W237 PolarHBondContact O-N 2.87Å
234	H	96.5	Very high	94	Very high	31 Å²	31	74.2 Å²	74.2	14%	0.144	41%	0.409	C	S	.	.	H	α-helix	trans	-58.1	-52.8	176.6	174.8	83.5	0	0	0	111.6	F87 H90 I230 F231 T236 W237 V238	F87-H234 PolarHBondContact O-NE2 2.9Å; H90-H234 AromaticContact CD2-CD2 3.78Å; H90-H234 AromaticContact CD2-CE1 3.8Å; H90-H234 AromaticContact CD2-CG 3.39Å; H90-H234 AromaticContact CD2-ND1 3.44Å; H90-H234 PolarHBondContact CD2-ND1 3.3Å; H90-H234 AromaticContact CD2-NE2 3.99Å; H90-H234 AromaticContact CG-CD2 3.79Å; H90-H234 AromaticContact CG-CG 3.77Å; I230-H234 WeakPolarHBondContact O-CB 3.48Å; I230-H234 PolarHBondContact O-N 3.38Å; F231-H234 PolarHBondContact O-N 3.3Å; H234-T236 VanDerWaalsContact C-N 3.28Å; H234-T236 PolarHBondContact O-N 2.75Å; H234-W237 PolarHBondContact O-N 3.2Å; H234-W237 VanDerWaalsContact O-N 3.16Å; H234-V238 VanDerWaalsContact CE1-CG2 3.42Å; H234-V238 WeakPolarHBondContact CE1-CG2 3.46Å; H234-V238 WeakPolarHBondContact NE2-CG2 3.45Å; H234-V238 WeakPolarHBondContact O-CB 3.39Å; H234-V238 WeakPolarHBondContact O-CG2 3.48Å; H234-V238 PolarHBondContact O-N 3.12Å
235	C	95.4	Very high	93.7	Very high	39 Å²	39	75.5 Å²	75.5	26%	0.264	43%	0.426	S	S	.	.	H	α-helix	trans	-59.1	-40.5	-180	-70.5	0	0	0	0	112.1	F231 T239	F231-C235 WeakPolarHBondContact CE2-SG 3.4Å; F231-C235 WeakPolarHBondContact CZ-SG 3.48Å; F231-C235 WeakPolarHBondContact O-CB 3.2Å; F231-C235 PolarHBondContact O-N 2.88Å; F231-C235 PolarHBondContact O-SG 3.44Å; C235-T239 VanDerWaalsContact O-CB 3.26Å; C235-T239 WeakPolarHBondContact O-CB 3.38Å; C235-T239 PolarHBondContact O-N 3.48Å; C235-T239 PolarHBondContact O-OG1 2.85Å
236	T	96.7	Very high	93.7	Very high	91 Å²	91	73.8 Å²	73.8	56%	0.558	42%	0.421	S	S	*	.	H	α-helix	trans	-65.5	-45.1	177.1	-54.6	0	0	0	0	111.1	V232 I233 H234 S240	V232-T236 WeakPolarHBondContact O-CB 3.49Å; V232-T236 PolarHBondContact O-N 3.17Å; V232-T236 PolarHBondContact O-OG1 3.37Å; I233-T236 PolarHBondContact O-N 3.45Å; H234-T236 VanDerWaalsContact C-N 3.28Å; H234-T236 PolarHBondContact O-N 2.75Å; T236-S240 VanDerWaalsContact O-CB 3.26Å; T236-S240 WeakPolarHBondContact O-CB 3.31Å; T236-S240 PolarHBondContact O-N 3.29Å
237	W	97.1	Very high	93.5	Very high	147 Å²	147	74.8 Å²	74.8	56%	0.557	43%	0.43	S	S	*	.	H	α-helix	trans	-65.9	-45.4	179.7	-179.2	86.8	0	0	0	112.4	F87 I233 H234 S240 N241	F87-W237 HydrophobicContact CE2-CZ3 4.11Å; I233-W237 WeakPolarHBondContact O-CB 3.45Å; I233-W237 PolarHBondContact O-N 2.87Å; H234-W237 PolarHBondContact O-N 3.2Å; H234-W237 VanDerWaalsContact O-N 3.16Å; W237-S240 PolarHBondContact O-N 3.2Å; W237-N241 PolarHBondContact NE1-ND2 3.17Å; W237-N241 VanDerWaalsContact NE1-ND2 3.16Å; W237-N241 WeakPolarHBondContact O-CB 3.42Å; W237-N241 PolarHBondContact O-N 3.41Å; W237-N241 PolarHBondContact O-ND2 2.94Å
238	V	96.1	Very high	93.2	Very high	5 Å²	5	74.5 Å²	74.5	3%	0.03	43%	0.429	C	S	.	.	H	α-helix	trans	-62.6	-46.7	177.3	166.7	0	0	0	0	110.8	F87 H234 S240 N241 A242 Y243	F87-V238 HydrophobicContact CD1-CG1 4.11Å; F87-V238 HydrophobicContact CD2-CG2 4.3Å; F87-V238 HydrophobicContact CE1-CB 4.44Å; F87-V238 HydrophobicContact CE1-CG1 3.44Å; F87-V238 VanDerWaalsContact CE1-CG1 3.44Å; F87-V238 HydrophobicContact CE1-CG2 4.25Å; F87-V238 HydrophobicContact CE2-CG1 4.46Å; F87-V238 HydrophobicContact CE2-CG2 3.8Å; F87-V238 HydrophobicContact CZ-CB 4.21Å; F87-V238 HydrophobicContact CZ-CG1 3.65Å; F87-V238 HydrophobicContact CZ-CG2 3.77Å; H234-V238 VanDerWaalsContact CE1-CG2 3.42Å; H234-V238 WeakPolarHBondContact CE1-CG2 3.46Å; H234-V238 WeakPolarHBondContact NE2-CG2 3.45Å; H234-V238 WeakPolarHBondContact O-CB 3.39Å; H234-V238 WeakPolarHBondContact O-CG2 3.48Å; H234-V238 PolarHBondContact O-N 3.12Å; V238-S240 VanDerWaalsContact C-N 3.32Å; V238-S240 PolarHBondContact O-N 3.16Å; V238-N241 PolarHBondContact O-N 3.01Å; V238-A242 WeakPolarHBondContact O-CB 3.39Å; V238-A242 PolarHBondContact O-N 3.15Å; V238-Y243 HydrophobicContact CG1-CD2 3.78Å; V238-Y243 HydrophobicContact CG1-CE2 3.41Å; V238-Y243 VanDerWaalsContact CG1-CE2 3.41Å
239	T	95.5	Very high	93	Very high	82 Å²	82	72.9 Å²	72.9	50%	0.503	42%	0.421	S	S	.	.	I	π-helix	trans	-60.5	-44.2	178.6	-57.1	0	0	0	0	111.1	C235 S244	C235-T239 VanDerWaalsContact O-CB 3.26Å; C235-T239 WeakPolarHBondContact O-CB 3.38Å; C235-T239 PolarHBondContact O-N 3.48Å; C235-T239 PolarHBondContact O-OG1 2.85Å; T239-S244 WeakPolarHBondContact O-CB 3.38Å; T239-S244 PolarHBondContact O-N 3.01Å; T239-S244 VanDerWaalsContact O-N 3.09Å; T239-S244 PolarHBondContact O-OG 2.8Å
240	S	94.2	Very high	92.7	Very high	75 Å²	75	71.9 Å²	71.9	52%	0.524	41%	0.409	S	S	.	.	I	π-helix	trans	-72.6	-28.6	-176.7	-175.6	0	0	0	0	114.7	T236 W237 V238 S244	T236-S240 VanDerWaalsContact O-CB 3.26Å; T236-S240 WeakPolarHBondContact O-CB 3.31Å; T236-S240 PolarHBondContact O-N 3.29Å; W237-S240 PolarHBondContact O-N 3.2Å; V238-S240 VanDerWaalsContact C-N 3.32Å; V238-S240 PolarHBondContact O-N 3.16Å; S240-S244 VanDerWaalsContact C-OG 3.26Å; S240-S244 WeakPolarHBondContact CA-OG 3.46Å; S240-S244 PolarHBondContact O-OG 2.84Å
241	N	92	Very high	92.2	Very high	105 Å²	105	69.8 Å²	69.8	56%	0.561	41%	0.405	S	S	*	.	I	π-helix	trans	-107	-29.9	-173.5	-68.5	-67.7	0	0	0	113.7	W237 V238	W237-N241 PolarHBondContact NE1-ND2 3.17Å; W237-N241 VanDerWaalsContact NE1-ND2 3.16Å; W237-N241 WeakPolarHBondContact O-CB 3.42Å; W237-N241 PolarHBondContact O-N 3.41Å; W237-N241 PolarHBondContact O-ND2 2.94Å; V238-N241 PolarHBondContact O-N 3.01Å
242	A	90.9	Very high	91.5	Very high	46 Å²	46	68.2 Å²	68.2	38%	0.38	40%	0.401	S	S	.	.	I	π-helix	trans	-105.3	-53.6	-174.1	0	0	0	0	0	112.8	F87 V238	F87-A242 HydrophobicContact CE1-CB 3.93Å; F87-A242 HydrophobicContact CZ-CB 3.76Å; V238-A242 WeakPolarHBondContact O-CB 3.39Å; V238-A242 PolarHBondContact O-N 3.15Å
243	Y	91.7	Very high	90.8	Very high	134 Å²	134	70.6 Å²	70.6	53%	0.525	41%	0.406	S	S	.	.	I	π-helix	trans	-87.4	-25.3	-171.7	-62.5	-63	0	0	0	114.2	F87 D88 V238 S245	F87-Y243 HydrophobicContact CE1-CE2 4.33Å; D88-Y243 PolarHBondContact OD1-OH 3.4Å; V238-Y243 HydrophobicContact CG1-CD2 3.78Å; V238-Y243 HydrophobicContact CG1-CE2 3.41Å; V238-Y243 VanDerWaalsContact CG1-CE2 3.41Å; Y243-S245 VanDerWaalsContact C-N 3.27Å; Y243-S245 PolarHBondContact O-N 3.04Å
244	S	91.8	Very high	90.1	Very high	76 Å²	76	67.1 Å²	67.1	53%	0.531	39%	0.392	S	S	.	.			trans	-84.9	58.6	179.2	64.6	0	0	0	0	113.1	T239 S240	T239-S244 WeakPolarHBondContact O-CB 3.38Å; T239-S244 PolarHBondContact O-N 3.01Å; T239-S244 VanDerWaalsContact O-N 3.09Å; T239-S244 PolarHBondContact O-OG 2.8Å; S240-S244 VanDerWaalsContact C-OG 3.26Å; S240-S244 WeakPolarHBondContact CA-OG 3.46Å; S240-S244 PolarHBondContact O-OG 2.84Å
245	S	85.4	Confident	89.4	Confident	86 Å²	86	74.3 Å²	74.3	60%	0.601	43%	0.432	S	S	*	.			trans	-127.7	116.8	176.8	-170.3	0	0	0	0	111.3	Y243	Y243-S245 VanDerWaalsContact C-N 3.27Å; Y243-S245 PolarHBondContact O-N 3.04Å
246	P	90.3	Very high	89	Confident	69 Å²	69	79.5 Å²	79.5	45%	0.448	46%	0.457	S	S	.	.			trans	-73.1	136.4	179.6	29	-32.5	0	0	0	111.4	V249	P246-V249 VanDerWaalsContact O-O 3.13Å
247	S	86	Confident	88.4	Confident	90 Å²	90	77.7 Å²	77.7	63%	0.629	46%	0.457	S	S	*	.	S	Bend	trans	-85.2	-14.1	177.9	-45.5	0	0	0	0	114.3
248	V	88.2	Confident	87.8	Confident	39 Å²	39	73 Å²	73	24%	0.236	45%	0.446	C	S	.	.	S	Bend	trans	-82.4	-37.4	179.6	176.7	0	0	0	0	111.4	F265 R266 M295	V248-F265 WeakPolarHBondContact O-CD2 3.44Å; V248-R266 HydrophobicContact CG1-CG 3.68Å; V248-M295 HydrophobicContact CB-CE 4.45Å; V248-M295 HydrophobicContact CG1-CE 3.76Å; V248-M295 HydrophobicContact CG1-SD 4.27Å; V248-M295 HydrophobicContact CG2-CE 3.78Å
249	V	88.3	Confident	87.3	Confident	26 Å²	26	79.4 Å²	79.4	16%	0.158	47%	0.47	C	S	.	.	S	Bend	trans	-117.6	112.2	-175.5	178	0	0	0	0	107.3	P246 I261	P246-V249 VanDerWaalsContact O-O 3.13Å; V249-I261 HydrophobicContact CG1-CG2 3.15Å
250	L	87.3	Confident	86.7	Confident	27 Å²	27	79.3 Å²	79.3	14%	0.141	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	135.2	-177.4	-55.4	177.9	0	0	0	109.4	L262 F265 Y348 L447	L250-L262 HydrophobicContact CB-CB 4.19Å; L250-L262 HydrophobicContact CB-CD1 4.38Å; L250-L262 PolarHBondContact N-O 3.47Å; L250-L262 PolarHBondContact O-N 2.75Å; L250-F265 HydrophobicContact CD1-CE2 4.02Å; L250-F265 HydrophobicContact CG-CE2 4.21Å; L250-Y348 HydrophobicContact CD1-CD2 3.6Å; L250-Y348 HydrophobicContact CD1-CE2 3.64Å; L250-Y348 HydrophobicContact CD1-CG 4.26Å; L250-Y348 HydrophobicContact CD2-CE2 3.97Å; L250-Y348 HydrophobicContact CG-CE2 4.49Å; L250-L447 HydrophobicContact CD1-CD2 3.77Å
251	A	85	Confident	86.4	Confident	46 Å²	46	80.7 Å²	80.7	38%	0.38	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119	176.6	0	0	0	0	0	110	R259	A251-R259 HydrophobicContact CB-CG 4.29Å
252	A	81.2	Confident	86.2	Confident	14 Å²	14	76.4 Å²	76.4	12%	0.116	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132	171.6	0	0	0	0	0	109.3	R259 N260 L262 F346	A252-R259 CarbonylContact O-C 3.5Å; A252-N260 HydrophobicContact CB-CB 4.34Å; A252-N260 PolarHBondContact N-O 2.91Å; A252-N260 PolarHBondContact O-N 2.7Å; A252-L262 HydrophobicContact CB-CD1 4.26Å; A252-F346 HydrophobicContact CB-CE1 4.4Å; A252-F346 HydrophobicContact CB-CE2 3.66Å; A252-F346 HydrophobicContact CB-CZ 3.32Å
253	H	81.8	Confident	86.3	Confident	137 Å²	137	76.6 Å²	76.6	63%	0.634	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.2	171.3	-64.5	86.1	0	0	0	108.3
254	S	80.5	Confident	86.4	Confident	45 Å²	45	70.3 Å²	70.3	32%	0.315	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-73	163.8	171	-56	0	0	0	0	109.9	D256 G257 S258 N260	S254-D256 PolarHBondContact O-N 3.16Å; S254-G257 PolarHBondContact O-N 2.93Å; S254-S258 WeakPolarHBondContact CB-OG 3.37Å; S254-S258 PolarHBondContact N-O 3.25Å; S254-S258 PolarHBondContact OG-OG 2.83Å; S254-N260 PolarHBondContact OG-ND2 3Å
255	N	83.1	Confident	86.5	Confident	181 Å²	181	66.9 Å²	66.9	97%	0.968	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24.8	177.4	-67.7	-11	0	0	0	113.5	G257	N255-G257 PolarHBondContact O-N 3.39Å
256	D	85.1	Confident	86.9	Confident	148 Å²	148	68.5 Å²	68.5	79%	0.791	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	1.5	176.4	-166.4	31.5	0	0	0	113.4	S254 S258	S254-D256 PolarHBondContact O-N 3.16Å; D256-S258 PolarHBondContact O-N 3.31Å
257	G	85.1	Confident	87.2	Confident	54 Å²	54	68.8 Å²	68.8	56%	0.557	38%	0.378	S	S	*	.	S	Bend	trans	75.8	-3.2	-173.7	0	0	0	0	0	114.2	S254 N255 R259	S254-G257 PolarHBondContact O-N 2.93Å; N255-G257 PolarHBondContact O-N 3.39Å; G257-R259 PolarHBondContact O-N 3.12Å
258	S	85.2	Confident	87.7	Confident	48 Å²	48	64.5 Å²	64.5	34%	0.336	35%	0.348	S	S	.	.			trans	-62.7	130.8	172.2	62.9	0	0	0	0	110.6	S254 D256	S254-S258 WeakPolarHBondContact CB-OG 3.37Å; S254-S258 PolarHBondContact N-O 3.25Å; S254-S258 PolarHBondContact OG-OG 2.83Å; D256-S258 PolarHBondContact O-N 3.31Å
259	R	84.1	Confident	88.1	Confident	139 Å²	139	62.7 Å²	62.7	53%	0.525	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	106.5	178.6	-177.2	-178.4	173.7	-176	0.9	109.1	A251 A252 G257 I261	A251-R259 HydrophobicContact CB-CG 4.29Å; A252-R259 CarbonylContact O-C 3.5Å; G257-R259 PolarHBondContact O-N 3.12Å; R259-I261 HydrophobicContact CG-CG1 4.41Å
260	N	84.2	Confident	88.5	Confident	81 Å²	81	68.8 Å²	68.8	43%	0.433	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.3	170.9	-67.2	-10.9	0	0	0	108.7	A252 S254	A252-N260 HydrophobicContact CB-CB 4.34Å; A252-N260 PolarHBondContact N-O 2.91Å; A252-N260 PolarHBondContact O-N 2.7Å; S254-N260 PolarHBondContact OG-ND2 3Å
261	I	87.5	Confident	89	Confident	104 Å²	104	70 Å²	70	53%	0.533	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119	-178.5	-61.9	179.3	0	0	0	107.4	V249 R259	V249-I261 HydrophobicContact CG1-CG2 3.15Å; R259-I261 HydrophobicContact CG-CG1 4.41Å
262	L	87.8	Confident	89.5	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.073	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.4	177	-53.5	169.9	0	0	0	108.1	L250 A252 F346 N445	L250-L262 HydrophobicContact CB-CB 4.19Å; L250-L262 HydrophobicContact CB-CD1 4.38Å; L250-L262 PolarHBondContact N-O 3.47Å; L250-L262 PolarHBondContact O-N 2.75Å; A252-L262 HydrophobicContact CB-CD1 4.26Å; L262-F346 HydrophobicContact CD1-CD1 3.7Å; L262-F346 HydrophobicContact CD1-CD2 3.84Å; L262-F346 HydrophobicContact CD1-CE1 3.56Å; L262-F346 HydrophobicContact CD1-CE2 3.72Å; L262-F346 HydrophobicContact CD1-CG 3.87Å; L262-F346 HydrophobicContact CD1-CZ 3.6Å; L262-N445 WeakPolarHBondContact CD2-ND2 3.17Å
263	D	92.3	Very high	90.2	Very high	50 Å²	50	68.4 Å²	68.4	27%	0.267	35%	0.346	S	S	.	.			trans	-122.3	28.6	-173	-164	28.8	0	0	0	113.5	F265 R266 E267	D263-F265 PolarHBondContact O-N 3.16Å; D263-R266 PolarHBondContact O-N 3.22Å; D263-R266 WeakPolarHBondContact OD1-CB 3.41Å; D263-R266 VanDerWaalsContact OD1-CG 3.3Å; D263-R266 WeakPolarHBondContact OD1-CG 3.28Å; D263-R266 IonicContact OD1-CZ 2.85Å; D263-R266 IonicContact OD1-NE 2.6Å; D263-R266 PolarHBondContact OD1-NE 2.77Å; D263-R266 IonicContact OD1-NH2 3.88Å; D263-R266 PolarHBondContact OD1-NH2 3.41Å; D263-R266 IonicContact OD2-CZ 2.66Å; D263-R266 IonicContact OD2-NE 3.35Å; D263-R266 PolarHBondContact OD2-NE 2.99Å; D263-R266 IonicContact OD2-NH2 2.92Å; D263-R266 PolarHBondContact OD2-NH2 3.24Å; D263-E267 PolarHBondContact O-N 2.58Å
264	D	93.9	Very high	90.9	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.011	34%	0.341	C	S	.	.	H	α-helix	trans	-59	-31.9	-177	-65.5	-83.5	0	0	0	113.1	A268 S443 E444 N445 L447	D264-A268 VanDerWaalsContact O-CB 3.25Å; D264-A268 WeakPolarHBondContact O-CB 3.45Å; D264-A268 PolarHBondContact O-N 3.35Å; D264-S443 WeakPolarHBondContact CB-OG 3.37Å; D264-S443 VanDerWaalsContact CG-OG 3.31Å; D264-S443 WeakPolarHBondContact OD1-CB 3.24Å; D264-S443 PolarHBondContact OD1-OG 3.48Å; D264-E444 PolarHBondContact OD1-N 2.85Å; D264-N445 PolarHBondContact OD1-N 3.02Å; D264-N445 PolarHBondContact OD1-ND2 2.86Å; D264-N445 WeakPolarHBondContact OD2-CB 3.47Å; D264-N445 PolarHBondContact OD2-ND2 2.81Å; D264-L447 HydrophobicContact CB-CB 3.64Å; D264-L447 HydrophobicContact CB-CD2 3.91Å; D264-L447 HydrophobicContact CB-CG 4.36Å
265	F	94.3	Very high	91.7	Very high	4 Å²	4	70 Å²	70	2%	0.018	35%	0.352	C	S	.	.	H	α-helix	trans	-62.8	-52.3	176.9	-72.6	-75.8	0	0	0	111.4	V248 L250 D263 E267 A268 Y269 I341 L447 V448	V248-F265 WeakPolarHBondContact O-CD2 3.44Å; L250-F265 HydrophobicContact CD1-CE2 4.02Å; L250-F265 HydrophobicContact CG-CE2 4.21Å; D263-F265 PolarHBondContact O-N 3.16Å; F265-E267 VanDerWaalsContact C-N 3.34Å; F265-A268 PolarHBondContact O-N 3.42Å; F265-Y269 HydrophobicContact CB-CD2 4.38Å; F265-Y269 HydrophobicContact CB-CE2 4.04Å; F265-Y269 HydrophobicContact CD1-CE2 4.24Å; F265-Y269 WeakPolarHBondContact O-CB 3.4Å; F265-Y269 WeakPolarHBondContact O-CD2 3.43Å; F265-Y269 PolarHBondContact O-N 3.36Å; F265-I341 HydrophobicContact CE1-CD1 3.66Å; F265-I341 HydrophobicContact CE1-CG1 4.09Å; F265-I341 HydrophobicContact CZ-CD1 4.44Å; F265-L447 HydrophobicContact CD2-CD2 3.9Å; F265-L447 HydrophobicContact CE2-CD2 3.48Å; F265-L447 VanDerWaalsContact CE2-CD2 3.48Å; F265-L447 HydrophobicContact CE2-CG 4.5Å; F265-L447 HydrophobicContact CZ-CD2 3.93Å; F265-V448 HydrophobicContact CD1-CG2 3.94Å; F265-V448 HydrophobicContact CE1-CG2 4.25Å; F265-V448 HydrophobicContact CG-CG2 4.45Å
266	R	94.9	Very high	92.3	Very high	121 Å²	121	61.8 Å²	61.8	46%	0.457	31%	0.308	S	S	.	.	H	α-helix	trans	-67.8	-38.3	179.9	-63.8	-168.7	-64.9	179.2	-0.7	110.8	V248 D263 Y270 M295	V248-R266 HydrophobicContact CG1-CG 3.68Å; D263-R266 PolarHBondContact O-N 3.22Å; D263-R266 WeakPolarHBondContact OD1-CB 3.41Å; D263-R266 VanDerWaalsContact OD1-CG 3.3Å; D263-R266 WeakPolarHBondContact OD1-CG 3.28Å; D263-R266 IonicContact OD1-CZ 2.85Å; D263-R266 IonicContact OD1-NE 2.6Å; D263-R266 PolarHBondContact OD1-NE 2.77Å; D263-R266 IonicContact OD1-NH2 3.88Å; D263-R266 PolarHBondContact OD1-NH2 3.41Å; D263-R266 IonicContact OD2-CZ 2.66Å; D263-R266 IonicContact OD2-NE 3.35Å; D263-R266 PolarHBondContact OD2-NE 2.99Å; D263-R266 IonicContact OD2-NH2 2.92Å; D263-R266 PolarHBondContact OD2-NH2 3.24Å; R266-Y270 WeakPolarHBondContact O-CB 3.38Å; R266-Y270 PolarHBondContact O-N 3.45Å; R266-M295 HydrophobicContact CG-SD 4.44Å
267	E	96.3	Very high	92.7	Very high	75 Å²	75	58.8 Å²	58.8	35%	0.35	30%	0.297	S	S	.	.	H	α-helix	trans	-55.2	-53.8	174.3	-172.5	-165.9	176.5	0	0	111.3	D263 F265 Y270 W271 F441 E444	D263-E267 PolarHBondContact O-N 2.58Å; F265-E267 VanDerWaalsContact C-N 3.34Å; E267-Y270 PolarHBondContact O-N 3.36Å; E267-W271 PolarHBondContact O-N 3.23Å; E267-F441 HydrophobicContact CG-CZ 3.99Å; E267-E444 PolarHBondContact OE2-N 3.04Å
268	A	96.3	Very high	93.1	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-42.6	-177.8	0	0	0	0	0	112.7	D264 F265 Y270 W271 L272 F441 V448 I450	D264-A268 VanDerWaalsContact O-CB 3.25Å; D264-A268 WeakPolarHBondContact O-CB 3.45Å; D264-A268 PolarHBondContact O-N 3.35Å; F265-A268 PolarHBondContact O-N 3.42Å; A268-Y270 VanDerWaalsContact C-N 3.32Å; A268-Y270 PolarHBondContact O-N 3.02Å; A268-W271 PolarHBondContact O-N 3.33Å; A268-L272 WeakPolarHBondContact O-CB 3.45Å; A268-L272 PolarHBondContact O-N 3.13Å; A268-F441 HydrophobicContact CB-CD1 4.25Å; A268-F441 HydrophobicContact CB-CE1 3.87Å; A268-V448 HydrophobicContact CB-CB 3.6Å; A268-V448 HydrophobicContact CB-CG1 3.48Å; A268-V448 VanDerWaalsContact CB-CG1 3.48Å; A268-V448 HydrophobicContact CB-CG2 4.16Å; A268-I450 HydrophobicContact CB-CD1 4.26Å
269	Y	96.4	Very high	93.6	Very high	1 Å²	1	67.3 Å²	67.3	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-65.5	-36	176.1	-63.1	-34	0	0	0	112	F265 L272 S273 Q291 I292 M295 A296 L339	F265-Y269 HydrophobicContact CB-CD2 4.38Å; F265-Y269 HydrophobicContact CB-CE2 4.04Å; F265-Y269 HydrophobicContact CD1-CE2 4.24Å; F265-Y269 WeakPolarHBondContact O-CB 3.4Å; F265-Y269 WeakPolarHBondContact O-CD2 3.43Å; F265-Y269 PolarHBondContact O-N 3.36Å; Y269-L272 PolarHBondContact O-N 3.24Å; Y269-S273 PolarHBondContact O-N 3.32Å; Y269-Q291 HydrophobicContact CE2-CB 3.92Å; Y269-Q291 PolarHBondContact OH-OE1 2.7Å; Y269-I292 HydrophobicContact CD1-CG1 4.18Å; Y269-I292 HydrophobicContact CE1-CG1 3.56Å; Y269-M295 HydrophobicContact CD2-CB 3.92Å; Y269-M295 HydrophobicContact CD2-CG 4.35Å; Y269-M295 HydrophobicContact CD2-SD 3.62Å; Y269-M295 HydrophobicContact CE2-SD 4.09Å; Y269-M295 HydrophobicContact CG-CB 4.16Å; Y269-A296 WeakPolarHBondContact O-CA 3.36Å; Y269-A296 WeakPolarHBondContact O-CB 3.23Å; Y269-L339 HydrophobicContact CD1-CD1 4.22Å; Y269-L339 HydrophobicContact CE1-CD1 3.81Å
270	Y	96.6	Very high	94.1	Very high	154 Å²	154	60.8 Å²	60.8	60%	0.604	30%	0.297	S	S	*	.	H	α-helix	trans	-69.5	-41.3	176.2	-166.8	-100.1	0	0	0	112	R266 E267 A268 L272 S273 Q274	R266-Y270 WeakPolarHBondContact O-CB 3.38Å; R266-Y270 PolarHBondContact O-N 3.45Å; E267-Y270 PolarHBondContact O-N 3.36Å; A268-Y270 VanDerWaalsContact C-N 3.32Å; A268-Y270 PolarHBondContact O-N 3.02Å; Y270-L272 VanDerWaalsContact C-N 3.28Å; Y270-L272 PolarHBondContact O-N 3.16Å; Y270-S273 PolarHBondContact O-N 3.26Å; Y270-Q274 HydrophobicContact CD1-CG 4.16Å; Y270-Q274 HydrophobicContact CE1-CG 3.8Å; Y270-Q274 HydrophobicContact CE2-CG 4.42Å; Y270-Q274 WeakPolarHBondContact O-CG 3.44Å; Y270-Q274 PolarHBondContact O-N 3.25Å
271	W	97.4	Very high	94.7	Very high	51 Å²	51	60.8 Å²	60.8	19%	0.193	29%	0.291	C	S	.	.	H	α-helix	trans	-56.6	-45.5	171.5	-179.5	96.1	0	0	0	111	E267 A268 S273 Q274 N275 T276 Y337 A440 F441 I450	E267-W271 PolarHBondContact O-N 3.23Å; A268-W271 PolarHBondContact O-N 3.33Å; W271-S273 VanDerWaalsContact C-N 3.32Å; W271-S273 PolarHBondContact O-N 3.33Å; W271-Q274 PolarHBondContact O-N 3.19Å; W271-N275 HydrophobicContact CD2-CB 4.3Å; W271-N275 HydrophobicContact CZ2-CB 4.27Å; W271-N275 PolarHBondContact NE1-ND2 2.88Å; W271-N275 VanDerWaalsContact O-CB 3.31Å; W271-N275 WeakPolarHBondContact O-CB 3.39Å; W271-N275 PolarHBondContact O-N 3.46Å; W271-T276 HydrophobicContact CZ3-CG2 4.11Å; W271-Y337 HydrophobicContact CH2-CE1 4.4Å; W271-A440 HydrophobicContact CH2-CB 3.8Å; W271-A440 HydrophobicContact CZ2-CB 4.48Å; W271-F441 HydrophobicContact CB-CD1 4.38Å; W271-F441 HydrophobicContact CB-CD2 4.31Å; W271-F441 HydrophobicContact CB-CE1 4.35Å; W271-F441 HydrophobicContact CB-CE2 4.27Å; W271-F441 HydrophobicContact CB-CG 4.36Å; W271-F441 HydrophobicContact CB-CZ 4.29Å; W271-F441 AromaticContact CD1-CD2 3.33Å; W271-F441 AromaticContact CD1-CE2 3.65Å; W271-F441 AromaticContact CD1-CG 3.94Å; W271-F441 HydrophobicContact CD2-CB 3.61Å; W271-F441 HydrophobicContact CD2-CD1 4.33Å; W271-F441 AromaticContact CD2-CD2 3.88Å; W271-F441 HydrophobicContact CD2-CD2 3.88Å; W271-F441 AromaticContact CD2-CG 3.67Å; W271-F441 HydrophobicContact CD2-CG 3.67Å; W271-F441 AromaticContact CE2-CD2 3.88Å; W271-F441 AromaticContact CE2-CG 3.94Å; W271-F441 HydrophobicContact CE3-CB 3.73Å; W271-F441 HydrophobicContact CE3-CG 4.09Å; W271-F441 HydrophobicContact CG-CB 4.24Å; W271-F441 HydrophobicContact CG-CD1 4.25Å; W271-F441 AromaticContact CG-CD2 3.61Å; W271-F441 HydrophobicContact CG-CD2 3.61Å; W271-F441 AromaticContact CG-CE2 3.97Å; W271-F441 HydrophobicContact CG-CE2 3.97Å; W271-F441 AromaticContact CG-CG 3.76Å; W271-F441 HydrophobicContact CG-CG 3.76Å; W271-F441 HydrophobicContact CG-CZ 4.43Å; W271-F441 HydrophobicContact CH2-CB 3.93Å; W271-F441 HydrophobicContact CZ2-CB 3.79Å; W271-F441 HydrophobicContact CZ3-CB 3.89Å; W271-F441 AromaticContact NE1-CD2 3.52Å; W271-I450 HydrophobicContact CE3-CD1 3.68Å; W271-I450 HydrophobicContact CZ3-CB 4.4Å; W271-I450 HydrophobicContact CZ3-CD1 4Å; W271-I450 HydrophobicContact CZ3-CG2 4.03Å
272	L	96.4	Very high	95.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-38.5	179.4	-163	66.8	0	0	0	111.6	A268 Y269 Y270 T276 I282 I292 A296 Y337 I450	A268-L272 WeakPolarHBondContact O-CB 3.45Å; A268-L272 PolarHBondContact O-N 3.13Å; Y269-L272 PolarHBondContact O-N 3.24Å; Y270-L272 VanDerWaalsContact C-N 3.28Å; Y270-L272 PolarHBondContact O-N 3.16Å; L272-T276 HydrophobicContact CD1-CG2 3.65Å; L272-T276 HydrophobicContact CG-CG2 4.41Å; L272-T276 WeakPolarHBondContact O-CB 3.47Å; L272-T276 PolarHBondContact O-OG1 2.64Å; L272-I282 HydrophobicContact CD1-CD1 4.11Å; L272-I282 HydrophobicContact CD1-CG1 4.14Å; L272-I282 HydrophobicContact CD2-CD1 3.25Å; L272-I282 HydrophobicContact CD2-CG1 3.84Å; L272-I282 HydrophobicContact CG-CD1 3.76Å; L272-I282 HydrophobicContact CG-CG1 4.32Å; L272-I292 HydrophobicContact CD2-CG2 4.33Å; L272-A296 HydrophobicContact CB-CB 4.06Å; L272-A296 HydrophobicContact CD2-CB 3.81Å; L272-A296 HydrophobicContact CG-CB 4.21Å; L272-Y337 HydrophobicContact CD1-CG 4.48Å; L272-I450 HydrophobicContact CB-CD1 4.37Å; L272-I450 HydrophobicContact CD1-CD1 4.19Å; L272-I450 HydrophobicContact CD1-CG2 4.19Å
273	S	95.7	Very high	95.5	Very high	28 Å²	28	55.2 Å²	55.2	20%	0.196	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-32.9	176.6	-179.1	0	0	0	0	114.2	Y269 Y270 W271 A296 R298	Y269-S273 PolarHBondContact O-N 3.32Å; Y270-S273 PolarHBondContact O-N 3.26Å; W271-S273 VanDerWaalsContact C-N 3.32Å; W271-S273 PolarHBondContact O-N 3.33Å; S273-A296 WeakPolarHBondContact CA-O 3.4Å; S273-A296 VanDerWaalsContact CB-O 3.31Å; S273-A296 WeakPolarHBondContact CB-O 3.36Å; S273-R298 PolarHBondContact O-NH2 3.32Å
274	Q	95.9	Very high	95.7	Very high	115 Å²	115	52.9 Å²	52.9	54%	0.537	25%	0.249	S	C	.	.	H	α-helix	trans	-98.3	-30.7	-172.7	-66.1	-65.8	-31.6	0	0	113	Y270 W271	Y270-Q274 HydrophobicContact CD1-CG 4.16Å; Y270-Q274 HydrophobicContact CE1-CG 3.8Å; Y270-Q274 HydrophobicContact CE2-CG 4.42Å; Y270-Q274 WeakPolarHBondContact O-CG 3.44Å; Y270-Q274 PolarHBondContact O-N 3.25Å; W271-Q274 PolarHBondContact O-N 3.19Å
275	N	96.6	Very high	95.8	Very high	99 Å²	99	53.1 Å²	53.1	53%	0.529	25%	0.25	S	S	.	.	H	α-helix	trans	-109.5	1.2	-168.1	-61.5	-35.5	0	0	0	114.5	W271	W271-N275 HydrophobicContact CD2-CB 4.3Å; W271-N275 HydrophobicContact CZ2-CB 4.27Å; W271-N275 PolarHBondContact NE1-ND2 2.88Å; W271-N275 VanDerWaalsContact O-CB 3.31Å; W271-N275 WeakPolarHBondContact O-CB 3.39Å; W271-N275 PolarHBondContact O-N 3.46Å
276	T	95.7	Very high	95.8	Very high	10 Å²	10	53.8 Å²	53.8	6%	0.061	25%	0.253	C	S	.	.	S	Bend	trans	-113.7	154.7	177.3	71.6	0	0	0	0	112.2	W271 L272 R298 Y337	W271-T276 HydrophobicContact CZ3-CG2 4.11Å; L272-T276 HydrophobicContact CD1-CG2 3.65Å; L272-T276 HydrophobicContact CG-CG2 4.41Å; L272-T276 WeakPolarHBondContact O-CB 3.47Å; L272-T276 PolarHBondContact O-OG1 2.64Å; T276-R298 PolarHBondContact O-NH2 2.94Å; T276-R298 PolarHBondContact OG1-NE 3.42Å; T276-Y337 HydrophobicContact CG2-CD2 4.1Å; T276-Y337 HydrophobicContact CG2-CE1 4.16Å; T276-Y337 HydrophobicContact CG2-CE2 3.53Å
277	P	95.1	Very high	95.7	Very high	84 Å²	84	49.7 Å²	49.7	55%	0.545	24%	0.24	S	C	.	.			trans	-56.5	147	171.9	-23.5	33	0	0	0	112.3	Q279 A280 R298	P277-Q279 PolarHBondContact O-N 3.21Å; P277-Q279 VanDerWaalsContact O-N 3.16Å; P277-A280 HydrophobicContact CB-CB 4.45Å; P277-A280 WeakPolarHBondContact O-CB 3.21Å; P277-A280 PolarHBondContact O-N 2.67Å; P277-R298 PolarHBondContact O-NE 3Å
278	D	93.2	Very high	95.5	Very high	126 Å²	126	46.7 Å²	46.7	67%	0.674	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.8	-179	-63.3	-26.5	0	0	0	113.4	A280 R298	D278-A280 VanDerWaalsContact C-N 3.34Å; D278-R298 IonicContact OD1-NH2 2.86Å
279	Q	94.4	Very high	95.4	Very high	156 Å²	156	46.7 Å²	46.7	73%	0.729	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	8.2	178.5	-61.4	-61.6	-39.4	0	0	113.3	P277 R281	P277-Q279 PolarHBondContact O-N 3.21Å; P277-Q279 VanDerWaalsContact O-N 3.16Å; Q279-R281 PolarHBondContact O-N 3.4Å
280	A	95.6	Very high	95.3	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.017	25%	0.249	C	C	.	.			trans	-63.5	132.7	-179.4	0	0	0	0	0	111.3	P277 D278 T299 D336 Y337	P277-A280 HydrophobicContact CB-CB 4.45Å; P277-A280 WeakPolarHBondContact O-CB 3.21Å; P277-A280 PolarHBondContact O-N 2.67Å; D278-A280 VanDerWaalsContact C-N 3.34Å; A280-T299 PolarHBondContact O-N 2.7Å; A280-D336 WeakPolarHBondContact CA-OD2 3.45Å; A280-Y337 HydrophobicContact CB-CD2 4.03Å; A280-Y337 HydrophobicContact CB-CE2 3.98Å
281	R	96.5	Very high	95.2	Very high	81 Å²	81	48.2 Å²	48.2	31%	0.306	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.2	179.5	-72.8	171.6	-72.1	-162.3	3.7	110.7	Q279 T299 L301 D334 D336 Y337	Q279-R281 PolarHBondContact O-N 3.4Å; R281-T299 WeakPolarHBondContact CA-O 3.35Å; R281-T299 HydrophobicContact CG-CG2 4.03Å; R281-L301 HydrophobicContact CB-CD1 3.98Å; R281-D334 IonicContact CZ-OD2 3.68Å; R281-D334 PolarHBondContact NE-O 2.86Å; R281-D334 VanDerWaalsContact NH1-CB 3.33Å; R281-D334 IonicContact NH1-OD2 3.38Å; R281-D334 PolarHBondContact NH1-OD2 2.95Å; R281-D334 PolarHBondContact NH2-O 2.86Å; R281-D334 IonicContact NH2-OD1 2.67Å; R281-D334 IonicContact NH2-OD2 3.42Å; R281-D334 PolarHBondContact NH2-OD2 3.43Å; R281-D336 PolarHBondContact N-OD2 2.83Å; R281-D336 PolarHBondContact O-N 3Å; R281-Y337 PolarHBondContact O-N 2.8Å; R281-Y337 VanDerWaalsContact O-N 3.13Å
282	I	96.6	Very high	95.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.6	-179.2	-60.6	135	0	0	0	109.9	L272 I292 R298 T299 L301 Y337 L339	L272-I282 HydrophobicContact CD1-CD1 4.11Å; L272-I282 HydrophobicContact CD1-CG1 4.14Å; L272-I282 HydrophobicContact CD2-CD1 3.25Å; L272-I282 HydrophobicContact CD2-CG1 3.84Å; L272-I282 HydrophobicContact CG-CD1 3.76Å; L272-I282 HydrophobicContact CG-CG1 4.32Å; I282-I292 HydrophobicContact CD1-CG2 3.82Å; I282-I292 HydrophobicContact CG2-CD1 4.32Å; I282-R298 HydrophobicContact CD1-CB 3.19Å; I282-R298 HydrophobicContact CD1-CG 3.81Å; I282-T299 PolarHBondContact N-O 2.66Å; I282-L301 WeakPolarHBondContact O-CD1 3.26Å; I282-L301 PolarHBondContact O-N 3.09Å; I282-Y337 CarbonylContact C-O 3.59Å; I282-Y337 WeakPolarHBondContact CA-O 3.5Å; I282-L339 HydrophobicContact CG2-CB 4.02Å
283	M	96.5	Very high	95	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122.4	169.1	-178.4	-177	160.9	0	0	109.3	V315 A318 M319 M330 V335 Y337 V338 L339	M283-V315 HydrophobicContact CE-CB 4.26Å; M283-V315 HydrophobicContact CE-CG1 3.74Å; M283-V315 HydrophobicContact CE-CG2 4.41Å; M283-V315 WeakPolarHBondContact CE-O 3.45Å; M283-V315 HydrophobicContact CG-CG1 4.17Å; M283-V315 HydrophobicContact CG-CG2 4.38Å; M283-A318 HydrophobicContact CE-CB 3.43Å; M283-A318 VanDerWaalsContact CE-CB 3.43Å; M283-A318 HydrophobicContact SD-CB 4.42Å; M283-M319 HydrophobicContact CE-CE 3.74Å; M283-M319 HydrophobicContact CE-CG 3.8Å; M283-M319 HydrophobicContact CE-SD 3.94Å; M283-M319 HydrophobicContact CG-CE 4.22Å; M283-M330 HydrophobicContact SD-CG 3.88Å; M283-M330 HydrophobicContact SD-SD 4.43Å; M283-V335 HydrophobicContact CB-CG1 3.59Å; M283-V335 HydrophobicContact CB-CG2 4.01Å; M283-V335 HydrophobicContact SD-CG2 4.29Å; M283-Y337 PolarHBondContact N-O 3.06Å; M283-V338 HydrophobicContact CB-CG2 4.48Å; M283-V338 WeakPolarHBondContact O-CA 3.34Å; M283-L339 PolarHBondContact O-N 2.92Å
284	S	95.7	Very high	95	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	26%	0.264	C	S	.	.			trans	-141.9	171.4	174.8	67.1	0	0	0	0	109.4	I292	S284-I292 WeakPolarHBondContact OG-CD1 3.46Å
285	W	95.7	Very high	94.9	Very high	7 Å²	7	47.9 Å²	47.9	3%	0.027	26%	0.257	C	S	.	.			trans	-64.8	154.6	165.4	-162.1	-121.7	0	0	0	111.5	D287 Y288 I312 V315 M359 I362	W285-D287 VanDerWaalsContact C-N 3.28Å; W285-D287 PolarHBondContact O-N 3.44Å; W285-Y288 HydrophobicContact CB-CD2 4.03Å; W285-Y288 HydrophobicContact CB-CE2 3.92Å; W285-Y288 PolarHBondContact O-N 3.44Å; W285-I312 HydrophobicContact CH2-CG2 4.09Å; W285-I312 HydrophobicContact CZ3-CG2 4.33Å; W285-V315 HydrophobicContact CE3-CG1 4.5Å; W285-M359 HydrophobicContact CB-CE 4.1Å; W285-M359 HydrophobicContact CD2-CE 3.76Å; W285-M359 HydrophobicContact CD2-CG 3.95Å; W285-M359 HydrophobicContact CD2-SD 4.19Å; W285-M359 HydrophobicContact CE3-CB 4.48Å; W285-M359 HydrophobicContact CE3-CE 4.04Å; W285-M359 HydrophobicContact CE3-CG 3.74Å; W285-M359 HydrophobicContact CE3-SD 3.87Å; W285-M359 HydrophobicContact CG-CE 3.79Å; W285-M359 HydrophobicContact CH2-CB 3.84Å; W285-M359 HydrophobicContact CH2-CG 3.64Å; W285-M359 HydrophobicContact CZ2-CB 4.38Å; W285-M359 HydrophobicContact CZ2-CG 3.79Å; W285-M359 HydrophobicContact CZ3-CB 3.88Å; W285-M359 HydrophobicContact CZ3-CG 3.6Å; W285-M359 HydrophobicContact CZ3-SD 4.21Å; W285-I362 HydrophobicContact CH2-CD1 3.95Å; W285-I362 HydrophobicContact CZ2-CD1 3.85Å
286	W	94.4	Very high	94.8	Very high	19 Å²	19	43.2 Å²	43.2	7%	0.072	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-64.3	-29.9	-169.8	61.9	-97.7	0	0	0	113.5	V74 Y288 G289 V302 D303 N304 T306	V74-W286 HydrophobicContact CG2-CH2 3.91Å; V74-W286 HydrophobicContact CG2-CZ2 4.5Å; W286-Y288 PolarHBondContact O-N 3.24Å; W286-Y288 VanDerWaalsContact O-N 3.17Å; W286-G289 PolarHBondContact O-N 3.01Å; W286-V302 HydrophobicContact CB-CG1 3.48Å; W286-V302 VanDerWaalsContact CB-CG1 3.48Å; W286-D303 CarbonylContact O-C 3.51Å; W286-N304 HydrophobicContact CE3-CB 4.49Å; W286-N304 WeakPolarHBondContact CZ3-OD1 3.46Å; W286-N304 PolarHBondContact O-N 2.92Å; W286-T306 HydrophobicContact CD2-CG2 3.9Å; W286-T306 HydrophobicContact CE3-CG2 3.7Å; W286-T306 HydrophobicContact CG-CG2 4.35Å; W286-T306 HydrophobicContact CZ3-CG2 4.17Å
287	D	92.2	Very high	94.8	Very high	35 Å²	35	48.3 Å²	48.3	19%	0.187	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-50.8	-41	177.1	-66	15.4	0	0	0	112.4	W285 N304 K355	W285-D287 VanDerWaalsContact C-N 3.28Å; W285-D287 PolarHBondContact O-N 3.44Å; D287-N304 PolarHBondContact O-ND2 3.2Å; D287-K355 IonicContact OD2-NZ 3.67Å; D287-K355 PolarHBondContact OD2-NZ 3.41Å
288	Y	93.7	Very high	94.9	Very high	12 Å²	12	45.1 Å²	45.1	5%	0.047	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-91.2	-5.1	-170.3	-45.4	-65.2	0	0	0	113.4	W285 W286 Y290 Q291 I292 I341 D352 K355	W285-Y288 HydrophobicContact CB-CD2 4.03Å; W285-Y288 HydrophobicContact CB-CE2 3.92Å; W285-Y288 PolarHBondContact O-N 3.44Å; W286-Y288 PolarHBondContact O-N 3.24Å; W286-Y288 VanDerWaalsContact O-N 3.17Å; Y288-Y290 VanDerWaalsContact C-N 3.33Å; Y288-Y290 PolarHBondContact O-N 2.91Å; Y288-Q291 WeakPolarHBondContact O-CB 3.33Å; Y288-Q291 PolarHBondContact O-N 3.02Å; Y288-I292 WeakPolarHBondContact O-CG1 3.13Å; Y288-I292 PolarHBondContact O-N 3.36Å; Y288-I341 HydrophobicContact CD1-CD1 3.56Å; Y288-I341 HydrophobicContact CD2-CD1 3.9Å; Y288-I341 HydrophobicContact CE1-CD1 3.16Å; Y288-I341 HydrophobicContact CE2-CD1 3.54Å; Y288-I341 HydrophobicContact CG-CD1 3.91Å; Y288-D352 WeakPolarHBondContact CE2-OD1 3.4Å; Y288-D352 PolarHBondContact OH-OD1 2.96Å; Y288-K355 PolarHBondContact OH-NZ 3.1Å
289	G	93.7	Very high	95	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56.6	-42.7	-171.4	0	0	0	0	0	113.7	W286 A293	W286-G289 PolarHBondContact O-N 3.01Å; G289-A293 WeakPolarHBondContact O-CB 3.29Å; G289-A293 PolarHBondContact O-N 2.98Å
290	Y	94.7	Very high	95	Very high	129 Å²	129	36.5 Å²	36.5	51%	0.506	20%	0.198	S	C	.	.	H	α-helix	trans	-70.8	-34.5	176	-67.5	-23.4	0	0	0	113.5	Y288 G294 D303 N304 N305	Y288-Y290 VanDerWaalsContact C-N 3.33Å; Y288-Y290 PolarHBondContact O-N 2.91Å; Y290-G294 PolarHBondContact O-N 3.38Å; Y290-D303 HydrophobicContact CE1-CB 4.09Å; Y290-N304 HydrophobicContact CD2-CB 3.59Å; Y290-N304 HydrophobicContact CE2-CB 3.63Å; Y290-N304 HydrophobicContact CG-CB 4.07Å; Y290-N305 WeakPolarHBondContact OH-CB 3.26Å
291	Q	94.1	Very high	94.9	Very high	57 Å²	57	37.7 Å²	37.7	27%	0.266	20%	0.204	S	C	.	.	H	α-helix	trans	-67.6	-43.5	178.2	-64.6	-176.2	-1	0	0	110.9	Y269 Y288 G294 M295	Y269-Q291 HydrophobicContact CE2-CB 3.92Å; Y269-Q291 PolarHBondContact OH-OE1 2.7Å; Y288-Q291 WeakPolarHBondContact O-CB 3.33Å; Y288-Q291 PolarHBondContact O-N 3.02Å; Q291-G294 PolarHBondContact O-N 2.91Å; Q291-M295 VanDerWaalsContact O-CB 3.31Å; Q291-M295 WeakPolarHBondContact O-CB 3.5Å; Q291-M295 PolarHBondContact O-N 3Å
292	I	95.1	Very high	94.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	I	π-helix	trans	-65.1	-48.3	177.7	-64	164.3	0	0	0	110.1	Y269 L272 I282 S284 Y288 G294 A296 N297 T300 L339	Y269-I292 HydrophobicContact CD1-CG1 4.18Å; Y269-I292 HydrophobicContact CE1-CG1 3.56Å; L272-I292 HydrophobicContact CD2-CG2 4.33Å; I282-I292 HydrophobicContact CD1-CG2 3.82Å; I282-I292 HydrophobicContact CG2-CD1 4.32Å; S284-I292 WeakPolarHBondContact OG-CD1 3.46Å; Y288-I292 WeakPolarHBondContact O-CG1 3.13Å; Y288-I292 PolarHBondContact O-N 3.36Å; I292-G294 VanDerWaalsContact C-N 3.31Å; I292-G294 PolarHBondContact O-N 3.49Å; I292-A296 HydrophobicContact CG2-CB 4.15Å; I292-A296 CarbonylContact O-C 3.59Å; I292-A296 WeakPolarHBondContact O-CA 3.49Å; I292-A296 VanDerWaalsContact O-CB 3.24Å; I292-A296 WeakPolarHBondContact O-CB 3.46Å; I292-A296 PolarHBondContact O-N 3.26Å; I292-N297 PolarHBondContact O-N 2.94Å; I292-N297 VanDerWaalsContact O-N 3.16Å; I292-T300 HydrophobicContact CB-CG2 3.67Å; I292-T300 HydrophobicContact CD1-CG2 4.36Å; I292-T300 HydrophobicContact CG2-CG2 3.48Å; I292-T300 VanDerWaalsContact CG2-CG2 3.48Å; I292-L339 HydrophobicContact CD1-CD1 4.28Å; I292-L339 HydrophobicContact CG1-CD1 4.43Å
293	A	95	Very high	94.5	Very high	43 Å²	43	36.4 Å²	36.4	36%	0.355	20%	0.204	S	C	.	.	I	π-helix	trans	-62.1	-38.6	178.4	0	0	0	0	0	112.4	G289 N297	G289-A293 WeakPolarHBondContact O-CB 3.29Å; G289-A293 PolarHBondContact O-N 2.98Å; A293-N297 WeakPolarHBondContact O-CA 3.43Å
294	G	94.4	Very high	94.3	Very high	66 Å²	66	39.4 Å²	39.4	68%	0.68	22%	0.22	S	C	*	.	I	π-helix	trans	-78.3	-42.7	-178.9	0	0	0	0	0	114.8	Y290 Q291 I292	Y290-G294 PolarHBondContact O-N 3.38Å; Q291-G294 PolarHBondContact O-N 2.91Å; I292-G294 VanDerWaalsContact C-N 3.31Å; I292-G294 PolarHBondContact O-N 3.49Å
295	M	94.2	Very high	94	Very high	79 Å²	79	43.1 Å²	43.1	39%	0.389	24%	0.24	S	C	.	.	I	π-helix	trans	-96.2	-43	-174.6	-63.1	-175.5	-179.9	0	0	113.2	V248 R266 Y269 Q291	V248-M295 HydrophobicContact CB-CE 4.45Å; V248-M295 HydrophobicContact CG1-CE 3.76Å; V248-M295 HydrophobicContact CG1-SD 4.27Å; V248-M295 HydrophobicContact CG2-CE 3.78Å; R266-M295 HydrophobicContact CG-SD 4.44Å; Y269-M295 HydrophobicContact CD2-CB 3.92Å; Y269-M295 HydrophobicContact CD2-CG 4.35Å; Y269-M295 HydrophobicContact CD2-SD 3.62Å; Y269-M295 HydrophobicContact CE2-SD 4.09Å; Y269-M295 HydrophobicContact CG-CB 4.16Å; Q291-M295 VanDerWaalsContact O-CB 3.31Å; Q291-M295 WeakPolarHBondContact O-CB 3.5Å; Q291-M295 PolarHBondContact O-N 3Å
296	A	94.9	Very high	93.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-85.7	-17.5	179.7	0	0	0	0	0	112.7	Y269 L272 S273 I292 R298	Y269-A296 WeakPolarHBondContact O-CA 3.36Å; Y269-A296 WeakPolarHBondContact O-CB 3.23Å; L272-A296 HydrophobicContact CB-CB 4.06Å; L272-A296 HydrophobicContact CD2-CB 3.81Å; L272-A296 HydrophobicContact CG-CB 4.21Å; S273-A296 WeakPolarHBondContact CA-O 3.4Å; S273-A296 VanDerWaalsContact CB-O 3.31Å; S273-A296 WeakPolarHBondContact CB-O 3.36Å; I292-A296 HydrophobicContact CG2-CB 4.15Å; I292-A296 CarbonylContact O-C 3.59Å; I292-A296 WeakPolarHBondContact O-CA 3.49Å; I292-A296 VanDerWaalsContact O-CB 3.24Å; I292-A296 WeakPolarHBondContact O-CB 3.46Å; I292-A296 PolarHBondContact O-N 3.26Å; A296-R298 PolarHBondContact O-N 3.42Å; A296-R298 PolarHBondContact O-NH1 3.43Å
297	N	96.1	Very high	93.4	Very high	118 Å²	118	51.6 Å²	51.6	63%	0.631	27%	0.274	S	S	*	.			trans	49.9	55.6	-177.8	-170.7	32.5	0	0	0	112.2	I292 A293	I292-N297 PolarHBondContact O-N 2.94Å; I292-N297 VanDerWaalsContact O-N 3.16Å; A293-N297 WeakPolarHBondContact O-CA 3.43Å
298	R	95.4	Very high	93.3	Very high	17 Å²	17	52.7 Å²	52.7	6%	0.064	28%	0.28	C	S	.	.			trans	-137	160.7	179.2	-69.8	-62.9	-179	-78.8	0.8	111.3	S273 T276 P277 D278 I282 A296 T300	S273-R298 PolarHBondContact O-NH2 3.32Å; T276-R298 PolarHBondContact O-NH2 2.94Å; T276-R298 PolarHBondContact OG1-NE 3.42Å; P277-R298 PolarHBondContact O-NE 3Å; D278-R298 IonicContact OD1-NH2 2.86Å; I282-R298 HydrophobicContact CD1-CB 3.19Å; I282-R298 HydrophobicContact CD1-CG 3.81Å; A296-R298 PolarHBondContact O-N 3.42Å; A296-R298 PolarHBondContact O-NH1 3.43Å; R298-T300 PolarHBondContact O-N 3.05Å
299	T	95.8	Very high	93.2	Very high	68 Å²	68	55 Å²	55	42%	0.417	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	121.7	-177.7	-54.6	0	0	0	0	110.3	A280 R281 I282	A280-T299 PolarHBondContact O-N 2.7Å; R281-T299 WeakPolarHBondContact CA-O 3.35Å; R281-T299 HydrophobicContact CG-CG2 4.03Å; I282-T299 PolarHBondContact N-O 2.66Å
300	T	95.2	Very high	93.1	Very high	32 Å²	32	57.5 Å²	57.5	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	146.5	172.8	53.1	0	0	0	0	110.6	I292 R298	I292-T300 HydrophobicContact CB-CG2 3.67Å; I292-T300 HydrophobicContact CD1-CG2 4.36Å; I292-T300 HydrophobicContact CG2-CG2 3.48Å; I292-T300 VanDerWaalsContact CG2-CG2 3.48Å; R298-T300 PolarHBondContact O-N 3.05Å
301	L	92.8	Very high	93	Very high	27 Å²	27	54 Å²	54	14%	0.141	30%	0.299	C	S	.	.	S	Bend	trans	-77.2	-34.1	175.7	-83.2	73.6	0	0	0	112.2	R281 I282 H311 L333 V335	R281-L301 HydrophobicContact CB-CD1 3.98Å; I282-L301 WeakPolarHBondContact O-CD1 3.26Å; I282-L301 PolarHBondContact O-N 3.09Å; L301-H311 PolarHBondContact O-CE1 3.12Å; L301-H311 PolarHBondContact O-ND1 3.35Å; L301-L333 HydrophobicContact CD2-CB 3.68Å; L301-L333 HydrophobicContact CD2-CD1 3.96Å; L301-L333 HydrophobicContact CD2-CG 4.37Å; L301-V335 HydrophobicContact CD1-CG2 4.05Å; L301-V335 HydrophobicContact CD2-CG2 3.43Å; L301-V335 VanDerWaalsContact CD2-CG2 3.43Å; L301-V335 HydrophobicContact CG-CG2 4.41Å
302	V	93.1	Very high	93.1	Very high	8 Å²	8	51.4 Å²	51.4	5%	0.048	29%	0.287	C	S	.	.	S	Bend	trans	-132.1	141.9	-173.1	-172.9	0	0	0	0	109.5	W286 I312 V315	W286-V302 HydrophobicContact CB-CG1 3.48Å; W286-V302 VanDerWaalsContact CB-CG1 3.48Å; V302-I312 HydrophobicContact CG1-CB 4.49Å; V302-I312 HydrophobicContact CG1-CD1 4.31Å; V302-I312 HydrophobicContact CG1-CG1 3.6Å; V302-V315 HydrophobicContact CG2-CB 4.02Å; V302-V315 HydrophobicContact CG2-CG1 4.4Å; V302-V315 HydrophobicContact CG2-CG2 3.42Å; V302-V315 VanDerWaalsContact CG2-CG2 3.42Å
303	D	91.3	Very high	93	Very high	47 Å²	47	51.4 Å²	51.4	25%	0.251	29%	0.287	S	S	.	.			trans	-120.7	169.8	-178.5	73.6	7.6	0	0	0	112.7	W286 Y290 N305	W286-D303 CarbonylContact O-C 3.51Å; Y290-D303 HydrophobicContact CE1-CB 4.09Å; D303-N305 PolarHBondContact O-N 3.01Å; D303-N305 WeakPolarHBondContact OD1-CB 3.49Å; D303-N305 PolarHBondContact OD1-N 3.29Å
304	N	92	Very high	93	Very high	62 Å²	62	52 Å²	52	33%	0.332	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-6.7	-177.4	-158.7	-38.3	0	0	0	112.5	W286 D287 Y290 T306	W286-N304 HydrophobicContact CE3-CB 4.49Å; W286-N304 WeakPolarHBondContact CZ3-OD1 3.46Å; W286-N304 PolarHBondContact O-N 2.92Å; D287-N304 PolarHBondContact O-ND2 3.2Å; Y290-N304 HydrophobicContact CD2-CB 3.59Å; Y290-N304 HydrophobicContact CE2-CB 3.63Å; Y290-N304 HydrophobicContact CG-CB 4.07Å; N304-T306 VanDerWaalsContact C-N 3.32Å; N304-T306 PolarHBondContact O-N 3.31Å
305	N	89.7	Confident	93.1	Very high	80 Å²	80	48.9 Å²	48.9	43%	0.428	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-27.7	-179.9	-165	16.1	0	0	0	112.8	R54 Y290 D303 W307	R54-N305 PolarHBondContact NH2-O 3.39Å; Y290-N305 WeakPolarHBondContact OH-CB 3.26Å; D303-N305 PolarHBondContact O-N 3.01Å; D303-N305 WeakPolarHBondContact OD1-CB 3.49Å; D303-N305 PolarHBondContact OD1-N 3.29Å; N305-W307 PolarHBondContact O-N 3.17Å
306	T	89.6	Confident	93.1	Very high	20 Å²	20	45.1 Å²	45.1	12%	0.123	23%	0.233	C	C	.	.			trans	56	42.1	175.5	63.3	0	0	0	0	114.8	R54 I70 W286 N304 I312	R54-T306 PolarHBondContact NH2-OG1 2.97Å; I70-T306 HydrophobicContact CD1-CG2 3.69Å; I70-T306 HydrophobicContact CG1-CG2 4.29Å; W286-T306 HydrophobicContact CD2-CG2 3.9Å; W286-T306 HydrophobicContact CE3-CG2 3.7Å; W286-T306 HydrophobicContact CG-CG2 4.35Å; W286-T306 HydrophobicContact CZ3-CG2 4.17Å; N304-T306 VanDerWaalsContact C-N 3.32Å; N304-T306 PolarHBondContact O-N 3.31Å; T306-I312 HydrophobicContact CG2-CD1 3.78Å
307	W	88.6	Confident	93.1	Very high	183 Å²	183	46.9 Å²	46.9	69%	0.693	24%	0.241	S	C	*	.			trans	-83.3	-22.6	-179.9	68.9	-88.5	0	0	0	113.8	N305	N305-W307 PolarHBondContact O-N 3.17Å
308	N	91	Very high	93.1	Very high	58 Å²	58	41.2 Å²	41.2	31%	0.31	21%	0.21	S	C	.	.			trans	-121.5	92.9	179.4	-173.5	-15.8	0	0	0	111.1	S310 H311 I312	N308-S310 PolarHBondContact O-N 3.24Å; N308-S310 PolarHBondContact OD1-N 3.06Å; N308-H311 HydrophobicContact CB-CB 4.25Å; N308-H311 PolarHBondContact O-N 2.89Å; N308-H311 PolarHBondContact OD1-N 3.16Å; N308-I312 WeakPolarHBondContact O-CG1 3.36Å; N308-I312 PolarHBondContact O-N 3.3Å
309	N	90.5	Very high	93.1	Very high	61 Å²	61	40.5 Å²	40.5	33%	0.326	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-39.1	-176.1	-65	-18.9	0	0	0	112.9	H311 I312 A313	N309-H311 VanDerWaalsContact C-N 3.27Å; N309-H311 PolarHBondContact O-N 2.81Å; N309-I312 WeakPolarHBondContact O-CB 3.32Å; N309-I312 PolarHBondContact O-N 3.13Å; N309-I312 VanDerWaalsContact O-N 3.13Å; N309-A313 WeakPolarHBondContact O-CB 3.48Å; N309-A313 PolarHBondContact O-N 3.12Å
310	S	92.4	Very high	93.1	Very high	52 Å²	52	37.3 Å²	37.3	36%	0.364	19%	0.188	S	C	.	.	H	α-helix	trans	-64.2	-33.7	-179.3	-48.9	0	0	0	0	111.8	N308 A313 L314 E366	N308-S310 PolarHBondContact O-N 3.24Å; N308-S310 PolarHBondContact OD1-N 3.06Å; S310-A313 PolarHBondContact O-N 3.27Å; S310-L314 WeakPolarHBondContact O-CG 3.47Å; S310-L314 PolarHBondContact O-N 2.78Å; S310-E366 WeakPolarHBondContact CB-OE2 3.43Å; S310-E366 PolarHBondContact OG-OE2 3.31Å
311	H	93	Very high	93.1	Very high	55 Å²	55	36.6 Å²	36.6	26%	0.255	18%	0.184	S	C	.	.	H	α-helix	trans	-68.7	-37.6	175.2	-163.4	-158.8	0	0	0	112.2	L301 N308 N309 A313 L314 V315	L301-H311 PolarHBondContact O-CE1 3.12Å; L301-H311 PolarHBondContact O-ND1 3.35Å; N308-H311 HydrophobicContact CB-CB 4.25Å; N308-H311 PolarHBondContact O-N 2.89Å; N308-H311 PolarHBondContact OD1-N 3.16Å; N309-H311 VanDerWaalsContact C-N 3.27Å; N309-H311 PolarHBondContact O-N 2.81Å; H311-A313 VanDerWaalsContact C-N 3.35Å; H311-L314 PolarHBondContact O-N 3.23Å; H311-V315 PolarHBondContact O-N 2.93Å
312	I	94.4	Very high	93.2	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-65.8	-41.3	173.4	-57	174.4	0	0	0	110.2	I70 W285 V302 T306 N308 N309 L314 V315 G316 I362	I70-I312 HydrophobicContact CD1-CD1 3.39Å; W285-I312 HydrophobicContact CH2-CG2 4.09Å; W285-I312 HydrophobicContact CZ3-CG2 4.33Å; V302-I312 HydrophobicContact CG1-CB 4.49Å; V302-I312 HydrophobicContact CG1-CD1 4.31Å; V302-I312 HydrophobicContact CG1-CG1 3.6Å; T306-I312 HydrophobicContact CG2-CD1 3.78Å; N308-I312 WeakPolarHBondContact O-CG1 3.36Å; N308-I312 PolarHBondContact O-N 3.3Å; N309-I312 WeakPolarHBondContact O-CB 3.32Å; N309-I312 PolarHBondContact O-N 3.13Å; N309-I312 VanDerWaalsContact O-N 3.13Å; I312-L314 VanDerWaalsContact C-N 3.31Å; I312-L314 PolarHBondContact O-N 2.58Å; I312-V315 PolarHBondContact O-N 3.36Å; I312-V315 VanDerWaalsContact O-N 3.16Å; I312-G316 PolarHBondContact O-N 3.04Å; I312-I362 HydrophobicContact CG2-CG2 4.16Å
313	A	94.3	Very high	93.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-35.4	176.9	0	0	0	0	0	112.4	N309 S310 H311 G316 K317 I362 E366	N309-A313 WeakPolarHBondContact O-CB 3.48Å; N309-A313 PolarHBondContact O-N 3.12Å; S310-A313 PolarHBondContact O-N 3.27Å; H311-A313 VanDerWaalsContact C-N 3.35Å; A313-G316 PolarHBondContact O-N 3.17Å; A313-K317 WeakPolarHBondContact O-CB 3.37Å; A313-K317 PolarHBondContact O-N 3.39Å; A313-I362 HydrophobicContact CB-CG2 4.19Å; A313-E366 HydrophobicContact CB-CB 3.73Å; A313-E366 HydrophobicContact CB-CG 3.58Å
314	L	94.9	Very high	93.3	Very high	56 Å²	56	39.1 Å²	39.1	29%	0.293	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-41.8	172	-74.2	173.8	0	0	0	112.4	S310 H311 I312 K317 A318	S310-L314 WeakPolarHBondContact O-CG 3.47Å; S310-L314 PolarHBondContact O-N 2.78Å; H311-L314 PolarHBondContact O-N 3.23Å; I312-L314 VanDerWaalsContact C-N 3.31Å; I312-L314 PolarHBondContact O-N 2.58Å; L314-K317 PolarHBondContact O-N 2.87Å; L314-A318 PolarHBondContact O-N 3.29Å
315	V	95.5	Very high	93.4	Very high	1 Å²	1	40 Å²	40	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-67.5	-42.9	174.9	167.9	0	0	0	0	111.3	M283 W285 V302 H311 I312 K317 A318 M319	M283-V315 HydrophobicContact CE-CB 4.26Å; M283-V315 HydrophobicContact CE-CG1 3.74Å; M283-V315 HydrophobicContact CE-CG2 4.41Å; M283-V315 WeakPolarHBondContact CE-O 3.45Å; M283-V315 HydrophobicContact CG-CG1 4.17Å; M283-V315 HydrophobicContact CG-CG2 4.38Å; W285-V315 HydrophobicContact CE3-CG1 4.5Å; V302-V315 HydrophobicContact CG2-CB 4.02Å; V302-V315 HydrophobicContact CG2-CG1 4.4Å; V302-V315 HydrophobicContact CG2-CG2 3.42Å; V302-V315 VanDerWaalsContact CG2-CG2 3.42Å; H311-V315 PolarHBondContact O-N 2.93Å; I312-V315 PolarHBondContact O-N 3.36Å; I312-V315 VanDerWaalsContact O-N 3.16Å; V315-K317 VanDerWaalsContact C-N 3.31Å; V315-K317 PolarHBondContact O-N 2.84Å; V315-A318 PolarHBondContact O-N 3.2Å; V315-M319 WeakPolarHBondContact O-CG 3.49Å; V315-M319 PolarHBondContact O-N 3.16Å
316	G	95.2	Very high	93.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.2	-41.8	173.3	0	0	0	0	0	112.1	I312 A313 M319 S320	I312-G316 PolarHBondContact O-N 3.04Å; A313-G316 PolarHBondContact O-N 3.17Å; G316-M319 PolarHBondContact O-N 3.25Å; G316-S320 WeakPolarHBondContact O-CB 3.46Å; G316-S320 PolarHBondContact O-N 2.96Å; G316-S320 PolarHBondContact O-OG 2.87Å
317	K	95.4	Very high	93.9	Very high	36 Å²	36	36.1 Å²	36.1	16%	0.157	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-44.7	175.5	176.6	172.2	177	-179	0	111.9	A313 L314 V315 M319 S320 S321 I329 A363 H367 D370 I371	A313-K317 WeakPolarHBondContact O-CB 3.37Å; A313-K317 PolarHBondContact O-N 3.39Å; L314-K317 PolarHBondContact O-N 2.87Å; V315-K317 VanDerWaalsContact C-N 3.31Å; V315-K317 PolarHBondContact O-N 2.84Å; K317-M319 VanDerWaalsContact C-N 3.34Å; K317-M319 PolarHBondContact O-N 2.97Å; K317-S320 PolarHBondContact O-N 3.01Å; K317-S320 PolarHBondContact O-OG 3.4Å; K317-S321 WeakPolarHBondContact O-CB 3.29Å; K317-S321 PolarHBondContact O-N 3.33Å; K317-S321 PolarHBondContact O-OG 3.05Å; K317-I329 HydrophobicContact CB-CD1 4.43Å; K317-I329 HydrophobicContact CD-CD1 4.07Å; K317-I329 HydrophobicContact CG-CD1 3.75Å; K317-A363 HydrophobicContact CB-CB 4.12Å; K317-H367 HydrophobicContact CD-CB 4.26Å; K317-D370 WeakPolarHBondContact CE-OD2 3.38Å; K317-D370 IonicContact NZ-OD2 2.92Å; K317-D370 PolarHBondContact NZ-OD2 2.9Å; K317-I371 HydrophobicContact CB-CD1 3.79Å; K317-I371 HydrophobicContact CD-CD1 4.5Å; K317-I371 HydrophobicContact CG-CD1 3.63Å
318	A	95.9	Very high	94.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.3	-41.3	175.5	0	0	0	0	0	111.9	M283 L314 V315 A326 I329 L397	M283-A318 HydrophobicContact CE-CB 3.43Å; M283-A318 VanDerWaalsContact CE-CB 3.43Å; M283-A318 HydrophobicContact SD-CB 4.42Å; L314-A318 PolarHBondContact O-N 3.29Å; V315-A318 PolarHBondContact O-N 3.2Å; A318-A326 WeakPolarHBondContact O-CB 3.47Å; A318-I329 HydrophobicContact CB-CB 4.04Å; A318-I329 HydrophobicContact CB-CD1 4.19Å; A318-I329 HydrophobicContact CB-CG2 3.84Å; A318-L397 WeakPolarHBondContact O-CD2 3.36Å
319	M	95.5	Very high	94.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-68.9	-32.3	178.5	-70.4	-60.8	-169.5	0	0	113.7	M283 V315 G316 K317 V338 V340 M359 C396 M398	M283-M319 HydrophobicContact CE-CE 3.74Å; M283-M319 HydrophobicContact CE-CG 3.8Å; M283-M319 HydrophobicContact CE-SD 3.94Å; M283-M319 HydrophobicContact CG-CE 4.22Å; V315-M319 WeakPolarHBondContact O-CG 3.49Å; V315-M319 PolarHBondContact O-N 3.16Å; G316-M319 PolarHBondContact O-N 3.25Å; K317-M319 VanDerWaalsContact C-N 3.34Å; K317-M319 PolarHBondContact O-N 2.97Å; M319-V338 HydrophobicContact CE-CG1 3.65Å; M319-V338 HydrophobicContact SD-CG1 4.36Å; M319-V340 HydrophobicContact CE-CG1 4.42Å; M319-M359 HydrophobicContact CB-SD 4.01Å; M319-M359 HydrophobicContact CG-SD 4.35Å; M319-C396 PolarHBondContact O-SG 2.71Å; M319-M398 HydrophobicContact CB-CE 3.92Å; M319-M398 HydrophobicContact CE-CE 4.38Å; M319-M398 HydrophobicContact CG-CE 3.88Å; M319-M398 WeakPolarHBondContact O-CB 3.34Å; M319-M398 PolarHBondContact O-N 3.4Å; M319-M398 HydrophobicContact SD-CE 3.57Å; M319-M398 VanDerWaalsContact SD-CE 3.57Å
320	S	95.1	Very high	94.6	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-94.6	-11.6	-176.3	56.1	0	0	0	0	114.8	G316 K317 I371 Y376 C396	G316-S320 WeakPolarHBondContact O-CB 3.46Å; G316-S320 PolarHBondContact O-N 2.96Å; G316-S320 PolarHBondContact O-OG 2.87Å; K317-S320 PolarHBondContact O-N 3.01Å; K317-S320 PolarHBondContact O-OG 3.4Å; S320-I371 WeakPolarHBondContact OG-CD1 3.44Å; S320-Y376 WeakPolarHBondContact CB-OH 3.02Å; S320-Y376 PolarHBondContact O-OH 3.43Å; S320-C396 WeakPolarHBondContact CA-SG 3.28Å; S320-C396 PolarHBondContact O-SG 3.36Å
321	S	95	Very high	94.7	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	15%	0.147	C	C	.	.	S	Bend	trans	-82.7	170.2	178.1	-65.4	0	0	0	0	113	K317 L397	K317-S321 WeakPolarHBondContact O-CB 3.29Å; K317-S321 PolarHBondContact O-N 3.33Å; K317-S321 PolarHBondContact O-OG 3.05Å; S321-L397 WeakPolarHBondContact O-CB 3.13Å; S321-L397 PolarHBondContact O-N 3.27Å
322	N	94.8	Very high	94.8	Very high	81 Å²	81	31.6 Å²	31.6	43%	0.433	17%	0.167	S	C	.	.	B	Isolated β-bridge	trans	-64.4	162.8	166.7	71.2	33	0	0	0	111.5	S324 E325 A326	N322-S324 VanDerWaalsContact C-N 3.28Å; N322-S324 PolarHBondContact O-N 2.91Å; N322-S324 PolarHBondContact OD1-N 2.92Å; N322-E325 PolarHBondContact O-N 3.18Å; N322-E325 WeakPolarHBondContact OD1-CB 3.46Å; N322-E325 WeakPolarHBondContact OD1-CG 3.48Å; N322-E325 PolarHBondContact OD1-N 2.65Å; N322-A326 VanDerWaalsContact O-CB 3.23Å; N322-A326 WeakPolarHBondContact O-CB 3.35Å; N322-A326 PolarHBondContact O-N 3.42Å
323	E	93.4	Very high	94.8	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.019	18%	0.177	C	C	.	.	H	α-helix	trans	-58.7	-35.2	-175.2	-155	-170.2	161.2	0	0	113.7	Y327 L397 K400 N435 Y436	E323-Y327 WeakPolarHBondContact O-CB 3.41Å; E323-Y327 PolarHBondContact O-N 3.4Å; E323-L397 HydrophobicContact CG-CD1 4.22Å; E323-K400 IonicContact OE2-NZ 3.17Å; E323-N435 WeakPolarHBondContact OE1-CA 3.44Å; E323-N435 PolarHBondContact OE1-N 3.32Å; E323-Y436 HydrophobicContact CB-CD2 4.29Å; E323-Y436 HydrophobicContact CG-CD2 3.78Å; E323-Y436 PolarHBondContact OE1-N 2.95Å
324	S	93.1	Very high	94.8	Very high	50 Å²	50	37.2 Å²	37.2	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-72.5	-44.5	-177.9	-66.2	0	0	0	0	113	N322 K328	N322-S324 VanDerWaalsContact C-N 3.28Å; N322-S324 PolarHBondContact O-N 2.91Å; N322-S324 PolarHBondContact OD1-N 2.92Å; S324-K328 PolarHBondContact O-N 3.37Å
325	E	93.8	Very high	94.9	Very high	81 Å²	81	34.7 Å²	34.7	38%	0.379	18%	0.184	S	C	.	.	H	α-helix	trans	-71.1	-41	176	-65.9	-47.8	127	0	0	111	N322 Y327 K328 I329	N322-E325 PolarHBondContact O-N 3.18Å; N322-E325 WeakPolarHBondContact OD1-CB 3.46Å; N322-E325 WeakPolarHBondContact OD1-CG 3.48Å; N322-E325 PolarHBondContact OD1-N 2.65Å; E325-Y327 VanDerWaalsContact C-N 3.29Å; E325-Y327 PolarHBondContact O-N 3.16Å; E325-K328 WeakPolarHBondContact O-CB 3.21Å; E325-K328 PolarHBondContact O-N 3.22Å; E325-K328 VanDerWaalsContact O-N 3.16Å; E325-K328 IonicContact OE1-NZ 2.75Å; E325-K328 PolarHBondContact OE1-NZ 2.84Å; E325-K328 WeakPolarHBondContact OE2-CD 3.44Å; E325-K328 IonicContact OE2-NZ 2.65Å; E325-K328 PolarHBondContact OE2-NZ 3.45Å; E325-I329 PolarHBondContact O-N 2.8Å
326	A	95.1	Very high	94.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-39.7	174.9	0	0	0	0	0	111.8	A318 N322 K328 I329 M330 L397	A318-A326 WeakPolarHBondContact O-CB 3.47Å; N322-A326 VanDerWaalsContact O-CB 3.23Å; N322-A326 WeakPolarHBondContact O-CB 3.35Å; N322-A326 PolarHBondContact O-N 3.42Å; A326-K328 VanDerWaalsContact C-N 3.34Å; A326-K328 PolarHBondContact O-N 3.48Å; A326-I329 PolarHBondContact O-N 3.19Å; A326-M330 HydrophobicContact CB-CE 4.38Å; A326-M330 WeakPolarHBondContact O-CB 3.23Å; A326-M330 WeakPolarHBondContact O-CG 3.47Å; A326-M330 PolarHBondContact O-N 2.94Å; A326-L397 HydrophobicContact CB-CB 4.2Å; A326-L397 HydrophobicContact CB-CD2 3.56Å; A326-L397 HydrophobicContact CB-CG 4.37Å
327	Y	95.2	Very high	95	Very high	19 Å²	19	38.5 Å²	38.5	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-61.9	-39.1	175.6	-175.7	-107.6	0	0	0	112.7	E323 E325 I329 M330 R331 Y436 V453 K454 L456	E323-Y327 WeakPolarHBondContact O-CB 3.41Å; E323-Y327 PolarHBondContact O-N 3.4Å; E325-Y327 VanDerWaalsContact C-N 3.29Å; E325-Y327 PolarHBondContact O-N 3.16Å; Y327-I329 VanDerWaalsContact C-N 3.32Å; Y327-I329 PolarHBondContact O-N 2.91Å; Y327-M330 HydrophobicContact CD2-CE 4.4Å; Y327-M330 PolarHBondContact O-N 2.93Å; Y327-R331 HydrophobicContact CD1-CG 4.11Å; Y327-R331 HydrophobicContact CD2-CG 4.24Å; Y327-R331 HydrophobicContact CE1-CG 3.75Å; Y327-R331 HydrophobicContact CE2-CG 3.93Å; Y327-R331 HydrophobicContact CG-CG 4.35Å; Y327-R331 WeakPolarHBondContact O-CB 3.39Å; Y327-R331 VanDerWaalsContact O-CG 3.26Å; Y327-R331 WeakPolarHBondContact O-CG 3.48Å; Y327-R331 PolarHBondContact O-N 2.92Å; Y327-Y436 AromaticContact CD1-CD1 3.5Å; Y327-Y436 HydrophobicContact CD1-CD1 3.5Å; Y327-Y436 AromaticContact CD1-CE1 3.83Å; Y327-Y436 HydrophobicContact CD1-CE1 3.83Å; Y327-Y436 HydrophobicContact CD1-CG 4.19Å; Y327-Y436 AromaticContact CD2-CD1 3.88Å; Y327-Y436 HydrophobicContact CD2-CD1 3.88Å; Y327-Y436 AromaticContact CD2-CG 3.96Å; Y327-Y436 HydrophobicContact CD2-CG 3.96Å; Y327-Y436 AromaticContact CE1-CD1 3.75Å; Y327-Y436 HydrophobicContact CE1-CD1 3.75Å; Y327-Y436 HydrophobicContact CE1-CE1 4.14Å; Y327-Y436 HydrophobicContact CE2-CD1 4.08Å; Y327-Y436 HydrophobicContact CE2-CG 4.45Å; Y327-Y436 AromaticContact CG-CD1 3.56Å; Y327-Y436 HydrophobicContact CG-CD1 3.56Å; Y327-Y436 HydrophobicContact CG-CE1 4.25Å; Y327-Y436 AromaticContact CG-CG 3.77Å; Y327-Y436 HydrophobicContact CG-CG 3.77Å; Y327-V453 HydrophobicContact CD2-CG1 3.93Å; Y327-V453 HydrophobicContact CE2-CG1 3.57Å; Y327-K454 WeakPolarHBondContact CE2-O 3.39Å; Y327-K454 PolarHBondContact OH-O 2.94Å; Y327-L456 HydrophobicContact CE1-CD2 4.16Å
328	K	94.9	Very high	95.1	Very high	120 Å²	120	36.8 Å²	36.8	52%	0.522	20%	0.196	S	C	.	.	H	α-helix	trans	-60.6	-43.2	174.1	-65.7	173.2	-167.8	165.7	0	111.5	S324 E325 A326 R331 A332	S324-K328 PolarHBondContact O-N 3.37Å; E325-K328 WeakPolarHBondContact O-CB 3.21Å; E325-K328 PolarHBondContact O-N 3.22Å; E325-K328 VanDerWaalsContact O-N 3.16Å; E325-K328 IonicContact OE1-NZ 2.75Å; E325-K328 PolarHBondContact OE1-NZ 2.84Å; E325-K328 WeakPolarHBondContact OE2-CD 3.44Å; E325-K328 IonicContact OE2-NZ 2.65Å; E325-K328 PolarHBondContact OE2-NZ 3.45Å; A326-K328 VanDerWaalsContact C-N 3.34Å; A326-K328 PolarHBondContact O-N 3.48Å; K328-R331 PolarHBondContact O-N 3.44Å; K328-A332 WeakPolarHBondContact O-CB 3.47Å; K328-A332 PolarHBondContact O-N 3.42Å
329	I	94.9	Very high	95.1	Very high	24 Å²	24	36.8 Å²	36.8	12%	0.123	20%	0.196	C	C	.	.	H	α-helix	trans	-67.4	-46.7	178.9	-60.5	167.2	0	0	0	110.6	K317 A318 E325 A326 Y327 R331 A332 L333	K317-I329 HydrophobicContact CB-CD1 4.43Å; K317-I329 HydrophobicContact CD-CD1 4.07Å; K317-I329 HydrophobicContact CG-CD1 3.75Å; A318-I329 HydrophobicContact CB-CB 4.04Å; A318-I329 HydrophobicContact CB-CD1 4.19Å; A318-I329 HydrophobicContact CB-CG2 3.84Å; E325-I329 PolarHBondContact O-N 2.8Å; A326-I329 PolarHBondContact O-N 3.19Å; Y327-I329 VanDerWaalsContact C-N 3.32Å; Y327-I329 PolarHBondContact O-N 2.91Å; I329-R331 VanDerWaalsContact C-N 3.29Å; I329-R331 PolarHBondContact O-N 2.9Å; I329-A332 PolarHBondContact O-N 3.12Å; I329-A332 VanDerWaalsContact O-N 3.12Å; I329-L333 HydrophobicContact CG2-CD1 3.82Å; I329-L333 HydrophobicContact CG2-CG 4.36Å; I329-L333 WeakPolarHBondContact O-CG 3.08Å; I329-L333 PolarHBondContact O-N 3.34Å
330	M	95.8	Very high	95.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-39.3	176.9	-73.3	-174.4	-67	0	0	112.1	M283 A326 Y327 L333 D334 V335 V338 L397 L437 V453	M283-M330 HydrophobicContact SD-CG 3.88Å; M283-M330 HydrophobicContact SD-SD 4.43Å; A326-M330 HydrophobicContact CB-CE 4.38Å; A326-M330 WeakPolarHBondContact O-CB 3.23Å; A326-M330 WeakPolarHBondContact O-CG 3.47Å; A326-M330 PolarHBondContact O-N 2.94Å; Y327-M330 HydrophobicContact CD2-CE 4.4Å; Y327-M330 PolarHBondContact O-N 2.93Å; M330-L333 CarbonylContact O-C 3.51Å; M330-D334 PolarHBondContact O-N 2.91Å; M330-V335 HydrophobicContact CB-CB 4.18Å; M330-V335 HydrophobicContact CB-CG2 4.44Å; M330-V335 PolarHBondContact O-N 3.27Å; M330-V338 HydrophobicContact SD-CG2 3.58Å; M330-V338 VanDerWaalsContact SD-CG2 3.58Å; M330-L397 HydrophobicContact CE-CD2 4.19Å; M330-L397 HydrophobicContact SD-CD2 4.42Å; M330-L437 HydrophobicContact CE-CD1 4.08Å; M330-L437 HydrophobicContact CE-CD2 4.39Å; M330-L437 HydrophobicContact CE-CG 4.44Å; M330-L437 HydrophobicContact SD-CD2 4.44Å; M330-V453 HydrophobicContact SD-CG2 3.96Å
331	R	93.9	Very high	95.2	Very high	85 Å²	85	36.7 Å²	36.7	32%	0.321	20%	0.195	S	C	.	.	H	α-helix	trans	-71.9	-34.9	175.1	-68.6	-58.5	-59.6	-167.9	0.6	112.9	Y327 K328 I329 L333 D334 D455	Y327-R331 HydrophobicContact CD1-CG 4.11Å; Y327-R331 HydrophobicContact CD2-CG 4.24Å; Y327-R331 HydrophobicContact CE1-CG 3.75Å; Y327-R331 HydrophobicContact CE2-CG 3.93Å; Y327-R331 HydrophobicContact CG-CG 4.35Å; Y327-R331 WeakPolarHBondContact O-CB 3.39Å; Y327-R331 VanDerWaalsContact O-CG 3.26Å; Y327-R331 WeakPolarHBondContact O-CG 3.48Å; Y327-R331 PolarHBondContact O-N 2.92Å; K328-R331 PolarHBondContact O-N 3.44Å; I329-R331 VanDerWaalsContact C-N 3.29Å; I329-R331 PolarHBondContact O-N 2.9Å; R331-L333 VanDerWaalsContact C-N 3.34Å; R331-D334 PolarHBondContact O-N 3.3Å; R331-D455 IonicContact NH1-OD1 3.74Å
332	A	94.4	Very high	95.3	Very high	84 Å²	84	36 Å²	36	69%	0.694	19%	0.19	S	C	*	.	H	α-helix	trans	-68.9	-33.9	175.7	0	0	0	0	0	112.4	K328 I329 D334	K328-A332 WeakPolarHBondContact O-CB 3.47Å; K328-A332 PolarHBondContact O-N 3.42Å; I329-A332 PolarHBondContact O-N 3.12Å; I329-A332 VanDerWaalsContact O-N 3.12Å; A332-D334 VanDerWaalsContact C-N 3.31Å
333	L	94.3	Very high	95.1	Very high	41 Å²	41	32.1 Å²	32.1	22%	0.215	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	2.5	173.9	-61.7	175	0	0	0	113	L301 I329 M330 R331 V335	L301-L333 HydrophobicContact CD2-CB 3.68Å; L301-L333 HydrophobicContact CD2-CD1 3.96Å; L301-L333 HydrophobicContact CD2-CG 4.37Å; I329-L333 HydrophobicContact CG2-CD1 3.82Å; I329-L333 HydrophobicContact CG2-CG 4.36Å; I329-L333 WeakPolarHBondContact O-CG 3.08Å; I329-L333 PolarHBondContact O-N 3.34Å; M330-L333 CarbonylContact O-C 3.51Å; R331-L333 VanDerWaalsContact C-N 3.34Å; L333-V335 VanDerWaalsContact C-N 3.27Å; L333-V335 HydrophobicContact CB-CG2 4.05Å; L333-V335 PolarHBondContact O-N 2.82Å
334	D	95	Very high	94.9	Very high	80 Å²	80	32 Å²	32	43%	0.428	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	34.3	164.8	-128.4	22.3	0	0	0	111.6	R281 M330 R331 A332	R281-D334 IonicContact CZ-OD2 3.68Å; R281-D334 PolarHBondContact NE-O 2.86Å; R281-D334 VanDerWaalsContact NH1-CB 3.33Å; R281-D334 IonicContact NH1-OD2 3.38Å; R281-D334 PolarHBondContact NH1-OD2 2.95Å; R281-D334 PolarHBondContact NH2-O 2.86Å; R281-D334 IonicContact NH2-OD1 2.67Å; R281-D334 IonicContact NH2-OD2 3.42Å; R281-D334 PolarHBondContact NH2-OD2 3.43Å; M330-D334 PolarHBondContact O-N 2.91Å; R331-D334 PolarHBondContact O-N 3.3Å; A332-D334 VanDerWaalsContact C-N 3.31Å
335	V	95.9	Very high	94.6	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	16%	0.161	C	C	.	.			trans	-76.4	133.4	-175.6	178.1	0	0	0	0	111.8	M283 L301 M330 L333 Y337 V338 V453	M283-V335 HydrophobicContact CB-CG1 3.59Å; M283-V335 HydrophobicContact CB-CG2 4.01Å; M283-V335 HydrophobicContact SD-CG2 4.29Å; L301-V335 HydrophobicContact CD1-CG2 4.05Å; L301-V335 HydrophobicContact CD2-CG2 3.43Å; L301-V335 VanDerWaalsContact CD2-CG2 3.43Å; L301-V335 HydrophobicContact CG-CG2 4.41Å; M330-V335 HydrophobicContact CB-CB 4.18Å; M330-V335 HydrophobicContact CB-CG2 4.44Å; M330-V335 PolarHBondContact O-N 3.27Å; L333-V335 VanDerWaalsContact C-N 3.27Å; L333-V335 HydrophobicContact CB-CG2 4.05Å; L333-V335 PolarHBondContact O-N 2.82Å; V335-Y337 VanDerWaalsContact CG1-O 3.3Å; V335-Y337 WeakPolarHBondContact CG1-O 3.46Å; V335-V338 HydrophobicContact CG1-CG2 4.17Å; V335-V453 HydrophobicContact CG1-CG2 4.06Å
336	D	96.4	Very high	94.1	Very high	59 Å²	59	31.2 Å²	31.2	32%	0.316	16%	0.16	S	C	.	.			trans	-99.8	-43.7	176.5	-58.1	-58.4	0	0	0	112.2	A280 R281 V453	A280-D336 WeakPolarHBondContact CA-OD2 3.45Å; R281-D336 PolarHBondContact N-OD2 2.83Å; R281-D336 PolarHBondContact O-N 3Å; D336-V453 PolarHBondContact O-N 2.91Å
337	Y	97.3	Very high	93.7	Very high	22 Å²	22	32.8 Å²	32.8	9%	0.086	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.2	-177.8	-65.2	-84.2	0	0	0	111.7	W271 L272 T276 A280 R281 I282 M283 V335 A440 I450 Y451 K452	W271-Y337 HydrophobicContact CH2-CE1 4.4Å; L272-Y337 HydrophobicContact CD1-CG 4.48Å; T276-Y337 HydrophobicContact CG2-CD2 4.1Å; T276-Y337 HydrophobicContact CG2-CE1 4.16Å; T276-Y337 HydrophobicContact CG2-CE2 3.53Å; A280-Y337 HydrophobicContact CB-CD2 4.03Å; A280-Y337 HydrophobicContact CB-CE2 3.98Å; R281-Y337 PolarHBondContact O-N 2.8Å; R281-Y337 VanDerWaalsContact O-N 3.13Å; I282-Y337 CarbonylContact C-O 3.59Å; I282-Y337 WeakPolarHBondContact CA-O 3.5Å; M283-Y337 PolarHBondContact N-O 3.06Å; V335-Y337 VanDerWaalsContact CG1-O 3.3Å; V335-Y337 WeakPolarHBondContact CG1-O 3.46Å; Y337-A440 HydrophobicContact CE1-CB 4.22Å; Y337-I450 HydrophobicContact CD1-CG2 3.92Å; Y337-I450 HydrophobicContact CG-CG2 4.44Å; Y337-Y451 CarbonylContact C-O 3.53Å; Y337-Y451 VanDerWaalsContact CA-O 3.25Å; Y337-Y451 WeakPolarHBondContact CA-O 3.39Å; Y337-K452 HydrophobicContact CD1-CB 3.92Å; Y337-K452 HydrophobicContact CD1-CG 4.32Å; Y337-K452 HydrophobicContact CE1-CB 3.75Å; Y337-K452 HydrophobicContact CE1-CD 3.99Å; Y337-K452 HydrophobicContact CE1-CG 3.93Å
338	V	97.1	Very high	93.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.4	173.9	-175.6	0	0	0	0	108.2	M283 M319 M330 V335 V340 L401 L437 I450 Y451 V453	M283-V338 HydrophobicContact CB-CG2 4.48Å; M283-V338 WeakPolarHBondContact O-CA 3.34Å; M319-V338 HydrophobicContact CE-CG1 3.65Å; M319-V338 HydrophobicContact SD-CG1 4.36Å; M330-V338 HydrophobicContact SD-CG2 3.58Å; M330-V338 VanDerWaalsContact SD-CG2 3.58Å; V335-V338 HydrophobicContact CG1-CG2 4.17Å; V338-V340 HydrophobicContact CG1-CG1 4.29Å; V338-L401 HydrophobicContact CG1-CD1 3.77Å; V338-L437 HydrophobicContact CG2-CD2 4.09Å; V338-I450 WeakPolarHBondContact O-CA 3.4Å; V338-Y451 PolarHBondContact N-O 2.91Å; V338-Y451 PolarHBondContact O-N 2.81Å; V338-V453 HydrophobicContact CG2-CG2 4.04Å
339	L	97.1	Very high	93	Very high	1 Å²	1	33 Å²	33	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.7	176.8	-174.2	154.5	0	0	0	109.2	Y269 I282 M283 I292 I341 V448 I450	Y269-L339 HydrophobicContact CD1-CD1 4.22Å; Y269-L339 HydrophobicContact CE1-CD1 3.81Å; I282-L339 HydrophobicContact CG2-CB 4.02Å; M283-L339 PolarHBondContact O-N 2.92Å; I292-L339 HydrophobicContact CD1-CD1 4.28Å; I292-L339 HydrophobicContact CG1-CD1 4.43Å; L339-I341 HydrophobicContact CD2-CD1 4.4Å; L339-I341 HydrophobicContact CD2-CG1 4.26Å; L339-V448 HydrophobicContact CD1-CG1 3.94Å; L339-V448 HydrophobicContact CD2-CG1 4.04Å; L339-V448 HydrophobicContact CG-CG1 3.86Å; L339-I450 HydrophobicContact CD1-CG1 4.34Å; L339-I450 HydrophobicContact CG-CG1 4.41Å
340	V	96.8	Very high	92.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.9	173.9	-61.2	0	0	0	0	110.3	M319 V338 D352 M398 L401 R449 Y451	M319-V340 HydrophobicContact CE-CG1 4.42Å; V338-V340 HydrophobicContact CG1-CG1 4.29Å; V340-D352 WeakPolarHBondContact CA-OD2 3.35Å; V340-M398 HydrophobicContact CB-SD 4.35Å; V340-M398 HydrophobicContact CG1-CE 4.19Å; V340-M398 HydrophobicContact CG1-SD 3.9Å; V340-L401 HydrophobicContact CG1-CB 4.19Å; V340-L401 HydrophobicContact CG1-CD1 3.86Å; V340-L401 HydrophobicContact CG2-CB 4.09Å; V340-R449 HydrophobicContact CG2-CB 3.93Å; V340-R449 PolarHBondContact N-O 3.4Å; V340-R449 PolarHBondContact O-N 3.5Å; V340-Y451 HydrophobicContact CG2-CD2 4.27Å; V340-Y451 HydrophobicContact CG2-CE2 3.84Å
341	I	96	Very high	92.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124	175.2	-72.2	152.2	0	0	0	109.3	F265 Y288 L339 Y348 D351 D352 L447 V448	F265-I341 HydrophobicContact CE1-CD1 3.66Å; F265-I341 HydrophobicContact CE1-CG1 4.09Å; F265-I341 HydrophobicContact CZ-CD1 4.44Å; Y288-I341 HydrophobicContact CD1-CD1 3.56Å; Y288-I341 HydrophobicContact CD2-CD1 3.9Å; Y288-I341 HydrophobicContact CE1-CD1 3.16Å; Y288-I341 HydrophobicContact CE2-CD1 3.54Å; Y288-I341 HydrophobicContact CG-CD1 3.91Å; L339-I341 HydrophobicContact CD2-CD1 4.4Å; L339-I341 HydrophobicContact CD2-CG1 4.26Å; I341-Y348 HydrophobicContact CG2-CD1 4.31Å; I341-Y348 HydrophobicContact CG2-CE1 4.27Å; I341-D351 HydrophobicContact CG2-CB 4.37Å; I341-D352 PolarHBondContact N-OD2 2.92Å; I341-D352 PolarHBondContact O-N 3.16Å; I341-L447 CarbonylContact C-O 3.49Å; I341-L447 VanDerWaalsContact CA-O 3.27Å; I341-L447 WeakPolarHBondContact CA-O 3.39Å; I341-L447 HydrophobicContact CG2-CD1 4.48Å; I341-V448 HydrophobicContact CG1-CG2 4.28Å
342	F	95.3	Very high	92.7	Very high	1 Å²	1	28.6 Å²	28.6	0%	0.004	17%	0.174	C	C	.	.			trans	-122.3	112.7	-176.7	172.8	-118.3	0	0	0	110.7	F403 F406 W446 L447 R449	F342-F403 AromaticContact CE2-CD1 3.85Å; F342-F403 HydrophobicContact CE2-CD1 3.85Å; F342-F403 AromaticContact CE2-CE1 3.44Å; F342-F403 HydrophobicContact CE2-CE1 3.44Å; F342-F403 VanDerWaalsContact CE2-CE1 3.44Å; F342-F403 HydrophobicContact CE2-CZ 4.04Å; F342-F403 HydrophobicContact CZ-CD1 4.02Å; F342-F403 AromaticContact CZ-CE1 3.87Å; F342-F403 HydrophobicContact CZ-CE1 3.87Å; F342-F406 AromaticContact CE1-CD2 3.56Å; F342-F406 HydrophobicContact CE1-CD2 3.56Å; F342-F406 AromaticContact CE1-CE2 3.63Å; F342-F406 HydrophobicContact CE1-CE2 3.63Å; F342-F406 HydrophobicContact CE1-CG 4.12Å; F342-F406 HydrophobicContact CE1-CZ 4.24Å; F342-F406 HydrophobicContact CZ-CD1 4.04Å; F342-F406 AromaticContact CZ-CD2 3.7Å; F342-F406 HydrophobicContact CZ-CD2 3.7Å; F342-F406 AromaticContact CZ-CE1 3.98Å; F342-F406 HydrophobicContact CZ-CE1 3.98Å; F342-F406 AromaticContact CZ-CE2 3.64Å; F342-F406 HydrophobicContact CZ-CE2 3.64Å; F342-F406 AromaticContact CZ-CG 3.9Å; F342-F406 HydrophobicContact CZ-CG 3.9Å; F342-F406 AromaticContact CZ-CZ 3.77Å; F342-F406 HydrophobicContact CZ-CZ 3.77Å; F342-W446 HydrophobicContact CD1-CB 4.38Å; F342-W446 WeakPolarHBondContact CD1-O 3.37Å; F342-L447 PolarHBondContact N-O 3.45Å; F342-L447 VanDerWaalsContact O-CA 3.31Å; F342-L447 WeakPolarHBondContact O-CA 3.43Å; F342-R449 HydrophobicContact CB-CG 4.42Å
343	G	91.2	Very high	92.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.01	14%	0.143	C	C	.	.			trans	-94.1	0.6	-175.2	0	0	0	0	0	115.2	L345 G347 Y348 D351 T422	G343-L345 PolarHBondContact O-N 3.38Å; G343-G347 WeakPolarHBondContact O-CA 3.49Å; G343-G347 PolarHBondContact O-N 3.16Å; G343-Y348 PolarHBondContact O-N 2.9Å; G343-D351 VanDerWaalsContact N-CB 3.29Å; G343-D351 PolarHBondContact N-OD2 3.25Å; G343-D351 VanDerWaalsContact N-OD2 3.1Å; G343-T422 PolarHBondContact O-OG1 3.28Å
344	G	88.5	Confident	92.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22	-162.9	0	0	0	0	0	116.1	D420 R421 R423	G344-D420 VanDerWaalsContact CA-OD1 3.31Å; G344-D420 WeakPolarHBondContact CA-OD1 3.34Å; G344-R421 WeakPolarHBondContact O-CB 3.39Å; G344-R421 PolarHBondContact O-N 2.63Å; G344-R423 VanDerWaalsContact CA-NH2 3.31Å
345	L	87.3	Confident	92.5	Very high	36 Å²	36	25 Å²	25	19%	0.188	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-48.1	177.1	-176.3	61.3	0	0	0	111.9	G343 F406 V409 T411 R421 W446	G343-L345 PolarHBondContact O-N 3.38Å; L345-F406 HydrophobicContact CB-CE2 4.36Å; L345-V409 HydrophobicContact CD1-CG1 4.17Å; L345-T411 HydrophobicContact CD1-CG2 3.59Å; L345-R421 WeakPolarHBondContact O-CD 3.12Å; L345-R421 PolarHBondContact O-NE 2.86Å; L345-W446 HydrophobicContact CD2-CB 4.22Å; L345-W446 HydrophobicContact CD2-CG 4.19Å
346	F	83.5	Confident	92.5	Very high	80 Å²	80	24.9 Å²	24.9	35%	0.351	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-29.9	-176	179.9	-102.8	0	0	0	113	A252 L262	A252-F346 HydrophobicContact CB-CE1 4.4Å; A252-F346 HydrophobicContact CB-CE2 3.66Å; A252-F346 HydrophobicContact CB-CZ 3.32Å; L262-F346 HydrophobicContact CD1-CD1 3.7Å; L262-F346 HydrophobicContact CD1-CD2 3.84Å; L262-F346 HydrophobicContact CD1-CE1 3.56Å; L262-F346 HydrophobicContact CD1-CE2 3.72Å; L262-F346 HydrophobicContact CD1-CG 3.87Å; L262-F346 HydrophobicContact CD1-CZ 3.6Å
347	G	86.1	Confident	92.3	Very high	33 Å²	33	23.6 Å²	23.6	34%	0.34	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.3	31.1	-172.5	0	0	0	0	0	113.4	G343 S349 T422	G343-G347 WeakPolarHBondContact O-CA 3.49Å; G343-G347 PolarHBondContact O-N 3.16Å; G347-S349 PolarHBondContact O-N 2.66Å; G347-T422 WeakPolarHBondContact CA-OG1 3.49Å
348	Y	89.1	Confident	92.2	Very high	56 Å²	56	25.8 Å²	25.8	22%	0.22	14%	0.141	C	C	.	.			trans	-76.1	121	176.4	-177.8	-114.3	0	0	0	110.1	L250 I341 G343 G350 D351 T422 L447	L250-Y348 HydrophobicContact CD1-CD2 3.6Å; L250-Y348 HydrophobicContact CD1-CE2 3.64Å; L250-Y348 HydrophobicContact CD1-CG 4.26Å; L250-Y348 HydrophobicContact CD2-CE2 3.97Å; L250-Y348 HydrophobicContact CG-CE2 4.49Å; I341-Y348 HydrophobicContact CG2-CD1 4.31Å; I341-Y348 HydrophobicContact CG2-CE1 4.27Å; G343-Y348 PolarHBondContact O-N 2.9Å; Y348-G350 VanDerWaalsContact CE1-CA 3.46Å; Y348-G350 WeakPolarHBondContact CE1-O 3.26Å; Y348-D351 HydrophobicContact CD1-CB 4.43Å; Y348-T422 PolarHBondContact O-OG1 3.43Å; Y348-L447 HydrophobicContact CD1-CD1 3.83Å; Y348-L447 HydrophobicContact CG-CD1 3.92Å
349	S	87.6	Confident	92.1	Very high	87 Å²	87	25.8 Å²	25.8	61%	0.608	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-20.2	-176.6	57.7	0	0	0	0	114	G347 D351 N354	G347-S349 PolarHBondContact O-N 2.66Å; S349-D351 PolarHBondContact O-N 3Å; S349-N354 PolarHBondContact O-ND2 3.44Å
350	G	87.7	Confident	92	Very high	17 Å²	17	25.7 Å²	25.7	18%	0.175	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	24.7	-178.7	0	0	0	0	0	114.6	Y348 K355	Y348-G350 VanDerWaalsContact CE1-CA 3.46Å; Y348-G350 WeakPolarHBondContact CE1-O 3.26Å; G350-K355 WeakPolarHBondContact O-CE 3.17Å
351	D	93.7	Very high	91.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-80.1	165.5	-175.7	78.7	-7.7	0	0	0	113.7	I341 G343 Y348 S349 I353 N354 K355 R423	I341-D351 HydrophobicContact CG2-CB 4.37Å; G343-D351 VanDerWaalsContact N-CB 3.29Å; G343-D351 PolarHBondContact N-OD2 3.25Å; G343-D351 VanDerWaalsContact N-OD2 3.1Å; Y348-D351 HydrophobicContact CD1-CB 4.43Å; S349-D351 PolarHBondContact O-N 3Å; D351-I353 PolarHBondContact O-N 3.35Å; D351-N354 PolarHBondContact O-N 2.99Å; D351-N354 PolarHBondContact OD1-N 3.02Å; D351-N354 VanDerWaalsContact OD1-N 3.12Å; D351-K355 PolarHBondContact O-N 3.38Å; D351-R423 IonicContact OD1-NH1 2.7Å; D351-R423 PolarHBondContact OD1-NH1 2.75Å; D351-R423 IonicContact OD2-CZ 3.79Å; D351-R423 IonicContact OD2-NH1 2.58Å; D351-R423 PolarHBondContact OD2-NH1 2.6Å; D351-R423 IonicContact OD2-NH2 2.83Å; D351-R423 PolarHBondContact OD2-NH2 3.29Å
352	D	95.8	Very high	91.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-69.1	-21.1	-173.4	-77.7	-31	0	0	0	113.1	Y288 V340 I341 K355 F356 M359 M398	Y288-D352 WeakPolarHBondContact CE2-OD1 3.4Å; Y288-D352 PolarHBondContact OH-OD1 2.96Å; V340-D352 WeakPolarHBondContact CA-OD2 3.35Å; I341-D352 PolarHBondContact N-OD2 2.92Å; I341-D352 PolarHBondContact O-N 3.16Å; D352-K355 CarbonylContact O-C 3.58Å; D352-K355 PolarHBondContact O-N 3.16Å; D352-F356 WeakPolarHBondContact O-CA 3.43Å; D352-F356 WeakPolarHBondContact O-CB 3.34Å; D352-F356 PolarHBondContact O-N 2.72Å; D352-M359 HydrophobicContact CB-CE 4.02Å; D352-M398 HydrophobicContact CB-CE 4.09Å; D352-M398 HydrophobicContact CB-SD 3.89Å
353	I	94.7	Very high	91.6	Very high	6 Å²	6	29.8 Å²	29.8	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-70.8	-41.6	175.4	-61.8	-64.7	0	0	0	111	D351 K355 F356 F383 V385 M398 F403 R423	D351-I353 PolarHBondContact O-N 3.35Å; I353-K355 PolarHBondContact O-N 2.83Å; I353-F356 WeakPolarHBondContact O-CB 3.38Å; I353-F356 PolarHBondContact O-N 3.24Å; I353-F383 HydrophobicContact CG2-CE1 4.39Å; I353-V385 HydrophobicContact CG2-CG2 4.41Å; I353-M398 HydrophobicContact CD1-CG 3.9Å; I353-F403 HydrophobicContact CD1-CE2 4.15Å; I353-F403 HydrophobicContact CG1-CE2 4.35Å; I353-R423 VanDerWaalsContact CG2-NH1 3.29Å
354	N	93	Very high	91.8	Very high	76 Å²	76	32.3 Å²	32.3	41%	0.406	17%	0.169	S	C	.	.	H	α-helix	trans	-68	-26.8	174.8	-75	-18.1	0	0	0	112.3	S349 D351	S349-N354 PolarHBondContact O-ND2 3.44Å; D351-N354 PolarHBondContact O-N 2.99Å; D351-N354 PolarHBondContact OD1-N 3.02Å; D351-N354 VanDerWaalsContact OD1-N 3.12Å
355	K	93	Very high	91.8	Very high	46 Å²	46	35.1 Å²	35.1	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-87.4	-8.4	174	-61	178.9	-171.9	179.7	0	113.5	D287 Y288 G350 D351 D352 I353 L357 W358 M359	D287-K355 IonicContact OD2-NZ 3.67Å; D287-K355 PolarHBondContact OD2-NZ 3.41Å; Y288-K355 PolarHBondContact OH-NZ 3.1Å; G350-K355 WeakPolarHBondContact O-CE 3.17Å; D351-K355 PolarHBondContact O-N 3.38Å; D352-K355 CarbonylContact O-C 3.58Å; D352-K355 PolarHBondContact O-N 3.16Å; I353-K355 PolarHBondContact O-N 2.83Å; K355-L357 VanDerWaalsContact C-N 3.28Å; K355-L357 PolarHBondContact O-N 2.74Å; K355-W358 WeakPolarHBondContact O-CB 3.44Å; K355-W358 PolarHBondContact O-N 2.87Å; K355-M359 HydrophobicContact CB-CE 4.44Å; K355-M359 PolarHBondContact O-N 2.92Å
356	F	95.1	Very high	92	Very high	1 Å²	1	37.9 Å²	37.9	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-57.1	-40.6	-170.8	178.3	-106.8	0	0	0	112.9	D352 I353 W358 M359 V360 Y376 F383 L393 C396 M398	D352-F356 WeakPolarHBondContact O-CA 3.43Å; D352-F356 WeakPolarHBondContact O-CB 3.34Å; D352-F356 PolarHBondContact O-N 2.72Å; I353-F356 WeakPolarHBondContact O-CB 3.38Å; I353-F356 PolarHBondContact O-N 3.24Å; F356-W358 PolarHBondContact O-N 3.46Å; F356-M359 HydrophobicContact CD2-SD 4.42Å; F356-M359 WeakPolarHBondContact O-CA 3.41Å; F356-M359 VanDerWaalsContact O-CB 3.23Å; F356-M359 WeakPolarHBondContact O-CB 3.24Å; F356-M359 PolarHBondContact O-N 3.15Å; F356-V360 HydrophobicContact CD1-CG2 4.08Å; F356-V360 HydrophobicContact CE1-CG2 3.57Å; F356-V360 HydrophobicContact CE2-CG2 4.33Å; F356-V360 HydrophobicContact CZ-CG2 3.71Å; F356-V360 PolarHBondContact O-N 3.25Å; F356-Y376 AromaticContact CE1-CD1 3.65Å; F356-Y376 HydrophobicContact CE1-CD1 3.65Å; F356-Y376 AromaticContact CE1-CE1 3.94Å; F356-Y376 HydrophobicContact CE1-CE1 3.94Å; F356-Y376 HydrophobicContact CE1-CG 4.11Å; F356-Y376 AromaticContact CZ-CD1 3.94Å; F356-Y376 HydrophobicContact CZ-CD1 3.94Å; F356-Y376 AromaticContact CZ-CE1 3.73Å; F356-Y376 HydrophobicContact CZ-CE1 3.73Å; F356-F383 HydrophobicContact CD1-CE2 4.01Å; F356-F383 HydrophobicContact CD1-CZ 4.03Å; F356-L393 HydrophobicContact CD1-CD1 4.04Å; F356-L393 HydrophobicContact CE1-CD1 3.62Å; F356-L393 HydrophobicContact CZ-CD1 4.25Å; F356-C396 VanDerWaalsContact CE2-SG 3.56Å; F356-C396 HydrophobicContact CZ-CB 4.49Å; F356-C396 WeakPolarHBondContact CZ-SG 3.12Å; F356-M398 HydrophobicContact CD2-CB 3.73Å; F356-M398 HydrophobicContact CD2-CG 3.77Å; F356-M398 HydrophobicContact CE2-CB 3.67Å; F356-M398 HydrophobicContact CE2-CG 4.24Å
357	L	93.6	Very high	92.4	Very high	32 Å²	32	36.4 Å²	36.4	17%	0.168	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-30.2	-179.4	-162.4	63.4	0	0	0	112.5	K355 V360 R361 E373 F377	K355-L357 VanDerWaalsContact C-N 3.28Å; K355-L357 PolarHBondContact O-N 2.74Å; L357-V360 PolarHBondContact O-N 2.89Å; L357-R361 WeakPolarHBondContact O-CG 3.34Å; L357-R361 PolarHBondContact O-N 2.79Å; L357-E373 HydrophobicContact CD1-CG 3.69Å; L357-F377 HydrophobicContact CD1-CE2 4.34Å; L357-F377 HydrophobicContact CD1-CZ 3.87Å; L357-F377 HydrophobicContact CD2-CZ 4.03Å
358	W	93.7	Very high	92.7	Very high	68 Å²	68	38.4 Å²	38.4	26%	0.258	21%	0.211	S	C	.	.	H	α-helix	trans	-69.3	-34.9	171.5	-68.9	112.6	0	0	0	112.3	P69 S72 K355 F356 V360 R361 I362	P69-W358 HydrophobicContact CB-CZ3 4.48Å; S72-W358 VanDerWaalsContact OG-CZ3 3.31Å; S72-W358 WeakPolarHBondContact OG-CZ3 3.42Å; K355-W358 WeakPolarHBondContact O-CB 3.44Å; K355-W358 PolarHBondContact O-N 2.87Å; F356-W358 PolarHBondContact O-N 3.46Å; W358-V360 VanDerWaalsContact C-N 3.31Å; W358-R361 PolarHBondContact O-N 3.01Å; W358-I362 WeakPolarHBondContact O-CB 3.31Å; W358-I362 WeakPolarHBondContact O-CD1 3.5Å; W358-I362 VanDerWaalsContact O-CG1 3.24Å; W358-I362 WeakPolarHBondContact O-CG1 3.23Å; W358-I362 PolarHBondContact O-N 3.1Å
359	M	95	Very high	92.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-42.4	174	-47.9	-173.1	-175.5	0	0	111	W285 M319 D352 K355 F356 A363 M398	W285-M359 HydrophobicContact CB-CE 4.1Å; W285-M359 HydrophobicContact CD2-CE 3.76Å; W285-M359 HydrophobicContact CD2-CG 3.95Å; W285-M359 HydrophobicContact CD2-SD 4.19Å; W285-M359 HydrophobicContact CE3-CB 4.48Å; W285-M359 HydrophobicContact CE3-CE 4.04Å; W285-M359 HydrophobicContact CE3-CG 3.74Å; W285-M359 HydrophobicContact CE3-SD 3.87Å; W285-M359 HydrophobicContact CG-CE 3.79Å; W285-M359 HydrophobicContact CH2-CB 3.84Å; W285-M359 HydrophobicContact CH2-CG 3.64Å; W285-M359 HydrophobicContact CZ2-CB 4.38Å; W285-M359 HydrophobicContact CZ2-CG 3.79Å; W285-M359 HydrophobicContact CZ3-CB 3.88Å; W285-M359 HydrophobicContact CZ3-CG 3.6Å; W285-M359 HydrophobicContact CZ3-SD 4.21Å; M319-M359 HydrophobicContact CB-SD 4.01Å; M319-M359 HydrophobicContact CG-SD 4.35Å; D352-M359 HydrophobicContact CB-CE 4.02Å; K355-M359 HydrophobicContact CB-CE 4.44Å; K355-M359 PolarHBondContact O-N 2.92Å; F356-M359 HydrophobicContact CD2-SD 4.42Å; F356-M359 WeakPolarHBondContact O-CA 3.41Å; F356-M359 VanDerWaalsContact O-CB 3.23Å; F356-M359 WeakPolarHBondContact O-CB 3.24Å; F356-M359 PolarHBondContact O-N 3.15Å; M359-A363 VanDerWaalsContact O-CB 3.28Å; M359-A363 WeakPolarHBondContact O-CB 3.19Å; M359-A363 PolarHBondContact O-N 3.09Å; M359-M398 HydrophobicContact CE-CE 3.85Å; M359-M398 HydrophobicContact SD-CE 3.69Å
360	V	95	Very high	93	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-51.1	176.4	175.2	0	0	0	0	111	F356 L357 W358 I362 A363 E364 I371 E373 Y376	F356-V360 HydrophobicContact CD1-CG2 4.08Å; F356-V360 HydrophobicContact CE1-CG2 3.57Å; F356-V360 HydrophobicContact CE2-CG2 4.33Å; F356-V360 HydrophobicContact CZ-CG2 3.71Å; F356-V360 PolarHBondContact O-N 3.25Å; L357-V360 PolarHBondContact O-N 2.89Å; W358-V360 VanDerWaalsContact C-N 3.31Å; V360-I362 PolarHBondContact O-N 3.44Å; V360-A363 PolarHBondContact O-N 3.37Å; V360-A363 VanDerWaalsContact O-N 3.15Å; V360-E364 WeakPolarHBondContact O-CB 3.43Å; V360-E364 PolarHBondContact O-N 3.38Å; V360-I371 HydrophobicContact CG1-CG2 3.76Å; V360-E373 HydrophobicContact CG1-CB 4.24Å; V360-E373 HydrophobicContact CG1-CG 4.24Å; V360-Y376 HydrophobicContact CB-CD2 4.48Å; V360-Y376 HydrophobicContact CB-CE2 4.34Å; V360-Y376 HydrophobicContact CG1-CD2 3.71Å; V360-Y376 HydrophobicContact CG1-CE2 3.57Å; V360-Y376 HydrophobicContact CG2-CD2 3.92Å; V360-Y376 HydrophobicContact CG2-CE2 3.73Å; V360-Y376 HydrophobicContact CG2-CG 4.4Å
361	R	93.5	Very high	93.3	Very high	75 Å²	75	44.5 Å²	44.5	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-60.8	-41.3	179.8	-73.9	174.4	-176.5	146.6	6.3	113.7	P69 L357 W358 A363 G365 E373	P69-R361 HydrophobicContact CB-CB 4.35Å; L357-R361 WeakPolarHBondContact O-CG 3.34Å; L357-R361 PolarHBondContact O-N 2.79Å; W358-R361 PolarHBondContact O-N 3.01Å; R361-A363 VanDerWaalsContact C-N 3.33Å; R361-G365 PolarHBondContact O-N 3.2Å; R361-G365 VanDerWaalsContact O-N 3.1Å; R361-E373 HydrophobicContact CG-CG 4.46Å; R361-E373 WeakPolarHBondContact CG-OE2 3.27Å; R361-E373 IonicContact CZ-OE1 2.74Å; R361-E373 IonicContact CZ-OE2 2.79Å; R361-E373 VanDerWaalsContact NE-CD 3.32Å; R361-E373 IonicContact NE-OE1 2.89Å; R361-E373 PolarHBondContact NE-OE1 2.95Å; R361-E373 IonicContact NE-OE2 2.87Å; R361-E373 PolarHBondContact NE-OE2 2.89Å; R361-E373 IonicContact NH2-OE1 3.46Å; R361-E373 PolarHBondContact NH2-OE1 2.73Å; R361-E373 IonicContact NH2-OE2 3.35Å
362	I	93.1	Very high	93.3	Very high	11 Å²	11	48 Å²	48	6%	0.056	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-38.8	177.4	-67.2	166.6	0	0	0	110.2	P69 I70 W285 I312 A313 W358 V360	P69-I362 HydrophobicContact CB-CG1 4.33Å; P69-I362 HydrophobicContact CG-CG1 4.14Å; I70-I362 HydrophobicContact CB-CD1 4.25Å; I70-I362 HydrophobicContact CG1-CD1 4.45Å; W285-I362 HydrophobicContact CH2-CD1 3.95Å; W285-I362 HydrophobicContact CZ2-CD1 3.85Å; I312-I362 HydrophobicContact CG2-CG2 4.16Å; A313-I362 HydrophobicContact CB-CG2 4.19Å; W358-I362 WeakPolarHBondContact O-CB 3.31Å; W358-I362 WeakPolarHBondContact O-CD1 3.5Å; W358-I362 VanDerWaalsContact O-CG1 3.24Å; W358-I362 WeakPolarHBondContact O-CG1 3.23Å; W358-I362 PolarHBondContact O-N 3.1Å; V360-I362 PolarHBondContact O-N 3.44Å
363	A	94.3	Very high	93.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.4	-41.5	176.9	0	0	0	0	0	112.7	K317 M359 V360 R361 G365 E366 H367 I371	K317-A363 HydrophobicContact CB-CB 4.12Å; M359-A363 VanDerWaalsContact O-CB 3.28Å; M359-A363 WeakPolarHBondContact O-CB 3.19Å; M359-A363 PolarHBondContact O-N 3.09Å; V360-A363 PolarHBondContact O-N 3.37Å; V360-A363 VanDerWaalsContact O-N 3.15Å; R361-A363 VanDerWaalsContact C-N 3.33Å; A363-G365 VanDerWaalsContact C-N 3.32Å; A363-G365 PolarHBondContact O-N 2.92Å; A363-E366 PolarHBondContact O-N 3.25Å; A363-H367 WeakPolarHBondContact O-CA 3.38Å; A363-H367 WeakPolarHBondContact O-CB 3.39Å; A363-H367 PolarHBondContact O-N 2.83Å; A363-I371 HydrophobicContact CB-CD1 3.67Å
364	E	94.2	Very high	93.1	Very high	55 Å²	55	53.6 Å²	53.6	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-38.1	176.5	179.9	175.2	-146.3	0	0	111.8	V360 E366 H367 P368 E373	V360-E364 WeakPolarHBondContact O-CB 3.43Å; V360-E364 PolarHBondContact O-N 3.38Å; E364-E366 VanDerWaalsContact C-N 3.3Å; E364-E366 PolarHBondContact O-N 3.1Å; E364-H367 CarbonylContact O-C 3.58Å; E364-H367 PolarHBondContact O-N 3.45Å; E364-P368 VanDerWaalsContact O-CA 3.31Å; E364-P368 WeakPolarHBondContact O-CA 3.45Å; E364-P368 WeakPolarHBondContact O-CB 3.15Å; E364-P368 WeakPolarHBondContact O-CD 3.13Å; E364-P368 VanDerWaalsContact O-N 3.11Å; E364-E373 PolarHBondContact OE1-N 2.79Å; E364-E373 WeakPolarHBondContact OE2-CB 3.21Å
365	G	90.1	Very high	93.1	Very high	58 Å²	58	53.3 Å²	53.3	60%	0.598	28%	0.277	S	S	*	.	H	α-helix	trans	-58.7	-36.6	178.8	0	0	0	0	0	114.4	R361 A363	R361-G365 PolarHBondContact O-N 3.2Å; R361-G365 VanDerWaalsContact O-N 3.1Å; A363-G365 VanDerWaalsContact C-N 3.32Å; A363-G365 PolarHBondContact O-N 2.92Å
366	E	90.9	Very high	93.2	Very high	95 Å²	95	51.5 Å²	51.5	44%	0.444	27%	0.269	S	S	.	.	H	α-helix	trans	-98.3	-28.2	178.7	-64.7	-77.6	133.4	0	0	112.7	S310 A313 A363 E364 P368	S310-E366 WeakPolarHBondContact CB-OE2 3.43Å; S310-E366 PolarHBondContact OG-OE2 3.31Å; A313-E366 HydrophobicContact CB-CB 3.73Å; A313-E366 HydrophobicContact CB-CG 3.58Å; A363-E366 PolarHBondContact O-N 3.25Å; E364-E366 VanDerWaalsContact C-N 3.3Å; E364-E366 PolarHBondContact O-N 3.1Å; E366-P368 VanDerWaalsContact C-CD 3.43Å; E366-P368 WeakPolarHBondContact O-CD 3.36Å
367	H	92.4	Very high	93.1	Very high	49 Å²	49	54 Å²	54	23%	0.227	28%	0.28	C	S	.	.			trans	-127.6	61.6	-176.1	-59.7	-56.1	0	0	0	112.7	K317 A363 E364 K369 D370 I371	K317-H367 HydrophobicContact CD-CB 4.26Å; A363-H367 WeakPolarHBondContact O-CA 3.38Å; A363-H367 WeakPolarHBondContact O-CB 3.39Å; A363-H367 PolarHBondContact O-N 2.83Å; E364-H367 CarbonylContact O-C 3.58Å; E364-H367 PolarHBondContact O-N 3.45Å; H367-K369 PolarHBondContact O-N 2.93Å; H367-D370 PolarHBondContact O-N 2.82Å; H367-D370 VanDerWaalsContact O-N 3.16Å; H367-I371 PolarHBondContact O-N 3Å
368	P	90.9	Very high	93	Very high	75 Å²	75	53.5 Å²	53.5	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-6.3	-173.6	29.1	-37.6	0	0	0	114.1	E364 E366 H372	E364-P368 VanDerWaalsContact O-CA 3.31Å; E364-P368 WeakPolarHBondContact O-CA 3.45Å; E364-P368 WeakPolarHBondContact O-CB 3.15Å; E364-P368 WeakPolarHBondContact O-CD 3.13Å; E364-P368 VanDerWaalsContact O-N 3.11Å; E366-P368 VanDerWaalsContact C-CD 3.43Å; E366-P368 WeakPolarHBondContact O-CD 3.36Å; P368-H372 PolarHBondContact O-NE2 2.84Å; P368-H372 VanDerWaalsContact O-NE2 3.12Å
369	K	92.1	Very high	92.7	Very high	188 Å²	188	60 Å²	60	82%	0.817	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-23.1	178	-65.2	-178.9	-178.9	176.3	0	113	H367	H367-K369 PolarHBondContact O-N 2.93Å
370	D	91.8	Very high	92.3	Very high	96 Å²	96	66.3 Å²	66.3	51%	0.513	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-32.8	-168.6	-59.2	-44.8	0	0	0	112.1	K317 H367	K317-D370 WeakPolarHBondContact CE-OD2 3.38Å; K317-D370 IonicContact NZ-OD2 2.92Å; K317-D370 PolarHBondContact NZ-OD2 2.9Å; H367-D370 PolarHBondContact O-N 2.82Å; H367-D370 VanDerWaalsContact O-N 3.16Å
371	I	93.3	Very high	92.1	Very high	4 Å²	4	68.3 Å²	68.3	2%	0.021	37%	0.367	C	S	.	.			trans	-131.1	130.9	-175.7	-70.1	165.7	0	0	0	108.2	K317 S320 V360 A363 H367 Y376	K317-I371 HydrophobicContact CB-CD1 3.79Å; K317-I371 HydrophobicContact CD-CD1 4.5Å; K317-I371 HydrophobicContact CG-CD1 3.63Å; S320-I371 WeakPolarHBondContact OG-CD1 3.44Å; V360-I371 HydrophobicContact CG1-CG2 3.76Å; A363-I371 HydrophobicContact CB-CD1 3.67Å; H367-I371 PolarHBondContact O-N 3Å; I371-Y376 HydrophobicContact CG2-CE2 4.02Å
372	H	93.4	Very high	91.9	Very high	74 Å²	74	69 Å²	69	34%	0.343	38%	0.376	S	S	.	.			trans	-124.9	134.9	172.1	-53.7	95.7	0	0	0	109.2	P368 S374 D375 Y376	P368-H372 PolarHBondContact O-NE2 2.84Å; P368-H372 VanDerWaalsContact O-NE2 3.12Å; H372-S374 PolarHBondContact O-N 3.04Å; H372-D375 IonicContact ND1-OD2 2.75Å; H372-D375 PolarHBondContact O-N 3.13Å; H372-Y376 WeakPolarHBondContact O-CD2 3.33Å; H372-Y376 WeakPolarHBondContact O-CE2 3.3Å
373	E	92.9	Very high	91.9	Very high	39 Å²	39	71.6 Å²	71.6	18%	0.182	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-60	-37.2	-179.6	-161.6	-172.2	147.7	0	0	111.8	L357 V360 R361 E364 D375 Y376 F377	L357-E373 HydrophobicContact CD1-CG 3.69Å; V360-E373 HydrophobicContact CG1-CB 4.24Å; V360-E373 HydrophobicContact CG1-CG 4.24Å; R361-E373 HydrophobicContact CG-CG 4.46Å; R361-E373 WeakPolarHBondContact CG-OE2 3.27Å; R361-E373 IonicContact CZ-OE1 2.74Å; R361-E373 IonicContact CZ-OE2 2.79Å; R361-E373 VanDerWaalsContact NE-CD 3.32Å; R361-E373 IonicContact NE-OE1 2.89Å; R361-E373 PolarHBondContact NE-OE1 2.95Å; R361-E373 IonicContact NE-OE2 2.87Å; R361-E373 PolarHBondContact NE-OE2 2.89Å; R361-E373 IonicContact NH2-OE1 3.46Å; R361-E373 PolarHBondContact NH2-OE1 2.73Å; R361-E373 IonicContact NH2-OE2 3.35Å; E364-E373 PolarHBondContact OE1-N 2.79Å; E364-E373 WeakPolarHBondContact OE2-CB 3.21Å; E373-D375 PolarHBondContact O-N 2.95Å; E373-D375 VanDerWaalsContact O-N 3.16Å; E373-Y376 PolarHBondContact O-N 3.43Å; E373-F377 HydrophobicContact CG-CE2 3.8Å; E373-F377 HydrophobicContact CG-CZ 4.41Å; E373-F377 WeakPolarHBondContact O-CD2 3.39Å
374	S	93.2	Very high	91.7	Very high	83 Å²	83	75.4 Å²	75.4	58%	0.58	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-56.7	-31.1	-179.6	54.2	0	0	0	0	113.7	H372 Y376 F377	H372-S374 PolarHBondContact O-N 3.04Å; S374-Y376 PolarHBondContact O-N 2.93Å; S374-F377 PolarHBondContact O-N 3.36Å
375	D	93.8	Very high	91.6	Very high	71 Å²	71	73 Å²	73	38%	0.38	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-72.2	-16.4	-173.1	-66.1	-12.4	0	0	0	112.5	H372 E373 S390 T392	H372-D375 IonicContact ND1-OD2 2.75Å; H372-D375 PolarHBondContact O-N 3.13Å; E373-D375 PolarHBondContact O-N 2.95Å; E373-D375 VanDerWaalsContact O-N 3.16Å; D375-S390 WeakPolarHBondContact O-CB 3.34Å; D375-S390 PolarHBondContact O-OG 3.48Å; D375-T392 HydrophobicContact CB-CG2 4.3Å; D375-T392 WeakPolarHBondContact O-CB 3.43Å
376	Y	94.4	Very high	91.6	Very high	8 Å²	8	70.8 Å²	70.8	3%	0.031	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-93.6	-9.4	179.6	-60.5	-83.3	0	0	0	113.7	S320 F356 V360 I371 H372 E373 S374 T392 L393	S320-Y376 WeakPolarHBondContact CB-OH 3.02Å; S320-Y376 PolarHBondContact O-OH 3.43Å; F356-Y376 AromaticContact CE1-CD1 3.65Å; F356-Y376 HydrophobicContact CE1-CD1 3.65Å; F356-Y376 AromaticContact CE1-CE1 3.94Å; F356-Y376 HydrophobicContact CE1-CE1 3.94Å; F356-Y376 HydrophobicContact CE1-CG 4.11Å; F356-Y376 AromaticContact CZ-CD1 3.94Å; F356-Y376 HydrophobicContact CZ-CD1 3.94Å; F356-Y376 AromaticContact CZ-CE1 3.73Å; F356-Y376 HydrophobicContact CZ-CE1 3.73Å; V360-Y376 HydrophobicContact CB-CD2 4.48Å; V360-Y376 HydrophobicContact CB-CE2 4.34Å; V360-Y376 HydrophobicContact CG1-CD2 3.71Å; V360-Y376 HydrophobicContact CG1-CE2 3.57Å; V360-Y376 HydrophobicContact CG2-CD2 3.92Å; V360-Y376 HydrophobicContact CG2-CE2 3.73Å; V360-Y376 HydrophobicContact CG2-CG 4.4Å; I371-Y376 HydrophobicContact CG2-CE2 4.02Å; H372-Y376 WeakPolarHBondContact O-CD2 3.33Å; H372-Y376 WeakPolarHBondContact O-CE2 3.3Å; E373-Y376 PolarHBondContact O-N 3.43Å; S374-Y376 PolarHBondContact O-N 2.93Å; Y376-T392 HydrophobicContact CD1-CG2 4.27Å; Y376-T392 HydrophobicContact CE1-CG2 3.94Å; Y376-L393 HydrophobicContact CD1-CB 4.18Å; Y376-L393 HydrophobicContact CD1-CD1 4.21Å
377	F	93.7	Very high	91.6	Very high	53 Å²	53	73 Å²	73	23%	0.232	38%	0.375	C	S	.	.	S	Bend	trans	-87.9	152	175.3	-64.9	-72.1	0	0	0	111.2	L357 E373 S374 G381 F383 S390	L357-F377 HydrophobicContact CD1-CE2 4.34Å; L357-F377 HydrophobicContact CD1-CZ 3.87Å; L357-F377 HydrophobicContact CD2-CZ 4.03Å; E373-F377 HydrophobicContact CG-CE2 3.8Å; E373-F377 HydrophobicContact CG-CZ 4.41Å; E373-F377 WeakPolarHBondContact O-CD2 3.39Å; S374-F377 PolarHBondContact O-N 3.36Å; F377-G381 VanDerWaalsContact CD1-O 3.29Å; F377-G381 WeakPolarHBondContact CD1-O 3.31Å; F377-F383 HydrophobicContact CD1-CB 4.01Å; F377-F383 HydrophobicContact CE1-CB 3.93Å; F377-S390 WeakPolarHBondContact O-CB 3.38Å
378	S	90.2	Very high	91.5	Very high	22 Å²	22	74.5 Å²	74.5	15%	0.154	38%	0.384	C	S	.	.			trans	-66.9	170.3	169.2	-163.6	0	0	0	0	110.8	D380 G381 D382 L388	S378-D380 PolarHBondContact O-N 3.01Å; S378-D380 VanDerWaalsContact O-N 3.16Å; S378-G381 PolarHBondContact O-N 3.07Å; S378-D382 PolarHBondContact N-O 2.96Å; S378-L388 WeakPolarHBondContact CB-O 3.11Å; S378-L388 PolarHBondContact OG-O 3.16Å
379	E	87.8	Confident	91.5	Very high	205 Å²	205	71.3 Å²	71.3	96%	0.958	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-28.5	176.8	-64	-175.4	172.9	0	0	112.2	G381	E379-G381 VanDerWaalsContact C-N 3.28Å; E379-G381 PolarHBondContact O-N 2.98Å
380	D	87.8	Confident	91.5	Very high	131 Å²	131	62.8 Å²	62.8	70%	0.701	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.1	175.3	-63.5	-38.8	0	0	0	113.7	S378	S378-D380 PolarHBondContact O-N 3.01Å; S378-D380 VanDerWaalsContact O-N 3.16Å
381	G	89.5	Confident	91.6	Very high	43 Å²	43	62.6 Å²	62.6	44%	0.443	33%	0.333	S	S	.	.	S	Bend	trans	88.5	3.1	-174.8	0	0	0	0	0	115	F377 S378 E379	F377-G381 VanDerWaalsContact CD1-O 3.29Å; F377-G381 WeakPolarHBondContact CD1-O 3.31Å; S378-G381 PolarHBondContact O-N 3.07Å; E379-G381 VanDerWaalsContact C-N 3.28Å; E379-G381 PolarHBondContact O-N 2.98Å
382	D	90.8	Very high	91.6	Very high	88 Å²	88	65.3 Å²	65.3	47%	0.471	35%	0.35	S	S	.	.			trans	-86.1	140.4	179.9	-72	-26	0	0	0	112.7	S378 R384	S378-D382 PolarHBondContact N-O 2.96Å; D382-R384 HydrophobicContact CB-CG 3.83Å; D382-R384 PolarHBondContact O-N 3.49Å
383	F	92.3	Very high	91.6	Very high	67 Å²	67	62 Å²	62	29%	0.294	34%	0.335	S	S	.	.			trans	-85	99.3	170.6	-177.4	-104.2	0	0	0	109.9	I353 F356 F377 L393	I353-F383 HydrophobicContact CG2-CE1 4.39Å; F356-F383 HydrophobicContact CD1-CE2 4.01Å; F356-F383 HydrophobicContact CD1-CZ 4.03Å; F377-F383 HydrophobicContact CD1-CB 4.01Å; F377-F383 HydrophobicContact CE1-CB 3.93Å; F383-L393 HydrophobicContact CD2-CD2 4.02Å; F383-L393 HydrophobicContact CE2-CD1 3.84Å; F383-L393 HydrophobicContact CE2-CD2 3.52Å; F383-L393 HydrophobicContact CE2-CG 4.33Å; F383-L393 HydrophobicContact CZ-CD1 4.13Å; F383-L393 HydrophobicContact CZ-CD2 3.96Å
384	R	90.4	Very high	91.6	Very high	80 Å²	80	60.9 Å²	60.9	30%	0.302	33%	0.33	S	S	.	.			trans	-121.6	141.1	-175.2	-58.8	178.7	69.1	154.4	5.6	111.7	D382 D386 G389 L393	D382-R384 HydrophobicContact CB-CG 3.83Å; D382-R384 PolarHBondContact O-N 3.49Å; R384-D386 WeakPolarHBondContact CB-OD1 3.46Å; R384-D386 IonicContact CZ-OD2 3.38Å; R384-D386 IonicContact NE-OD1 2.63Å; R384-D386 PolarHBondContact NE-OD1 2.92Å; R384-D386 IonicContact NE-OD2 3.06Å; R384-D386 PolarHBondContact NE-OD2 2.85Å; R384-D386 IonicContact NH2-OD2 3.2Å; R384-D386 PolarHBondContact NH2-OD2 3.05Å; R384-G389 WeakPolarHBondContact O-CA 3.36Å; R384-L393 VanDerWaalsContact O-CD2 3.29Å; R384-L393 WeakPolarHBondContact O-CD2 3.45Å
385	V	91.5	Very high	91.6	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.03	32%	0.323	C	S	.	.			trans	-102.2	-4.8	179.9	-174.2	0	0	0	0	111.4	I353 Y399 F403 V425 G428	I353-V385 HydrophobicContact CG2-CG2 4.41Å; V385-Y399 HydrophobicContact CG1-CD2 4.11Å; V385-Y399 HydrophobicContact CG1-CE2 3.54Å; V385-F403 HydrophobicContact CG1-CD2 4.26Å; V385-F403 HydrophobicContact CG1-CE1 4.41Å; V385-F403 HydrophobicContact CG1-CE2 3.37Å; V385-F403 HydrophobicContact CG1-CZ 3.47Å; V385-F403 VanDerWaalsContact CG1-CZ 3.47Å; V385-V425 HydrophobicContact CB-CG2 4.42Å; V385-G428 PolarHBondContact O-N 3.45Å
386	D	91.1	Very high	91.6	Very high	10 Å²	10	57.4 Å²	57.4	5%	0.053	31%	0.305	C	S	.	.	S	Bend	trans	-78.4	-172.7	177.3	62.5	17.8	0	0	0	112.1	R384 L388 G389 V425 E426	R384-D386 WeakPolarHBondContact CB-OD1 3.46Å; R384-D386 IonicContact CZ-OD2 3.38Å; R384-D386 IonicContact NE-OD1 2.63Å; R384-D386 PolarHBondContact NE-OD1 2.92Å; R384-D386 IonicContact NE-OD2 3.06Å; R384-D386 PolarHBondContact NE-OD2 2.85Å; R384-D386 IonicContact NH2-OD2 3.2Å; R384-D386 PolarHBondContact NH2-OD2 3.05Å; D386-L388 PolarHBondContact O-N 2.91Å; D386-L388 VanDerWaalsContact O-N 3.16Å; D386-L388 WeakPolarHBondContact OD1-CA 3.3Å; D386-L388 WeakPolarHBondContact OD1-CB 3.28Å; D386-L388 PolarHBondContact OD1-N 3.48Å; D386-G389 PolarHBondContact O-N 3.25Å; D386-G389 PolarHBondContact OD1-N 2.98Å; D386-V425 HydrophobicContact CB-CB 4.46Å; D386-E426 VanDerWaalsContact CA-O 3.28Å; D386-E426 WeakPolarHBondContact CA-O 3.33Å; D386-E426 VanDerWaalsContact CB-O 3.3Å; D386-E426 WeakPolarHBondContact CB-O 3.42Å
387	H	89.4	Confident	91.7	Very high	142 Å²	142	57 Å²	57	66%	0.657	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.3	178.8	66.8	-81.8	0	0	0	114	G428	H387-G428 VanDerWaalsContact N-CA 3.29Å
388	L	90.8	Very high	91.8	Very high	80 Å²	80	54.5 Å²	54.5	42%	0.419	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-0.5	175	-58.2	175.9	0	0	0	112.2	S378 D386	S378-L388 WeakPolarHBondContact CB-O 3.11Å; S378-L388 PolarHBondContact OG-O 3.16Å; D386-L388 PolarHBondContact O-N 2.91Å; D386-L388 VanDerWaalsContact O-N 3.16Å; D386-L388 WeakPolarHBondContact OD1-CA 3.3Å; D386-L388 WeakPolarHBondContact OD1-CB 3.28Å; D386-L388 PolarHBondContact OD1-N 3.48Å
389	G	90.2	Very high	92	Very high	8 Å²	8	53.6 Å²	53.6	8%	0.082	29%	0.286	C	S	.	.	S	Bend	trans	-61.9	158.1	171.2	0	0	0	0	0	112.2	R384 D386 L394	R384-G389 WeakPolarHBondContact O-CA 3.36Å; D386-G389 PolarHBondContact O-N 3.25Å; D386-G389 PolarHBondContact OD1-N 2.98Å; G389-L394 VanDerWaalsContact O-CD1 3.23Å; G389-L394 WeakPolarHBondContact O-CD1 3.44Å
390	S	93.7	Very high	92.3	Very high	10 Å²	10	45.2 Å²	45.2	7%	0.07	25%	0.246	C	C	.	.			trans	-58.7	136	176.7	169.1	0	0	0	0	111.1	D375 F377 T392 L393 L394	D375-S390 WeakPolarHBondContact O-CB 3.34Å; D375-S390 PolarHBondContact O-OG 3.48Å; F377-S390 WeakPolarHBondContact O-CB 3.38Å; S390-T392 PolarHBondContact O-N 3.44Å; S390-T392 VanDerWaalsContact O-N 3.13Å; S390-T392 WeakPolarHBondContact OG-CB 3.37Å; S390-T392 PolarHBondContact OG-N 2.87Å; S390-T392 VanDerWaalsContact OG-N 3.12Å; S390-L393 WeakPolarHBondContact O-CB 3.33Å; S390-L393 PolarHBondContact O-N 3.33Å; S390-L394 WeakPolarHBondContact O-CD1 3.31Å; S390-L394 PolarHBondContact O-N 2.83Å
391	P	92.3	Very high	92.7	Very high	91 Å²	91	39 Å²	39	59%	0.591	21%	0.213	S	C	*	.	H	α-helix	trans	-59.6	-24.8	174.4	25.9	-34.8	0	0	0	112.4	N395	P391-N395 WeakPolarHBondContact O-CB 3.44Å; P391-N395 PolarHBondContact O-N 3.26Å; P391-N395 PolarHBondContact O-ND2 3.01Å
392	T	93.3	Very high	92.9	Very high	61 Å²	61	37 Å²	37	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-68.5	-44.7	174	-54.1	0	0	0	0	110.8	D375 Y376 S390 N395 C396	D375-T392 HydrophobicContact CB-CG2 4.3Å; D375-T392 WeakPolarHBondContact O-CB 3.43Å; Y376-T392 HydrophobicContact CD1-CG2 4.27Å; Y376-T392 HydrophobicContact CE1-CG2 3.94Å; S390-T392 PolarHBondContact O-N 3.44Å; S390-T392 VanDerWaalsContact O-N 3.13Å; S390-T392 WeakPolarHBondContact OG-CB 3.37Å; S390-T392 PolarHBondContact OG-N 2.87Å; S390-T392 VanDerWaalsContact OG-N 3.12Å; T392-N395 PolarHBondContact O-N 2.81Å; T392-C396 PolarHBondContact O-N 2.85Å
393	L	94.2	Very high	93.1	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-64.7	-46.8	176.4	178.5	63.2	0	0	0	111.5	F356 Y376 F383 R384 S390 N395 C396 Y399	F356-L393 HydrophobicContact CD1-CD1 4.04Å; F356-L393 HydrophobicContact CE1-CD1 3.62Å; F356-L393 HydrophobicContact CZ-CD1 4.25Å; Y376-L393 HydrophobicContact CD1-CB 4.18Å; Y376-L393 HydrophobicContact CD1-CD1 4.21Å; F383-L393 HydrophobicContact CD2-CD2 4.02Å; F383-L393 HydrophobicContact CE2-CD1 3.84Å; F383-L393 HydrophobicContact CE2-CD2 3.52Å; F383-L393 HydrophobicContact CE2-CG 4.33Å; F383-L393 HydrophobicContact CZ-CD1 4.13Å; F383-L393 HydrophobicContact CZ-CD2 3.96Å; R384-L393 VanDerWaalsContact O-CD2 3.29Å; R384-L393 WeakPolarHBondContact O-CD2 3.45Å; S390-L393 WeakPolarHBondContact O-CB 3.33Å; S390-L393 PolarHBondContact O-N 3.33Å; L393-N395 PolarHBondContact O-N 3.28Å; L393-N395 VanDerWaalsContact O-N 3.16Å; L393-C396 WeakPolarHBondContact O-CB 3.24Å; L393-C396 PolarHBondContact O-N 2.73Å; L393-C396 VanDerWaalsContact O-N 3.1Å; L393-Y399 WeakPolarHBondContact O-CB 3.49Å
394	L	93.1	Very high	93.2	Very high	14 Å²	14	31 Å²	31	7%	0.073	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-20.9	179	-79.1	148.3	0	0	0	113.7	G389 S390 Y399 N429	G389-L394 VanDerWaalsContact O-CD1 3.23Å; G389-L394 WeakPolarHBondContact O-CD1 3.44Å; S390-L394 WeakPolarHBondContact O-CD1 3.31Å; S390-L394 PolarHBondContact O-N 2.83Å; L394-Y399 HydrophobicContact CD2-CE1 4.32Å; L394-Y399 HydrophobicContact CD2-CE2 4Å; L394-Y399 WeakPolarHBondContact O-CD1 3.31Å; L394-N429 HydrophobicContact CD2-CB 3.94Å; L394-N429 PolarHBondContact O-ND2 2.88Å
395	N	93.4	Very high	93.3	Very high	80 Å²	80	33.2 Å²	33.2	43%	0.428	17%	0.17	S	C	.	.	H	α-helix	trans	-105.5	-3.4	177.1	-74.4	-56.3	0	0	0	114.3	P391 T392 L393	P391-N395 WeakPolarHBondContact O-CB 3.44Å; P391-N395 PolarHBondContact O-N 3.26Å; P391-N395 PolarHBondContact O-ND2 3.01Å; T392-N395 PolarHBondContact O-N 2.81Å; L393-N395 PolarHBondContact O-N 3.28Å; L393-N395 VanDerWaalsContact O-N 3.16Å
396	C	94.4	Very high	93.4	Very high	1 Å²	1	33 Å²	33	1%	0.007	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-62.2	149	178.3	-179.9	0	0	0	0	111.6	M319 S320 F356 T392 L393 Y399 K400	M319-C396 PolarHBondContact O-SG 2.71Å; S320-C396 WeakPolarHBondContact CA-SG 3.28Å; S320-C396 PolarHBondContact O-SG 3.36Å; F356-C396 VanDerWaalsContact CE2-SG 3.56Å; F356-C396 HydrophobicContact CZ-CB 4.49Å; F356-C396 WeakPolarHBondContact CZ-SG 3.12Å; T392-C396 PolarHBondContact O-N 2.85Å; L393-C396 WeakPolarHBondContact O-CB 3.24Å; L393-C396 PolarHBondContact O-N 2.73Å; L393-C396 VanDerWaalsContact O-N 3.1Å; C396-Y399 PolarHBondContact O-N 2.76Å; C396-K400 WeakPolarHBondContact O-CG 3.38Å; C396-K400 PolarHBondContact O-N 2.94Å; C396-K400 VanDerWaalsContact O-N 3.09Å
397	L	95.6	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.2	-50.5	176.4	178.4	64.9	0	0	0	111.2	A318 S321 E323 A326 M330 Y399 K400 L401 L437	A318-L397 WeakPolarHBondContact O-CD2 3.36Å; S321-L397 WeakPolarHBondContact O-CB 3.13Å; S321-L397 PolarHBondContact O-N 3.27Å; E323-L397 HydrophobicContact CG-CD1 4.22Å; A326-L397 HydrophobicContact CB-CB 4.2Å; A326-L397 HydrophobicContact CB-CD2 3.56Å; A326-L397 HydrophobicContact CB-CG 4.37Å; M330-L397 HydrophobicContact CE-CD2 4.19Å; M330-L397 HydrophobicContact SD-CD2 4.42Å; L397-Y399 PolarHBondContact O-N 3.03Å; L397-K400 PolarHBondContact O-N 2.82Å; L397-K400 VanDerWaalsContact O-N 3.1Å; L397-L401 HydrophobicContact CD1-CD1 3.99Å; L397-L401 HydrophobicContact CD1-CD2 4.16Å; L397-L401 HydrophobicContact CD1-CG 3.8Å; L397-L401 HydrophobicContact CD2-CD1 4.17Å; L397-L401 HydrophobicContact CG-CD1 3.8Å; L397-L401 HydrophobicContact CG-CG 4.02Å; L397-L401 WeakPolarHBondContact O-CG 3.43Å; L397-L401 PolarHBondContact O-N 3.27Å; L397-L437 HydrophobicContact CD1-CD1 3.44Å; L397-L437 VanDerWaalsContact CD1-CD1 3.44Å
398	M	95.4	Very high	93.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-54.7	-48.7	179.7	-175.4	59.4	70.8	0	0	112.7	M319 V340 D352 I353 F356 M359 K400 L401 S402	M319-M398 HydrophobicContact CB-CE 3.92Å; M319-M398 HydrophobicContact CE-CE 4.38Å; M319-M398 HydrophobicContact CG-CE 3.88Å; M319-M398 WeakPolarHBondContact O-CB 3.34Å; M319-M398 PolarHBondContact O-N 3.4Å; M319-M398 HydrophobicContact SD-CE 3.57Å; M319-M398 VanDerWaalsContact SD-CE 3.57Å; V340-M398 HydrophobicContact CB-SD 4.35Å; V340-M398 HydrophobicContact CG1-CE 4.19Å; V340-M398 HydrophobicContact CG1-SD 3.9Å; D352-M398 HydrophobicContact CB-CE 4.09Å; D352-M398 HydrophobicContact CB-SD 3.89Å; I353-M398 HydrophobicContact CD1-CG 3.9Å; F356-M398 HydrophobicContact CD2-CB 3.73Å; F356-M398 HydrophobicContact CD2-CG 3.77Å; F356-M398 HydrophobicContact CE2-CB 3.67Å; F356-M398 HydrophobicContact CE2-CG 4.24Å; M359-M398 HydrophobicContact CE-CE 3.85Å; M359-M398 HydrophobicContact SD-CE 3.69Å; M398-K400 VanDerWaalsContact C-N 3.32Å; M398-K400 PolarHBondContact O-N 2.88Å; M398-L401 PolarHBondContact O-N 3.06Å; M398-S402 PolarHBondContact O-N 2.69Å; M398-S402 PolarHBondContact O-OG 3.07Å
399	Y	95.1	Very high	93.1	Very high	3 Å²	3	30.3 Å²	30.3	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-56.7	-47.2	176.4	179.9	-77.9	0	0	0	111.1	V385 L393 L394 C396 L397 L401 F403 G428 N429 F432	V385-Y399 HydrophobicContact CG1-CD2 4.11Å; V385-Y399 HydrophobicContact CG1-CE2 3.54Å; L393-Y399 WeakPolarHBondContact O-CB 3.49Å; L394-Y399 HydrophobicContact CD2-CE1 4.32Å; L394-Y399 HydrophobicContact CD2-CE2 4Å; L394-Y399 WeakPolarHBondContact O-CD1 3.31Å; C396-Y399 PolarHBondContact O-N 2.76Å; L397-Y399 PolarHBondContact O-N 3.03Å; Y399-L401 PolarHBondContact O-N 3.49Å; Y399-F403 HydrophobicContact CD1-CD2 4.19Å; Y399-F403 AromaticContact CD2-CD2 3.67Å; Y399-F403 HydrophobicContact CD2-CD2 3.67Å; Y399-F403 AromaticContact CD2-CE2 3.88Å; Y399-F403 HydrophobicContact CD2-CE2 3.88Å; Y399-F403 HydrophobicContact CE1-CB 4.31Å; Y399-F403 HydrophobicContact CE1-CD2 4.12Å; Y399-F403 AromaticContact CE2-CD2 3.66Å; Y399-F403 HydrophobicContact CE2-CD2 3.66Å; Y399-F403 AromaticContact CE2-CE2 3.92Å; Y399-F403 HydrophobicContact CE2-CE2 3.92Å; Y399-F403 AromaticContact CG-CD2 3.93Å; Y399-F403 HydrophobicContact CG-CD2 3.93Å; Y399-F403 AromaticContact CZ-CD2 3.85Å; Y399-F403 WeakPolarHBondContact O-CB 3.45Å; Y399-F403 WeakPolarHBondContact O-CD2 3.34Å; Y399-F403 PolarHBondContact O-N 2.91Å; Y399-G428 PolarHBondContact OH-N 2.93Å; Y399-N429 HydrophobicContact CE1-CB 3.91Å; Y399-N429 PolarHBondContact OH-N 3.43Å; Y399-F432 HydrophobicContact CE1-CE1 4.11Å
400	K	95.1	Very high	93	Very high	29 Å²	29	35.5 Å²	35.5	13%	0.126	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-39.9	179.8	-73.4	-178.3	173.7	-177.1	0	112.6	E323 C396 L397 M398 F404 F432 L434	E323-K400 IonicContact OE2-NZ 3.17Å; C396-K400 WeakPolarHBondContact O-CG 3.38Å; C396-K400 PolarHBondContact O-N 2.94Å; C396-K400 VanDerWaalsContact O-N 3.09Å; L397-K400 PolarHBondContact O-N 2.82Å; L397-K400 VanDerWaalsContact O-N 3.1Å; M398-K400 VanDerWaalsContact C-N 3.32Å; M398-K400 PolarHBondContact O-N 2.88Å; K400-F404 WeakPolarHBondContact O-CB 3.37Å; K400-F404 PolarHBondContact O-N 2.93Å; K400-F432 VanDerWaalsContact CA-CE2 3.46Å; K400-F432 HydrophobicContact CB-CD2 4.21Å; K400-F432 HydrophobicContact CB-CE2 3.68Å; K400-F432 HydrophobicContact CB-CZ 4.27Å; K400-F432 HydrophobicContact CG-CD2 3.96Å; K400-F432 HydrophobicContact CG-CE2 3.88Å; K400-F432 HydrophobicContact CG-CZ 4.44Å; K400-F432 WeakPolarHBondContact O-CE2 3.5Å; K400-F432 VanDerWaalsContact O-CZ 3.28Å; K400-F432 WeakPolarHBondContact O-CZ 3.27Å; K400-L434 HydrophobicContact CB-CD2 3.85Å
401	L	95.3	Very high	92.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-51.2	177.4	-69.1	-177.3	0	0	0	110.6	V338 V340 L397 M398 Y399 F403 L434 L437 Y451	V338-L401 HydrophobicContact CG1-CD1 3.77Å; V340-L401 HydrophobicContact CG1-CB 4.19Å; V340-L401 HydrophobicContact CG1-CD1 3.86Å; V340-L401 HydrophobicContact CG2-CB 4.09Å; L397-L401 HydrophobicContact CD1-CD1 3.99Å; L397-L401 HydrophobicContact CD1-CD2 4.16Å; L397-L401 HydrophobicContact CD1-CG 3.8Å; L397-L401 HydrophobicContact CD2-CD1 4.17Å; L397-L401 HydrophobicContact CG-CD1 3.8Å; L397-L401 HydrophobicContact CG-CG 4.02Å; L397-L401 WeakPolarHBondContact O-CG 3.43Å; L397-L401 PolarHBondContact O-N 3.27Å; M398-L401 PolarHBondContact O-N 3.06Å; Y399-L401 PolarHBondContact O-N 3.49Å; L401-F403 PolarHBondContact O-N 2.79Å; L401-L434 HydrophobicContact CD2-CD1 4.28Å; L401-L437 HydrophobicContact CD2-CD1 3.87Å; L401-Y451 HydrophobicContact CB-CD2 4.29Å; L401-Y451 HydrophobicContact CB-CE2 4Å; L401-Y451 HydrophobicContact CD2-CD1 3.83Å; L401-Y451 HydrophobicContact CD2-CD2 3.61Å; L401-Y451 HydrophobicContact CD2-CE1 4.17Å; L401-Y451 HydrophobicContact CD2-CE2 3.94Å; L401-Y451 HydrophobicContact CD2-CG 3.56Å; L401-Y451 HydrophobicContact CG-CD2 4.36Å; L401-Y451 VanDerWaalsContact O-CZ 3.28Å; L401-Y451 PolarHBondContact O-OH 2.64Å
402	S	94.4	Very high	91.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.6	-42.8	-177	-57.9	0	0	0	0	113	M398 R449	M398-S402 PolarHBondContact O-N 2.69Å; M398-S402 PolarHBondContact O-OG 3.07Å; S402-R449 PolarHBondContact O-NH1 2.8Å
403	F	94.6	Very high	91.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	9.3	-173.2	-65.7	-65.9	0	0	0	115.1	F342 I353 V385 Y399 L401 R405 F406 D420 I427 F432	F342-F403 AromaticContact CE2-CD1 3.85Å; F342-F403 HydrophobicContact CE2-CD1 3.85Å; F342-F403 AromaticContact CE2-CE1 3.44Å; F342-F403 HydrophobicContact CE2-CE1 3.44Å; F342-F403 VanDerWaalsContact CE2-CE1 3.44Å; F342-F403 HydrophobicContact CE2-CZ 4.04Å; F342-F403 HydrophobicContact CZ-CD1 4.02Å; F342-F403 AromaticContact CZ-CE1 3.87Å; F342-F403 HydrophobicContact CZ-CE1 3.87Å; I353-F403 HydrophobicContact CD1-CE2 4.15Å; I353-F403 HydrophobicContact CG1-CE2 4.35Å; V385-F403 HydrophobicContact CG1-CD2 4.26Å; V385-F403 HydrophobicContact CG1-CE1 4.41Å; V385-F403 HydrophobicContact CG1-CE2 3.37Å; V385-F403 HydrophobicContact CG1-CZ 3.47Å; V385-F403 VanDerWaalsContact CG1-CZ 3.47Å; Y399-F403 HydrophobicContact CD1-CD2 4.19Å; Y399-F403 AromaticContact CD2-CD2 3.67Å; Y399-F403 HydrophobicContact CD2-CD2 3.67Å; Y399-F403 AromaticContact CD2-CE2 3.88Å; Y399-F403 HydrophobicContact CD2-CE2 3.88Å; Y399-F403 HydrophobicContact CE1-CB 4.31Å; Y399-F403 HydrophobicContact CE1-CD2 4.12Å; Y399-F403 AromaticContact CE2-CD2 3.66Å; Y399-F403 HydrophobicContact CE2-CD2 3.66Å; Y399-F403 AromaticContact CE2-CE2 3.92Å; Y399-F403 HydrophobicContact CE2-CE2 3.92Å; Y399-F403 AromaticContact CG-CD2 3.93Å; Y399-F403 HydrophobicContact CG-CD2 3.93Å; Y399-F403 AromaticContact CZ-CD2 3.85Å; Y399-F403 WeakPolarHBondContact O-CB 3.45Å; Y399-F403 WeakPolarHBondContact O-CD2 3.34Å; Y399-F403 PolarHBondContact O-N 2.91Å; L401-F403 PolarHBondContact O-N 2.79Å; F403-R405 PolarHBondContact O-N 3.21Å; F403-R405 VanDerWaalsContact O-N 3.16Å; F403-F406 HydrophobicContact CB-CB 4.45Å; F403-F406 HydrophobicContact CD1-CB 4.29Å; F403-F406 AromaticContact CD1-CD1 3.67Å; F403-F406 HydrophobicContact CD1-CD1 3.67Å; F403-F406 HydrophobicContact CD1-CE1 4.34Å; F403-F406 HydrophobicContact CD1-CG 4.21Å; F403-F406 HydrophobicContact CE1-CD1 4.12Å; F403-F406 HydrophobicContact CE1-CE1 4.34Å; F403-F406 WeakPolarHBondContact O-CB 3.45Å; F403-F406 PolarHBondContact O-N 3.02Å; F403-D420 VanDerWaalsContact CE1-OD2 3.24Å; F403-D420 WeakPolarHBondContact CE1-OD2 3.3Å; F403-D420 WeakPolarHBondContact CZ-OD2 3.32Å; F403-I427 HydrophobicContact CD1-CG2 3.58Å; F403-I427 HydrophobicContact CE1-CG2 3.59Å; F403-I427 HydrophobicContact CG-CG2 4.23Å; F403-I427 HydrophobicContact CZ-CG2 4.29Å; F403-F432 HydrophobicContact CB-CE1 4.27Å; F403-F432 HydrophobicContact CB-CZ 4.18Å
404	F	94.5	Very high	90.8	Very high	30 Å²	30	44.6 Å²	44.6	13%	0.132	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	122.4	-179.6	-174	-114.9	0	0	0	111	K400 F406 F432 L434 E439 R449 Y451	K400-F404 WeakPolarHBondContact O-CB 3.37Å; K400-F404 PolarHBondContact O-N 2.93Å; F404-F406 PolarHBondContact O-N 3.23Å; F404-F432 HydrophobicContact CB-CE2 4.35Å; F404-F432 HydrophobicContact CD2-CD2 4.46Å; F404-F432 HydrophobicContact CD2-CE2 4.01Å; F404-L434 HydrophobicContact CB-CD1 4.36Å; F404-L434 HydrophobicContact CD1-CD1 4.3Å; F404-L434 HydrophobicContact CD2-CD1 3.78Å; F404-L434 HydrophobicContact CD2-CG 3.74Å; F404-L434 HydrophobicContact CE2-CB 4.49Å; F404-L434 HydrophobicContact CE2-CD1 4.1Å; F404-L434 HydrophobicContact CE2-CG 3.92Å; F404-L434 HydrophobicContact CG-CD1 3.88Å; F404-L434 HydrophobicContact CG-CG 4.35Å; F404-L434 HydrophobicContact CZ-CD1 4.48Å; F404-E439 HydrophobicContact CD1-CB 4.19Å; F404-E439 HydrophobicContact CE1-CB 4Å; F404-E439 WeakPolarHBondContact CE1-OE2 3.36Å; F404-R449 VanDerWaalsContact O-CZ 3.32Å; F404-R449 PolarHBondContact O-NH1 3.01Å; F404-R449 PolarHBondContact O-NH2 2.93Å; F404-Y451 HydrophobicContact CB-CE1 4.36Å; F404-Y451 HydrophobicContact CD1-CE1 4.22Å; F404-Y451 HydrophobicContact CG-CE1 4.47Å
405	R	92.2	Very high	90.5	Very high	127 Å²	127	45.3 Å²	45.3	48%	0.479	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	8	-176.1	-58.1	173.1	63.8	-161.6	-0.9	115.6	F403 G407 E408 E439	F403-R405 PolarHBondContact O-N 3.21Å; F403-R405 VanDerWaalsContact O-N 3.16Å; R405-G407 VanDerWaalsContact C-N 3.27Å; R405-G407 PolarHBondContact O-N 2.92Å; R405-E408 PolarHBondContact O-N 3.37Å; R405-E439 IonicContact NH1-OE2 3.59Å
406	F	92.8	Very high	90.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-71	-25.7	178.8	-172.3	-110.1	0	0	0	112.3	F342 L345 F403 F404 E408 V409 T411 G418 D420 I427 W446	F342-F406 AromaticContact CE1-CD2 3.56Å; F342-F406 HydrophobicContact CE1-CD2 3.56Å; F342-F406 AromaticContact CE1-CE2 3.63Å; F342-F406 HydrophobicContact CE1-CE2 3.63Å; F342-F406 HydrophobicContact CE1-CG 4.12Å; F342-F406 HydrophobicContact CE1-CZ 4.24Å; F342-F406 HydrophobicContact CZ-CD1 4.04Å; F342-F406 AromaticContact CZ-CD2 3.7Å; F342-F406 HydrophobicContact CZ-CD2 3.7Å; F342-F406 AromaticContact CZ-CE1 3.98Å; F342-F406 HydrophobicContact CZ-CE1 3.98Å; F342-F406 AromaticContact CZ-CE2 3.64Å; F342-F406 HydrophobicContact CZ-CE2 3.64Å; F342-F406 AromaticContact CZ-CG 3.9Å; F342-F406 HydrophobicContact CZ-CG 3.9Å; F342-F406 AromaticContact CZ-CZ 3.77Å; F342-F406 HydrophobicContact CZ-CZ 3.77Å; L345-F406 HydrophobicContact CB-CE2 4.36Å; F403-F406 HydrophobicContact CB-CB 4.45Å; F403-F406 HydrophobicContact CD1-CB 4.29Å; F403-F406 AromaticContact CD1-CD1 3.67Å; F403-F406 HydrophobicContact CD1-CD1 3.67Å; F403-F406 HydrophobicContact CD1-CE1 4.34Å; F403-F406 HydrophobicContact CD1-CG 4.21Å; F403-F406 HydrophobicContact CE1-CD1 4.12Å; F403-F406 HydrophobicContact CE1-CE1 4.34Å; F403-F406 WeakPolarHBondContact O-CB 3.45Å; F403-F406 PolarHBondContact O-N 3.02Å; F404-F406 PolarHBondContact O-N 3.23Å; F406-E408 PolarHBondContact O-N 3.38Å; F406-E408 VanDerWaalsContact O-N 3.14Å; F406-V409 PolarHBondContact O-N 2.67Å; F406-V409 VanDerWaalsContact O-N 3.09Å; F406-T411 HydrophobicContact CE2-CG2 3.94Å; F406-T411 HydrophobicContact CZ-CG2 3.66Å; F406-G418 WeakPolarHBondContact O-CA 3.25Å; F406-D420 HydrophobicContact CE1-CB 4.34Å; F406-I427 HydrophobicContact CD1-CD1 4.18Å; F406-I427 HydrophobicContact CD1-CG2 4.02Å; F406-I427 HydrophobicContact CE1-CG2 4.28Å; F406-W446 HydrophobicContact CB-CZ3 4.2Å; F406-W446 AromaticContact CD2-CE3 3.98Å; F406-W446 HydrophobicContact CD2-CE3 3.98Å; F406-W446 AromaticContact CD2-CZ3 3.93Å; F406-W446 HydrophobicContact CD2-CZ3 3.93Å
407	G	89.2	Confident	90	Very high	7 Å²	7	46.4 Å²	46.4	7%	0.072	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-62.6	-16.8	176.4	0	0	0	0	0	115.3	R405	R405-G407 VanDerWaalsContact C-N 3.27Å; R405-G407 PolarHBondContact O-N 2.92Å
408	E	88.2	Confident	89.8	Confident	129 Å²	129	46.4 Å²	46.4	60%	0.603	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-90.9	-16.6	177.9	-61	173.5	-179	0	0	112.3	R405 F406	R405-E408 PolarHBondContact O-N 3.37Å; F406-E408 PolarHBondContact O-N 3.38Å; F406-E408 VanDerWaalsContact O-N 3.14Å
409	V	89.3	Confident	89.6	Confident	39 Å²	39	48.6 Å²	48.6	24%	0.236	25%	0.246	C	C	.	.			trans	-90.9	128.6	-174.5	-178.9	0	0	0	0	110.4	L345 F406 G418 W446	L345-V409 HydrophobicContact CD1-CG1 4.17Å; F406-V409 PolarHBondContact O-N 2.67Å; F406-V409 VanDerWaalsContact O-N 3.09Å; V409-G418 PolarHBondContact O-N 3.4Å; V409-W446 HydrophobicContact CG2-CH2 3.39Å; V409-W446 HydrophobicContact CG2-CZ2 3.86Å; V409-W446 HydrophobicContact CG2-CZ3 3.91Å
410	Q	87.1	Confident	89.5	Confident	118 Å²	118	48.5 Å²	48.5	55%	0.551	25%	0.246	S	C	*	.	B	Isolated β-bridge	trans	-93.5	112	171.7	-169.2	176	16.7	0	0	109.6	G412 S415	Q410-G412 VanDerWaalsContact CG-O 3.31Å; Q410-G412 WeakPolarHBondContact CG-O 3.32Å; Q410-G412 PolarHBondContact NE2-O 3.07Å; Q410-S415 WeakPolarHBondContact CG-O 3.41Å; Q410-S415 PolarHBondContact NE2-O 2.85Å
411	T	84	Confident	89.3	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.055	26%	0.263	C	S	.	.			trans	-82.1	-20.4	-174.6	59.6	0	0	0	0	113.6	L345 F406 F419 R421	L345-T411 HydrophobicContact CD1-CG2 3.59Å; F406-T411 HydrophobicContact CE2-CG2 3.94Å; F406-T411 HydrophobicContact CZ-CG2 3.66Å; T411-F419 WeakPolarHBondContact CG2-O 3.25Å; T411-F419 PolarHBondContact OG1-O 2.63Å; T411-R421 PolarHBondContact O-NE 3.41Å; T411-R421 PolarHBondContact O-NH2 3.37Å
412	G	79.7	Confident	89	Confident	20 Å²	20	54.9 Å²	54.9	21%	0.206	27%	0.274	C	S	.	.	S	Bend	trans	-146.2	154.1	-179.6	0	0	0	0	0	111.8	Q410 H414 S415	Q410-G412 VanDerWaalsContact CG-O 3.31Å; Q410-G412 WeakPolarHBondContact CG-O 3.32Å; Q410-G412 PolarHBondContact NE2-O 3.07Å; G412-H414 PolarHBondContact O-N 3.48Å; G412-H414 VanDerWaalsContact O-N 3.11Å; G412-S415 PolarHBondContact O-N 3.33Å; G412-S415 VanDerWaalsContact O-N 3.1Å
413	L	79	Confident	88.9	Confident	150 Å²	150	57.2 Å²	57.2	79%	0.785	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.2	-176	-170.9	66.5	0	0	0	113.1
414	H	84.7	Confident	88.7	Confident	179 Å²	179	59.4 Å²	59.4	83%	0.829	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	3.3	179.4	-59.1	-52.9	0	0	0	113.8	G412	G412-H414 PolarHBondContact O-N 3.48Å; G412-H414 VanDerWaalsContact O-N 3.11Å
415	S	86.1	Confident	88.5	Confident	30 Å²	30	60 Å²	60	21%	0.21	31%	0.31	C	S	.	.	S	Bend	trans	-86.4	145.6	179.4	-59.5	0	0	0	0	110.2	Q410 G412	Q410-S415 WeakPolarHBondContact CG-O 3.41Å; Q410-S415 PolarHBondContact NE2-O 2.85Å; G412-S415 PolarHBondContact O-N 3.33Å; G412-S415 VanDerWaalsContact O-N 3.1Å
416	P	89.1	Confident	88.6	Confident	45 Å²	45	57.8 Å²	57.8	29%	0.292	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-62.6	157.5	172.3	26.6	-32.6	0	0	0	110.9	G418 F419 E426	P416-G418 PolarHBondContact O-N 2.99Å; P416-F419 HydrophobicContact CG-CB 4.18Å; P416-F419 HydrophobicContact CG-CD2 4.03Å; P416-F419 VanDerWaalsContact O-CB 3.27Å; P416-F419 WeakPolarHBondContact O-CB 3.46Å; P416-F419 PolarHBondContact O-N 2.92Å; P416-E426 HydrophobicContact CG-CB 4.22Å; P416-E426 HydrophobicContact CG-CG 4.22Å
417	P	89.3	Confident	88.5	Confident	58 Å²	58	57.9 Å²	57.9	38%	0.377	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-63.7	134	172.1	27.6	-33.4	0	0	0	109.8	K430	P417-K430 PolarHBondContact O-NZ 3.23Å
418	G	89.8	Confident	88.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	27.5	-172.5	0	0	0	0	0	114.5	F406 V409 P416 I427	F406-G418 WeakPolarHBondContact O-CA 3.25Å; V409-G418 PolarHBondContact O-N 3.4Å; P416-G418 PolarHBondContact O-N 2.99Å; G418-I427 WeakPolarHBondContact O-CG1 2.9Å; G418-I427 WeakPolarHBondContact O-CG2 3.29Å; G418-I427 PolarHBondContact O-N 3.35Å
419	F	92.6	Very high	88.7	Confident	48 Å²	48	55.2 Å²	55.2	21%	0.211	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121.7	175.8	-173.6	-95.9	0	0	0	112	T411 P416	T411-F419 WeakPolarHBondContact CG2-O 3.25Å; T411-F419 PolarHBondContact OG1-O 2.63Å; P416-F419 HydrophobicContact CG-CB 4.18Å; P416-F419 HydrophobicContact CG-CD2 4.03Å; P416-F419 VanDerWaalsContact O-CB 3.27Å; P416-F419 WeakPolarHBondContact O-CB 3.46Å; P416-F419 PolarHBondContact O-N 2.92Å
420	D	92.3	Very high	88.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.3	-179.9	-168.7	-41.1	0	0	0	111.6	G344 F403 F406 T422 R423 G424 V425	G344-D420 VanDerWaalsContact CA-OD1 3.31Å; G344-D420 WeakPolarHBondContact CA-OD1 3.34Å; F403-D420 VanDerWaalsContact CE1-OD2 3.24Å; F403-D420 WeakPolarHBondContact CE1-OD2 3.3Å; F403-D420 WeakPolarHBondContact CZ-OD2 3.32Å; F406-D420 HydrophobicContact CE1-CB 4.34Å; D420-T422 PolarHBondContact O-N 2.85Å; D420-T422 PolarHBondContact OD1-N 2.9Å; D420-R423 IonicContact OD1-CZ 3.56Å; D420-R423 PolarHBondContact OD1-N 3.06Å; D420-R423 IonicContact OD1-NE 2.65Å; D420-R423 PolarHBondContact OD1-NE 2.95Å; D420-R423 IonicContact OD1-NH2 3.22Å; D420-R423 PolarHBondContact OD1-NH2 2.83Å; D420-R423 IonicContact OD2-CZ 3.79Å; D420-R423 IonicContact OD2-NE 2.92Å; D420-R423 PolarHBondContact OD2-NE 2.77Å; D420-R423 IonicContact OD2-NH1 2.88Å; D420-R423 IonicContact OD2-NH2 2.8Å; D420-R423 PolarHBondContact OD2-NH2 3.42Å; D420-G424 WeakPolarHBondContact O-CA 3.31Å; D420-G424 PolarHBondContact O-N 3.09Å; D420-V425 PolarHBondContact N-O 3.14Å
421	R	90.2	Very high	88.5	Confident	126 Å²	126	56.8 Å²	56.8	48%	0.475	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-31.3	-176.9	-67.9	-162.2	-177.2	168.1	-3.9	114	G344 L345 T411	G344-R421 WeakPolarHBondContact O-CB 3.39Å; G344-R421 PolarHBondContact O-N 2.63Å; L345-R421 WeakPolarHBondContact O-CD 3.12Å; L345-R421 PolarHBondContact O-NE 2.86Å; T411-R421 PolarHBondContact O-NE 3.41Å; T411-R421 PolarHBondContact O-NH2 3.37Å
422	T	89.9	Confident	88.8	Confident	38 Å²	38	57.9 Å²	57.9	23%	0.233	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-38.5	-177.4	-52	0	0	0	0	111.1	G343 G347 Y348 D420	G343-T422 PolarHBondContact O-OG1 3.28Å; G347-T422 WeakPolarHBondContact CA-OG1 3.49Å; Y348-T422 PolarHBondContact O-OG1 3.43Å; D420-T422 PolarHBondContact O-N 2.85Å; D420-T422 PolarHBondContact OD1-N 2.9Å
423	R	91.9	Very high	89.4	Confident	49 Å²	49	64.3 Å²	64.3	19%	0.185	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-14.8	-178.4	-73.4	126.7	-71.9	-142.8	5.5	113.6	G344 D351 I353 D420 V425	G344-R423 VanDerWaalsContact CA-NH2 3.31Å; D351-R423 IonicContact OD1-NH1 2.7Å; D351-R423 PolarHBondContact OD1-NH1 2.75Å; D351-R423 IonicContact OD2-CZ 3.79Å; D351-R423 IonicContact OD2-NH1 2.58Å; D351-R423 PolarHBondContact OD2-NH1 2.6Å; D351-R423 IonicContact OD2-NH2 2.83Å; D351-R423 PolarHBondContact OD2-NH2 3.29Å; I353-R423 VanDerWaalsContact CG2-NH1 3.29Å; D420-R423 IonicContact OD1-CZ 3.56Å; D420-R423 PolarHBondContact OD1-N 3.06Å; D420-R423 IonicContact OD1-NE 2.65Å; D420-R423 PolarHBondContact OD1-NE 2.95Å; D420-R423 IonicContact OD1-NH2 3.22Å; D420-R423 PolarHBondContact OD1-NH2 2.83Å; D420-R423 IonicContact OD2-CZ 3.79Å; D420-R423 IonicContact OD2-NE 2.92Å; D420-R423 PolarHBondContact OD2-NE 2.77Å; D420-R423 IonicContact OD2-NH1 2.88Å; D420-R423 IonicContact OD2-NH2 2.8Å; D420-R423 PolarHBondContact OD2-NH2 3.42Å; R423-V425 VanDerWaalsContact C-N 3.3Å; R423-V425 HydrophobicContact CB-CG2 3.88Å; R423-V425 PolarHBondContact O-N 3.21Å
424	G	90.4	Very high	90	Very high	45 Å²	45	57.9 Å²	57.9	46%	0.464	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	25.2	178.7	0	0	0	0	0	114	D420	D420-G424 WeakPolarHBondContact O-CA 3.31Å; D420-G424 PolarHBondContact O-N 3.09Å
425	V	91.4	Very high	90.3	Very high	42 Å²	42	54.6 Å²	54.6	26%	0.255	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	154.5	-174.6	-62.1	0	0	0	0	112	V385 D386 D420 R423	V385-V425 HydrophobicContact CB-CG2 4.42Å; D386-V425 HydrophobicContact CB-CB 4.46Å; D420-V425 PolarHBondContact N-O 3.14Å; R423-V425 VanDerWaalsContact C-N 3.3Å; R423-V425 HydrophobicContact CB-CG2 3.88Å; R423-V425 PolarHBondContact O-N 3.21Å
426	E	93	Very high	90.6	Very high	81 Å²	81	57 Å²	57	38%	0.379	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	131.7	170.1	-176.6	179.6	167.1	0	0	109.8	D386 P416 K430	D386-E426 VanDerWaalsContact CA-O 3.28Å; D386-E426 WeakPolarHBondContact CA-O 3.33Å; D386-E426 VanDerWaalsContact CB-O 3.3Å; D386-E426 WeakPolarHBondContact CB-O 3.42Å; P416-E426 HydrophobicContact CG-CB 4.22Å; P416-E426 HydrophobicContact CG-CG 4.22Å; E426-K430 WeakPolarHBondContact OE1-CE 3.46Å; E426-K430 IonicContact OE1-NZ 2.8Å; E426-K430 PolarHBondContact OE1-NZ 2.69Å
427	I	92.5	Very high	90.9	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.015	28%	0.282	C	S	.	.			trans	-61.4	142	-179.2	65.8	176.8	0	0	0	111.8	F403 F406 G418 K430	F403-I427 HydrophobicContact CD1-CG2 3.58Å; F403-I427 HydrophobicContact CE1-CG2 3.59Å; F403-I427 HydrophobicContact CG-CG2 4.23Å; F403-I427 HydrophobicContact CZ-CG2 4.29Å; F406-I427 HydrophobicContact CD1-CD1 4.18Å; F406-I427 HydrophobicContact CD1-CG2 4.02Å; F406-I427 HydrophobicContact CE1-CG2 4.28Å; G418-I427 WeakPolarHBondContact O-CG1 2.9Å; G418-I427 WeakPolarHBondContact O-CG2 3.29Å; G418-I427 PolarHBondContact O-N 3.35Å; I427-K430 HydrophobicContact CD1-CG 4.29Å; I427-K430 HydrophobicContact CG1-CG 4.01Å
428	G	89.4	Confident	91.2	Very high	21 Å²	21	55.9 Å²	55.9	22%	0.216	28%	0.282	C	S	.	.	S	Bend	trans	-70.1	-53.7	179.6	0	0	0	0	0	113	V385 H387 Y399	V385-G428 PolarHBondContact O-N 3.45Å; H387-G428 VanDerWaalsContact N-CA 3.29Å; Y399-G428 PolarHBondContact OH-N 2.93Å
429	N	90.8	Very high	91.5	Very high	58 Å²	58	58.6 Å²	58.6	31%	0.31	29%	0.294	S	S	.	.			trans	-96.5	101	179	-80.8	-11.2	0	0	0	111.1	L394 Y399 F432	L394-N429 HydrophobicContact CD2-CB 3.94Å; L394-N429 PolarHBondContact O-ND2 2.88Å; Y399-N429 HydrophobicContact CE1-CB 3.91Å; Y399-N429 PolarHBondContact OH-N 3.43Å; N429-F432 HydrophobicContact CB-CD1 4.16Å
430	K	86.2	Confident	91.6	Very high	58 Å²	58	58.1 Å²	58.1	25%	0.252	30%	0.3	S	S	.	.			trans	-78.3	-42.2	178.6	-64.1	-168.7	-178.8	-158.8	0	114.2	P417 E426 I427	P417-K430 PolarHBondContact O-NZ 3.23Å; E426-K430 WeakPolarHBondContact OE1-CE 3.46Å; E426-K430 IonicContact OE1-NZ 2.8Å; E426-K430 PolarHBondContact OE1-NZ 2.69Å; I427-K430 HydrophobicContact CD1-CG 4.29Å; I427-K430 HydrophobicContact CG1-CG 4.01Å
431	N	86.9	Confident	91.8	Very high	133 Å²	133	59.7 Å²	59.7	71%	0.711	31%	0.306	S	S	*	.	S	Bend	trans	-120.7	106.8	-171.4	-64.3	-20	0	0	0	109.8
432	F	90.5	Very high	92.1	Very high	31 Å²	31	55.1 Å²	55.1	14%	0.136	29%	0.293	C	S	.	.			trans	-144.9	159.1	172.1	60	-93.5	0	0	0	110	Y399 K400 F403 F404 N429	Y399-F432 HydrophobicContact CE1-CE1 4.11Å; K400-F432 VanDerWaalsContact CA-CE2 3.46Å; K400-F432 HydrophobicContact CB-CD2 4.21Å; K400-F432 HydrophobicContact CB-CE2 3.68Å; K400-F432 HydrophobicContact CB-CZ 4.27Å; K400-F432 HydrophobicContact CG-CD2 3.96Å; K400-F432 HydrophobicContact CG-CE2 3.88Å; K400-F432 HydrophobicContact CG-CZ 4.44Å; K400-F432 WeakPolarHBondContact O-CE2 3.5Å; K400-F432 VanDerWaalsContact O-CZ 3.28Å; K400-F432 WeakPolarHBondContact O-CZ 3.27Å; F403-F432 HydrophobicContact CB-CE1 4.27Å; F403-F432 HydrophobicContact CB-CZ 4.18Å; F404-F432 HydrophobicContact CB-CE2 4.35Å; F404-F432 HydrophobicContact CD2-CD2 4.46Å; F404-F432 HydrophobicContact CD2-CE2 4.01Å; N429-F432 HydrophobicContact CB-CD1 4.16Å
433	H	90.7	Very high	92.4	Very high	156 Å²	156	53.4 Å²	53.4	72%	0.722	28%	0.282	S	S	*	.			trans	-115.7	145.3	178.7	-62	-62.6	0	0	0	110.6
434	L	92.5	Very high	92.4	Very high	14 Å²	14	58.5 Å²	58.5	7%	0.073	31%	0.308	C	S	.	.			trans	-89.1	119.4	170.7	-62	174.1	0	0	0	108.9	K400 L401 F404 L437 Y451 K454	K400-L434 HydrophobicContact CB-CD2 3.85Å; L401-L434 HydrophobicContact CD2-CD1 4.28Å; F404-L434 HydrophobicContact CB-CD1 4.36Å; F404-L434 HydrophobicContact CD1-CD1 4.3Å; F404-L434 HydrophobicContact CD2-CD1 3.78Å; F404-L434 HydrophobicContact CD2-CG 3.74Å; F404-L434 HydrophobicContact CE2-CB 4.49Å; F404-L434 HydrophobicContact CE2-CD1 4.1Å; F404-L434 HydrophobicContact CE2-CG 3.92Å; F404-L434 HydrophobicContact CG-CD1 3.88Å; F404-L434 HydrophobicContact CG-CG 4.35Å; F404-L434 HydrophobicContact CZ-CD1 4.48Å; L434-L437 HydrophobicContact CB-CB 4.36Å; L434-L437 WeakPolarHBondContact CB-O 3.44Å; L434-L437 HydrophobicContact CD1-CB 4.32Å; L434-Y451 HydrophobicContact CD1-CD1 3.78Å; L434-Y451 HydrophobicContact CD1-CE1 3.63Å; L434-K454 PolarHBondContact O-NZ 3.06Å
435	N	91.2	Very high	92.4	Very high	110 Å²	110	58.3 Å²	58.3	59%	0.588	30%	0.296	S	S	*	.	S	Bend	trans	-81.7	-47.2	-179.2	-64.9	-56.3	0	0	0	111.2	E323 K454	E323-N435 WeakPolarHBondContact OE1-CA 3.44Å; E323-N435 PolarHBondContact OE1-N 3.32Å; N435-K454 WeakPolarHBondContact O-CD 3.43Å; N435-K454 PolarHBondContact O-NZ 3.33Å
436	Y	92.8	Very high	92.5	Very high	81 Å²	81	59 Å²	59	32%	0.318	29%	0.294	S	S	.	.	S	Bend	trans	-100.6	-10.9	-170.3	-62	-78.8	0	0	0	114.1	E323 Y327 K454	E323-Y436 HydrophobicContact CB-CD2 4.29Å; E323-Y436 HydrophobicContact CG-CD2 3.78Å; E323-Y436 PolarHBondContact OE1-N 2.95Å; Y327-Y436 AromaticContact CD1-CD1 3.5Å; Y327-Y436 HydrophobicContact CD1-CD1 3.5Å; Y327-Y436 AromaticContact CD1-CE1 3.83Å; Y327-Y436 HydrophobicContact CD1-CE1 3.83Å; Y327-Y436 HydrophobicContact CD1-CG 4.19Å; Y327-Y436 AromaticContact CD2-CD1 3.88Å; Y327-Y436 HydrophobicContact CD2-CD1 3.88Å; Y327-Y436 AromaticContact CD2-CG 3.96Å; Y327-Y436 HydrophobicContact CD2-CG 3.96Å; Y327-Y436 AromaticContact CE1-CD1 3.75Å; Y327-Y436 HydrophobicContact CE1-CD1 3.75Å; Y327-Y436 HydrophobicContact CE1-CE1 4.14Å; Y327-Y436 HydrophobicContact CE2-CD1 4.08Å; Y327-Y436 HydrophobicContact CE2-CG 4.45Å; Y327-Y436 AromaticContact CG-CD1 3.56Å; Y327-Y436 HydrophobicContact CG-CD1 3.56Å; Y327-Y436 HydrophobicContact CG-CE1 4.25Å; Y327-Y436 AromaticContact CG-CG 3.77Å; Y327-Y436 HydrophobicContact CG-CG 3.77Å; Y436-K454 WeakPolarHBondContact O-CB 3.06Å; Y436-K454 PolarHBondContact O-N 3.32Å
437	L	94.6	Very high	92.5	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.9	-179.6	-71	141.3	0	0	0	110.4	M330 V338 L397 L401 L434 K452 V453 K454	M330-L437 HydrophobicContact CE-CD1 4.08Å; M330-L437 HydrophobicContact CE-CD2 4.39Å; M330-L437 HydrophobicContact CE-CG 4.44Å; M330-L437 HydrophobicContact SD-CD2 4.44Å; V338-L437 HydrophobicContact CG2-CD2 4.09Å; L397-L437 HydrophobicContact CD1-CD1 3.44Å; L397-L437 VanDerWaalsContact CD1-CD1 3.44Å; L401-L437 HydrophobicContact CD2-CD1 3.87Å; L434-L437 HydrophobicContact CB-CB 4.36Å; L434-L437 WeakPolarHBondContact CB-O 3.44Å; L434-L437 HydrophobicContact CD1-CB 4.32Å; L437-K452 WeakPolarHBondContact CA-O 3.2Å; L437-V453 HydrophobicContact CD2-CB 4.48Å; L437-V453 HydrophobicContact CD2-CG2 3.87Å; L437-K454 VanDerWaalsContact O-CE 3.23Å; L437-K454 WeakPolarHBondContact O-CE 3.47Å; L437-K454 PolarHBondContact O-NZ 3.27Å
438	E	95.1	Very high	92.7	Very high	79 Å²	79	55.2 Å²	55.2	37%	0.369	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139.9	170.7	62	-171.3	-176.7	0	0	110	A440 Y451 K452 K454	E438-A440 PolarHBondContact O-N 2.86Å; E438-Y451 CarbonylContact O-C 3.51Å; E438-Y451 VanDerWaalsContact O-CA 3.29Å; E438-Y451 WeakPolarHBondContact O-CA 3.47Å; E438-K452 HydrophobicContact CG-CB 3.8Å; E438-K452 HydrophobicContact CG-CG 4.39Å; E438-K452 PolarHBondContact N-O 2.9Å; E438-K452 PolarHBondContact O-N 3.25Å; E438-K452 VanDerWaalsContact OE1-CD 3.32Å; E438-K452 WeakPolarHBondContact OE1-CD 3.23Å; E438-K452 IonicContact OE1-NZ 3.21Å; E438-K452 PolarHBondContact OE1-NZ 3.34Å; E438-K454 HydrophobicContact CB-CG 4.44Å; E438-K454 HydrophobicContact CG-CG 4.37Å
439	E	95.8	Very high	93	Very high	56 Å²	56	54.2 Å²	54.2	26%	0.262	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	117.1	173.7	-178.6	174.9	-148.3	0	0	108.6	F404 R405 T442 R449 Y451	F404-E439 HydrophobicContact CD1-CB 4.19Å; F404-E439 HydrophobicContact CE1-CB 4Å; F404-E439 WeakPolarHBondContact CE1-OE2 3.36Å; R405-E439 IonicContact NH1-OE2 3.59Å; E439-T442 PolarHBondContact OE1-OG1 3.04Å; E439-R449 IonicContact OE1-CZ 3.77Å; E439-R449 IonicContact OE1-NE 3.91Å; E439-R449 IonicContact OE1-NH2 3.19Å; E439-R449 PolarHBondContact OE1-NH2 3.3Å; E439-Y451 HydrophobicContact CB-CD1 4.24Å; E439-Y451 HydrophobicContact CB-CE1 3.95Å; E439-Y451 HydrophobicContact CG-CE1 4.29Å
440	A	95.7	Very high	93.4	Very high	39 Å²	39	51.4 Å²	51.4	32%	0.322	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-42.2	-177.1	0	0	0	0	0	111.6	W271 Y337 E438 I450 K452	W271-A440 HydrophobicContact CH2-CB 3.8Å; W271-A440 HydrophobicContact CZ2-CB 4.48Å; Y337-A440 HydrophobicContact CE1-CB 4.22Å; E438-A440 PolarHBondContact O-N 2.86Å; A440-I450 WeakPolarHBondContact CB-O 3.32Å; A440-I450 PolarHBondContact N-O 3.31Å; A440-K452 HydrophobicContact CB-CB 4.08Å
441	F	96.9	Very high	93.9	Very high	33 Å²	33	48.7 Å²	48.7	15%	0.145	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	143	177.1	-179.3	-99.7	0	0	0	110.8	E267 A268 W271 I450	E267-F441 HydrophobicContact CG-CZ 3.99Å; A268-F441 HydrophobicContact CB-CD1 4.25Å; A268-F441 HydrophobicContact CB-CE1 3.87Å; W271-F441 HydrophobicContact CB-CD1 4.38Å; W271-F441 HydrophobicContact CB-CD2 4.31Å; W271-F441 HydrophobicContact CB-CE1 4.35Å; W271-F441 HydrophobicContact CB-CE2 4.27Å; W271-F441 HydrophobicContact CB-CG 4.36Å; W271-F441 HydrophobicContact CB-CZ 4.29Å; W271-F441 AromaticContact CD1-CD2 3.33Å; W271-F441 AromaticContact CD1-CE2 3.65Å; W271-F441 AromaticContact CD1-CG 3.94Å; W271-F441 HydrophobicContact CD2-CB 3.61Å; W271-F441 HydrophobicContact CD2-CD1 4.33Å; W271-F441 AromaticContact CD2-CD2 3.88Å; W271-F441 HydrophobicContact CD2-CD2 3.88Å; W271-F441 AromaticContact CD2-CG 3.67Å; W271-F441 HydrophobicContact CD2-CG 3.67Å; W271-F441 AromaticContact CE2-CD2 3.88Å; W271-F441 AromaticContact CE2-CG 3.94Å; W271-F441 HydrophobicContact CE3-CB 3.73Å; W271-F441 HydrophobicContact CE3-CG 4.09Å; W271-F441 HydrophobicContact CG-CB 4.24Å; W271-F441 HydrophobicContact CG-CD1 4.25Å; W271-F441 AromaticContact CG-CD2 3.61Å; W271-F441 HydrophobicContact CG-CD2 3.61Å; W271-F441 AromaticContact CG-CE2 3.97Å; W271-F441 HydrophobicContact CG-CE2 3.97Å; W271-F441 AromaticContact CG-CG 3.76Å; W271-F441 HydrophobicContact CG-CG 3.76Å; W271-F441 HydrophobicContact CG-CZ 4.43Å; W271-F441 HydrophobicContact CH2-CB 3.93Å; W271-F441 HydrophobicContact CZ2-CB 3.79Å; W271-F441 HydrophobicContact CZ3-CB 3.89Å; W271-F441 AromaticContact NE1-CD2 3.52Å; F441-I450 HydrophobicContact CB-CB 4.22Å; F441-I450 HydrophobicContact CB-CD1 4.31Å; F441-I450 HydrophobicContact CD1-CD1 3.98Å; F441-I450 HydrophobicContact CD1-CG1 4.48Å; F441-I450 PolarHBondContact N-O 2.8Å; F441-I450 VanDerWaalsContact N-O 3.07Å; F441-I450 PolarHBondContact O-N 2.93Å
442	T	96.3	Very high	94.4	Very high	30 Å²	30	45.9 Å²	45.9	18%	0.184	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	128.2	171.2	-71.7	0	0	0	0	106.6	E439 W446 R449	E439-T442 PolarHBondContact OE1-OG1 3.04Å; T442-W446 HydrophobicContact CG2-CB 4.05Å; T442-W446 HydrophobicContact CG2-CD2 4.01Å; T442-W446 HydrophobicContact CG2-CG 3.61Å; T442-R449 HydrophobicContact CG2-CG 4.2Å; T442-R449 PolarHBondContact OG1-NE 3.4Å
443	S	95.1	Very high	94.7	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	22%	0.217	C	C	.	.			trans	-65.7	167	-177.4	78	0	0	0	0	112.5	D264 N445 W446 L447 V448	D264-S443 WeakPolarHBondContact CB-OG 3.37Å; D264-S443 VanDerWaalsContact CG-OG 3.31Å; D264-S443 WeakPolarHBondContact OD1-CB 3.24Å; D264-S443 PolarHBondContact OD1-OG 3.48Å; S443-N445 VanDerWaalsContact C-N 3.32Å; S443-N445 PolarHBondContact O-N 3.16Å; S443-W446 PolarHBondContact O-N 3.14Å; S443-L447 PolarHBondContact OG-N 3.19Å; S443-V448 PolarHBondContact N-O 3.4Å; S443-V448 PolarHBondContact OG-N 3.37Å
444	E	92.3	Very high	94.8	Very high	155 Å²	155	40.6 Å²	40.6	72%	0.724	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-48.3	-176.8	-174.3	177.7	-176.5	0	0	112.9	D264 E267 W446	D264-E444 PolarHBondContact OD1-N 2.85Å; E267-E444 PolarHBondContact OE2-N 3.04Å; E444-W446 VanDerWaalsContact C-N 3.33Å
445	N	90.6	Very high	94.7	Very high	42 Å²	42	45.8 Å²	45.8	23%	0.225	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	14.6	-179.2	-54.6	-73.5	0	0	0	113.4	L262 D264 S443 L447	L262-N445 WeakPolarHBondContact CD2-ND2 3.17Å; D264-N445 PolarHBondContact OD1-N 3.02Å; D264-N445 PolarHBondContact OD1-ND2 2.86Å; D264-N445 WeakPolarHBondContact OD2-CB 3.47Å; D264-N445 PolarHBondContact OD2-ND2 2.81Å; S443-N445 VanDerWaalsContact C-N 3.32Å; S443-N445 PolarHBondContact O-N 3.16Å; N445-L447 PolarHBondContact O-N 2.84Å; N445-L447 VanDerWaalsContact O-N 3.14Å
446	W	93	Very high	94.3	Very high	55 Å²	55	46.2 Å²	46.2	21%	0.208	23%	0.226	C	C	.	.	S	Bend	trans	57.7	23	-177.5	-66.4	27.6	0	0	0	113.6	F342 L345 F406 V409 T442 S443 E444	F342-W446 HydrophobicContact CD1-CB 4.38Å; F342-W446 WeakPolarHBondContact CD1-O 3.37Å; L345-W446 HydrophobicContact CD2-CB 4.22Å; L345-W446 HydrophobicContact CD2-CG 4.19Å; F406-W446 HydrophobicContact CB-CZ3 4.2Å; F406-W446 AromaticContact CD2-CE3 3.98Å; F406-W446 HydrophobicContact CD2-CE3 3.98Å; F406-W446 AromaticContact CD2-CZ3 3.93Å; F406-W446 HydrophobicContact CD2-CZ3 3.93Å; V409-W446 HydrophobicContact CG2-CH2 3.39Å; V409-W446 HydrophobicContact CG2-CZ2 3.86Å; V409-W446 HydrophobicContact CG2-CZ3 3.91Å; T442-W446 HydrophobicContact CG2-CB 4.05Å; T442-W446 HydrophobicContact CG2-CD2 4.01Å; T442-W446 HydrophobicContact CG2-CG 3.61Å; S443-W446 PolarHBondContact O-N 3.14Å; E444-W446 VanDerWaalsContact C-N 3.33Å
447	L	93.9	Very high	93.8	Very high	5 Å²	5	46 Å²	46	3%	0.026	24%	0.242	C	C	.	.			trans	-71.9	-41.2	-178.6	-170.7	68.8	0	0	0	111.7	L250 D264 F265 I341 F342 Y348 S443 N445	L250-L447 HydrophobicContact CD1-CD2 3.77Å; D264-L447 HydrophobicContact CB-CB 3.64Å; D264-L447 HydrophobicContact CB-CD2 3.91Å; D264-L447 HydrophobicContact CB-CG 4.36Å; F265-L447 HydrophobicContact CD2-CD2 3.9Å; F265-L447 HydrophobicContact CE2-CD2 3.48Å; F265-L447 VanDerWaalsContact CE2-CD2 3.48Å; F265-L447 HydrophobicContact CE2-CG 4.5Å; F265-L447 HydrophobicContact CZ-CD2 3.93Å; I341-L447 CarbonylContact C-O 3.49Å; I341-L447 VanDerWaalsContact CA-O 3.27Å; I341-L447 WeakPolarHBondContact CA-O 3.39Å; I341-L447 HydrophobicContact CG2-CD1 4.48Å; F342-L447 PolarHBondContact N-O 3.45Å; F342-L447 VanDerWaalsContact O-CA 3.31Å; F342-L447 WeakPolarHBondContact O-CA 3.43Å; Y348-L447 HydrophobicContact CD1-CD1 3.83Å; Y348-L447 HydrophobicContact CG-CD1 3.92Å; S443-L447 PolarHBondContact OG-N 3.19Å; N445-L447 PolarHBondContact O-N 2.84Å; N445-L447 VanDerWaalsContact O-N 3.14Å
448	V	96.2	Very high	93.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127	178.9	-173.8	0	0	0	0	109	F265 A268 L339 I341 S443 I450	F265-V448 HydrophobicContact CD1-CG2 3.94Å; F265-V448 HydrophobicContact CE1-CG2 4.25Å; F265-V448 HydrophobicContact CG-CG2 4.45Å; A268-V448 HydrophobicContact CB-CB 3.6Å; A268-V448 HydrophobicContact CB-CG1 3.48Å; A268-V448 VanDerWaalsContact CB-CG1 3.48Å; A268-V448 HydrophobicContact CB-CG2 4.16Å; L339-V448 HydrophobicContact CD1-CG1 3.94Å; L339-V448 HydrophobicContact CD2-CG1 4.04Å; L339-V448 HydrophobicContact CG-CG1 3.86Å; I341-V448 HydrophobicContact CG1-CG2 4.28Å; S443-V448 PolarHBondContact N-O 3.4Å; S443-V448 PolarHBondContact OG-N 3.37Å; V448-I450 HydrophobicContact CG1-CG1 4.46Å
449	R	96.9	Very high	92.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.3	179	-49.1	-169.8	74.5	170.9	-1.1	109.7	V340 F342 S402 F404 E439 T442 Y451	V340-R449 HydrophobicContact CG2-CB 3.93Å; V340-R449 PolarHBondContact N-O 3.4Å; V340-R449 PolarHBondContact O-N 3.5Å; F342-R449 HydrophobicContact CB-CG 4.42Å; S402-R449 PolarHBondContact O-NH1 2.8Å; F404-R449 VanDerWaalsContact O-CZ 3.32Å; F404-R449 PolarHBondContact O-NH1 3.01Å; F404-R449 PolarHBondContact O-NH2 2.93Å; E439-R449 IonicContact OE1-CZ 3.77Å; E439-R449 IonicContact OE1-NE 3.91Å; E439-R449 IonicContact OE1-NH2 3.19Å; E439-R449 PolarHBondContact OE1-NH2 3.3Å; T442-R449 HydrophobicContact CG2-CG 4.2Å; T442-R449 PolarHBondContact OG1-NE 3.4Å; R449-Y451 HydrophobicContact CB-CD2 4.47Å; R449-Y451 HydrophobicContact CB-CE2 3.62Å; R449-Y451 PolarHBondContact NE-OH 3.36Å; R449-Y451 PolarHBondContact NH2-OH 2.97Å
450	I	97.5	Very high	91.6	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	121.3	-177.8	-52.8	172.6	0	0	0	108	A268 W271 L272 Y337 V338 L339 A440 F441 V448	A268-I450 HydrophobicContact CB-CD1 4.26Å; W271-I450 HydrophobicContact CE3-CD1 3.68Å; W271-I450 HydrophobicContact CZ3-CB 4.4Å; W271-I450 HydrophobicContact CZ3-CD1 4Å; W271-I450 HydrophobicContact CZ3-CG2 4.03Å; L272-I450 HydrophobicContact CB-CD1 4.37Å; L272-I450 HydrophobicContact CD1-CD1 4.19Å; L272-I450 HydrophobicContact CD1-CG2 4.19Å; Y337-I450 HydrophobicContact CD1-CG2 3.92Å; Y337-I450 HydrophobicContact CG-CG2 4.44Å; V338-I450 WeakPolarHBondContact O-CA 3.4Å; L339-I450 HydrophobicContact CD1-CG1 4.34Å; L339-I450 HydrophobicContact CG-CG1 4.41Å; A440-I450 WeakPolarHBondContact CB-O 3.32Å; A440-I450 PolarHBondContact N-O 3.31Å; F441-I450 HydrophobicContact CB-CB 4.22Å; F441-I450 HydrophobicContact CB-CD1 4.31Å; F441-I450 HydrophobicContact CD1-CD1 3.98Å; F441-I450 HydrophobicContact CD1-CG1 4.48Å; F441-I450 PolarHBondContact N-O 2.8Å; F441-I450 VanDerWaalsContact N-O 3.07Å; F441-I450 PolarHBondContact O-N 2.93Å; V448-I450 HydrophobicContact CG1-CG1 4.46Å
451	Y	97.6	Very high	90.6	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	142.1	177.6	-64.6	-88.9	0	0	0	109.6	Y337 V338 V340 L401 F404 L434 E438 E439 R449	Y337-Y451 CarbonylContact C-O 3.53Å; Y337-Y451 VanDerWaalsContact CA-O 3.25Å; Y337-Y451 WeakPolarHBondContact CA-O 3.39Å; V338-Y451 PolarHBondContact N-O 2.91Å; V338-Y451 PolarHBondContact O-N 2.81Å; V340-Y451 HydrophobicContact CG2-CD2 4.27Å; V340-Y451 HydrophobicContact CG2-CE2 3.84Å; L401-Y451 HydrophobicContact CB-CD2 4.29Å; L401-Y451 HydrophobicContact CB-CE2 4Å; L401-Y451 HydrophobicContact CD2-CD1 3.83Å; L401-Y451 HydrophobicContact CD2-CD2 3.61Å; L401-Y451 HydrophobicContact CD2-CE1 4.17Å; L401-Y451 HydrophobicContact CD2-CE2 3.94Å; L401-Y451 HydrophobicContact CD2-CG 3.56Å; L401-Y451 HydrophobicContact CG-CD2 4.36Å; L401-Y451 VanDerWaalsContact O-CZ 3.28Å; L401-Y451 PolarHBondContact O-OH 2.64Å; F404-Y451 HydrophobicContact CB-CE1 4.36Å; F404-Y451 HydrophobicContact CD1-CE1 4.22Å; F404-Y451 HydrophobicContact CG-CE1 4.47Å; L434-Y451 HydrophobicContact CD1-CD1 3.78Å; L434-Y451 HydrophobicContact CD1-CE1 3.63Å; E438-Y451 CarbonylContact O-C 3.51Å; E438-Y451 VanDerWaalsContact O-CA 3.29Å; E438-Y451 WeakPolarHBondContact O-CA 3.47Å; E439-Y451 HydrophobicContact CB-CD1 4.24Å; E439-Y451 HydrophobicContact CB-CE1 3.95Å; E439-Y451 HydrophobicContact CG-CE1 4.29Å; R449-Y451 HydrophobicContact CB-CD2 4.47Å; R449-Y451 HydrophobicContact CB-CE2 3.62Å; R449-Y451 PolarHBondContact NE-OH 3.36Å; R449-Y451 PolarHBondContact NH2-OH 2.97Å
452	K	96.9	Very high	89.5	Confident	75 Å²	75	71.8 Å²	71.8	33%	0.326	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.5	172.2	-179.8	174.6	162.7	-146.2	0	109.7	Y337 L437 E438 A440 K454	Y337-K452 HydrophobicContact CD1-CB 3.92Å; Y337-K452 HydrophobicContact CD1-CG 4.32Å; Y337-K452 HydrophobicContact CE1-CB 3.75Å; Y337-K452 HydrophobicContact CE1-CD 3.99Å; Y337-K452 HydrophobicContact CE1-CG 3.93Å; L437-K452 WeakPolarHBondContact CA-O 3.2Å; E438-K452 HydrophobicContact CG-CB 3.8Å; E438-K452 HydrophobicContact CG-CG 4.39Å; E438-K452 PolarHBondContact N-O 2.9Å; E438-K452 PolarHBondContact O-N 3.25Å; E438-K452 VanDerWaalsContact OE1-CD 3.32Å; E438-K452 WeakPolarHBondContact OE1-CD 3.23Å; E438-K452 IonicContact OE1-NZ 3.21Å; E438-K452 PolarHBondContact OE1-NZ 3.34Å; A440-K452 HydrophobicContact CB-CB 4.08Å; K452-K454 PolarHBondContact O-N 3.37Å
453	V	96	Very high	88.6	Confident	7 Å²	7	73.5 Å²	73.5	4%	0.042	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	122.6	175.9	-177.6	0	0	0	0	108.1	Y327 M330 V335 D336 V338 L437	Y327-V453 HydrophobicContact CD2-CG1 3.93Å; Y327-V453 HydrophobicContact CE2-CG1 3.57Å; M330-V453 HydrophobicContact SD-CG2 3.96Å; V335-V453 HydrophobicContact CG1-CG2 4.06Å; D336-V453 PolarHBondContact O-N 2.91Å; V338-V453 HydrophobicContact CG2-CG2 4.04Å; L437-V453 HydrophobicContact CD2-CB 4.48Å; L437-V453 HydrophobicContact CD2-CG2 3.87Å
454	K	93.6	Very high	87.5	Confident	68 Å²	68	80 Å²	80	30%	0.296	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-71.2	148.8	179.5	-66.4	177.4	-173.4	159.3	0	110.9	Y327 L434 N435 Y436 L437 E438 K452	Y327-K454 WeakPolarHBondContact CE2-O 3.39Å; Y327-K454 PolarHBondContact OH-O 2.94Å; L434-K454 PolarHBondContact O-NZ 3.06Å; N435-K454 WeakPolarHBondContact O-CD 3.43Å; N435-K454 PolarHBondContact O-NZ 3.33Å; Y436-K454 WeakPolarHBondContact O-CB 3.06Å; Y436-K454 PolarHBondContact O-N 3.32Å; L437-K454 VanDerWaalsContact O-CE 3.23Å; L437-K454 WeakPolarHBondContact O-CE 3.47Å; L437-K454 PolarHBondContact O-NZ 3.27Å; E438-K454 HydrophobicContact CB-CG 4.44Å; E438-K454 HydrophobicContact CG-CG 4.37Å; K452-K454 PolarHBondContact O-N 3.37Å
455	D	89.6	Confident	86.8	Confident	123 Å²	123	76 Å²	76	66%	0.658	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-64.4	162	169.5	-70	-45.4	0	0	0	112	R331 A457	R331-D455 IonicContact NH1-OD1 3.74Å; D455-A457 PolarHBondContact O-N 3.25Å
456	L	84.6	Confident	86.1	Confident	119 Å²	119	79.4 Å²	79.4	62%	0.623	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-54.5	136.8	172.9	-68.9	172.5	0	0	0	109.4	Y327 N458	Y327-L456 HydrophobicContact CE1-CD2 4.16Å; L456-N458 PolarHBondContact O-N 3.06Å
457	A	81.3	Confident	85.5	Confident	78 Å²	78	82.1 Å²	82.1	65%	0.645	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-54	122.1	176.1	0	0	0	0	0	109.3	D455 R459	D455-A457 PolarHBondContact O-N 3.25Å; A457-R459 PolarHBondContact O-N 3.3Å
458	N	83.8	Confident	84.6	Confident	159 Å²	159	91.2 Å²	91.2	85%	0.85	46%	0.458	S	S	*	.	S	Bend	trans	-54.4	-23.4	-177.2	-170.9	22.1	0	0	0	112.7	L456	L456-N458 PolarHBondContact O-N 3.06Å
459	R	80	Confident	83.6	Confident	205 Å²	205	97.7 Å²	97.7	77%	0.774	49%	0.491	S	S	*	.	S	Bend	trans	-136	135.3	171.5	-62	-177.2	-178.8	-173.6	-0.4	110.1	A457 T461	A457-R459 PolarHBondContact O-N 3.3Å; R459-T461 PolarHBondContact O-N 3.25Å
460	Y	76.5	Confident	82.2	Confident	194 Å²	194	103.5 Å²	103.5	76%	0.761	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-65.6	119.7	170.5	-177.8	-102.5	0	0	0	109.7	I462	Y460-I462 HydrophobicContact CD1-CG1 4.14Å; Y460-I462 HydrophobicContact CE1-CG1 3.92Å
461	T	74.6	Confident	80.6	Confident	106 Å²	106	110.3 Å²	110.3	65%	0.65	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-96.9	119.8	175.1	56.6	0	0	0	0	109.2	R459 P463	R459-T461 PolarHBondContact O-N 3.25Å; T461-P463 WeakPolarHBondContact O-CD 3.31Å
462	I	74.2	Confident	78.7	Confident	85 Å²	85	119.9 Å²	119.9	44%	0.436	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-70.1	123.1	174.5	-58.4	169.2	0	0	0	107.6	Y460 Y464 N466 R467	Y460-I462 HydrophobicContact CD1-CG1 4.14Å; Y460-I462 HydrophobicContact CE1-CG1 3.92Å; I462-Y464 PolarHBondContact O-N 3.1Å; I462-N466 HydrophobicContact CG2-CB 3.84Å; I462-R467 HydrophobicContact CB-CG 4.24Å; I462-R467 HydrophobicContact CG2-CG 3.94Å; I462-R467 PolarHBondContact O-NE 3.21Å; I462-R467 PolarHBondContact O-NH2 3.1Å
463	P	75.7	Confident	76.8	Confident	66 Å²	66	125.6 Å²	125.6	43%	0.429	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-53.3	140.5	175.4	-25.7	34	0	0	0	110.3	T461 A465 N466 R467	T461-P463 WeakPolarHBondContact O-CD 3.31Å; P463-A465 PolarHBondContact O-N 2.87Å; P463-N466 PolarHBondContact O-N 3.45Å; P463-R467 PolarHBondContact O-N 3.3Å
464	Y	72.9	Confident	74.8	Confident	137 Å²	137	131.2 Å²	131.2	54%	0.537	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-52.7	-35.3	-174.5	-177	-97.5	0	0	0	113.1	I462 N466 R467 K470	I462-Y464 PolarHBondContact O-N 3.1Å; Y464-N466 VanDerWaalsContact C-N 3.26Å; Y464-N466 PolarHBondContact O-N 2.9Å; Y464-R467 PolarHBondContact O-N 3.11Å; Y464-K470 HydrophobicContact CE1-CD 4.39Å
465	A	77.1	Confident	72.7	Confident	73 Å²	73	133.1 Å²	133.1	60%	0.603	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-58.2	-35.1	176.2	0	0	0	0	0	113.6	P463	P463-A465 PolarHBondContact O-N 2.87Å
466	N	77.1	Confident	70.7	Confident	112 Å²	112	132.8 Å²	132.8	60%	0.599	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-97.5	2	-174.1	-63.4	-5.8	0	0	0	113	I462 P463 Y464 M468	I462-N466 HydrophobicContact CG2-CB 3.84Å; P463-N466 PolarHBondContact O-N 3.45Å; Y464-N466 VanDerWaalsContact C-N 3.26Å; Y464-N466 PolarHBondContact O-N 2.9Å; N466-M468 PolarHBondContact O-N 2.96Å
467	R	78.9	Confident	69.1	Low	113 Å²	113	137.5 Å²	137.5	43%	0.426	69%	0.691	S	S	.	*			trans	-73.4	116.3	177	-64.8	-178.7	-172.8	-178.3	0.7	109.1	I462 P463 Y464 I469	I462-R467 HydrophobicContact CB-CG 4.24Å; I462-R467 HydrophobicContact CG2-CG 3.94Å; I462-R467 PolarHBondContact O-NE 3.21Å; I462-R467 PolarHBondContact O-NH2 3.1Å; P463-R467 PolarHBondContact O-N 3.3Å; Y464-R467 PolarHBondContact O-N 3.11Å; R467-I469 PolarHBondContact O-N 3.42Å
468	M	75.2	Confident	67.3	Low	196 Å²	196	136.3 Å²	136.3	97%	0.966	69%	0.686	S	S	*	*	S	Bend	trans	-59	-34.9	173.4	-67.3	-166.4	-68	0	0	111.8	N466	N466-M468 PolarHBondContact O-N 2.96Å
469	I	76.2	Confident	65.3	Low	136 Å²	136	140.3 Å²	140.3	70%	0.697	69%	0.689	S	S	*	*	S	Bend	trans	-106.8	95.4	175.7	-54.6	174.2	0	0	0	108.3	R467 L471	R467-I469 PolarHBondContact O-N 3.42Å; I469-L471 HydrophobicContact CG2-CG 4.45Å; I469-L471 PolarHBondContact O-N 3.06Å; I469-L471 VanDerWaalsContact O-N 3.14Å
470	K	67.7	Low	63.7	Low	122 Å²	122	136.7 Å²	136.7	53%	0.53	69%	0.69	S	S	.	*			trans	-78.8	91.6	169.2	-64.8	-178.9	-175.9	176.2	0	107.9	Y464 K472	Y464-K470 HydrophobicContact CE1-CD 4.39Å; K470-K472 PolarHBondContact O-N 3.14Å
471	L	63.3	Low	62.3	Low	143 Å²	143	136.6 Å²	136.6	75%	0.749	69%	0.694	S	S	*	*			trans	-54.1	118.3	171.3	-74.2	161.7	0	0	0	108.5	I469	I469-L471 HydrophobicContact CG2-CG 4.45Å; I469-L471 PolarHBondContact O-N 3.06Å; I469-L471 VanDerWaalsContact O-N 3.14Å
472	K	58.4	Low	61.2	Low	201 Å²	201	137.3 Å²	137.3	87%	0.874	70%	0.698	S	S	*	*			trans	-55.6	138.9	164.3	-92.6	177.6	173.9	176.4	0	107.1	K470	K470-K472 PolarHBondContact O-N 3.14Å
473	K	56.5	Low	60	Low	194 Å²	194	138.4 Å²	138.4	84%	0.843	71%	0.71	S	S	*	*			trans	-25.3	130	-178.2	-80.3	178.9	173.2	178.6	0	112	T475	K473-T475 PolarHBondContact O-N 3.16Å
474	P	53.5	Low	58.6	Low	125 Å²	125	141.8 Å²	141.8	81%	0.812	73%	0.73	S	S	*	*			trans	-57.2	118.2	175.3	25.6	-31.7	0	0	0	107.6	S476	P474-S476 PolarHBondContact O-N 2.98Å; P474-S476 VanDerWaalsContact O-N 3.16Å
475	T	50.5	Low	57.8	Low	109 Å²	109	141.3 Å²	141.3	67%	0.669	74%	0.741	S	S	*	*			trans	-51	122.8	164	38.3	0	0	0	0	106.6	K473 Y477	K473-T475 PolarHBondContact O-N 3.16Å; T475-Y477 VanDerWaalsContact C-N 3.31Å; T475-Y477 PolarHBondContact O-N 3.18Å
476	S	46.5	Very low	55.9	Low	115 Å²	115	145.7 Å²	145.7	80%	0.804	75%	0.753	S	S	*	*			trans	-52.6	97.9	174.1	123.3	0	0	0	0	107.7	P474 G478	P474-S476 PolarHBondContact O-N 2.98Å; P474-S476 VanDerWaalsContact O-N 3.16Å; S476-G478 PolarHBondContact O-N 2.77Å
477	Y	51.5	Low	54.5	Low	219 Å²	219	149.8 Å²	149.8	86%	0.859	79%	0.788	S	S	*	*			trans	-73.8	106.8	163	-97.4	-86.5	0	0	0	105.4	T475	T475-Y477 VanDerWaalsContact C-N 3.31Å; T475-Y477 PolarHBondContact O-N 3.18Å
478	G	43.9	Very low	53.2	Low	53 Å²	53	151.7 Å²	151.7	55%	0.546	81%	0.807	S	S	.	*			trans	-56.2	150.7	-170.9	0	0	0	0	0	113	S476 V480	S476-G478 PolarHBondContact O-N 2.77Å; G478-V480 PolarHBondContact O-N 3.02Å
479	R	41.3	Very low	52.1	Low	242 Å²	242	149.3 Å²	149.3	91%	0.913	80%	0.798	S	S	*	*			trans	-40.3	111.9	162.5	-71.5	176.8	-175.2	172.5	1	109.7	K481	R479-K481 VanDerWaalsContact C-N 3.32Å; R479-K481 PolarHBondContact O-N 3.05Å
480	V	47.4	Very low	50.7	Low	130 Å²	130	150.1 Å²	150.1	79%	0.788	80%	0.804	S	S	*	*			trans	-64.3	102.2	154.7	178.1	0	0	0	0	105.4	G478 V482	G478-V480 PolarHBondContact O-N 3.02Å; V480-V482 PolarHBondContact O-N 3.01Å
481	K	46	Very low	49.7	Very low	192 Å²	192	151.7 Å²	151.7	84%	0.835	82%	0.82	S	S	*	*			trans	-61.4	104.9	164.9	-80.7	-178.5	174.2	-179.3	0	106.6	R479	R479-K481 VanDerWaalsContact C-N 3.32Å; R479-K481 PolarHBondContact O-N 3.05Å
482	V	52.1	Low	48.9	Very low	121 Å²	121	152.3 Å²	152.3	73%	0.733	82%	0.824	S	S	*	*			trans	-66.9	122.9	164	-175.2	0	0	0	0	106.5	V480 T484	V480-V482 PolarHBondContact O-N 3.01Å; V482-T484 PolarHBondContact O-N 3.14Å
483	P	48.8	Very low	48.3	Very low	107 Å²	107	149 Å²	149	70%	0.695	82%	0.821	S	S	*	*			trans	-71.2	124.1	173.6	0.6	14.6	0	0	0	108.3	V485	P483-V485 PolarHBondContact O-N 3.38Å; P483-V485 VanDerWaalsContact O-N 3.14Å
484	T	47.1	Very low	47.7	Very low	137 Å²	137	145.8 Å²	145.8	84%	0.84	82%	0.819	S	S	*	*			trans	-63	109.1	165.1	-39.6	0	0	0	0	107.7	V482 L486	V482-T484 PolarHBondContact O-N 3.14Å; T484-L486 PolarHBondContact O-N 3.49Å
485	V	54.5	Low	47.2	Very low	127 Å²	127	147.4 Å²	147.4	77%	0.77	82%	0.82	S	S	*	*			trans	-80	116.5	169.3	-179.7	0	0	0	0	107	P483	P483-V485 PolarHBondContact O-N 3.38Å; P483-V485 VanDerWaalsContact O-N 3.14Å
486	L	37.4	Very low	46.9	Very low	166 Å²	166	150.6 Å²	150.6	87%	0.869	83%	0.833	S	S	*	*			trans	-65.5	119.8	163.4	-87.6	137.3	0	0	0	109.3	T484	T484-L486 PolarHBondContact O-N 3.49Å
487	C	47.1	Very low	47	Very low	198 Å²	198	153.8 Å²	153.8	100%	1.338	84%	0.835	S	S	*	*			trans	-141.1	0	143.4	-96.8	0	0	0	0	107.5

Retrieved 487 of 487 residues in 396.9 ms (Link to these results)

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