A0A060Y4N4_ONCMY Loading...

Dolichyldiphosphatase

Required for efficient N-glycosylation. Necessary for maintaining optimal levels of dolichol-linked oligosaccharides. Hydrolyzes dolichyl pyrophosphate at a very high rate and dolichyl monophosphate at a much lower rate. Does not act on phosphatidate.

AlphaFold DB , UniProt , Accession A0A060Y4N4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 238 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	39	Very low	52.3	Low	186 Å²	186	108.5 Å²	108.5	92%	0.916	61%	0.607	S	S	*	*				0	-70.9	0	-68.3	-169.5	162.7	0	0	112.9	S3 E4	M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 2.87Å; M1-E4 WeakPolarHBondContact CA-OE2 3.36Å; M1-E4 PolarHBondContact N-OE2 3.19Å; M1-E4 PolarHBondContact O-N 3.02Å
2	A	40.1	Very low	54	Low	88 Å²	88	116.8 Å²	116.8	73%	0.727	62%	0.622	S	S	*	*	H	α-helix	trans	-70.5	-21.7	178.1	0	0	0	0	0	115.3
3	S	42.1	Very low	55.8	Low	73 Å²	73	111.8 Å²	111.8	51%	0.51	59%	0.59	S	S	.	*	H	α-helix	trans	-82.9	-27.2	176.7	52.6	0	0	0	0	113.9	M1 C7	M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 2.87Å; S3-C7 PolarHBondContact O-SG 2.84Å
4	E	46	Very low	57.2	Low	134 Å²	134	114.6 Å²	114.6	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-79	-30.4	-176.3	-72.6	160.9	137.6	0	0	111.9	M1	M1-E4 WeakPolarHBondContact CA-OE2 3.36Å; M1-E4 PolarHBondContact N-OE2 3.19Å; M1-E4 PolarHBondContact O-N 3.02Å
5	E	50.4	Low	58.6	Low	157 Å²	157	110.9 Å²	110.9	73%	0.734	58%	0.576	S	S	*	*	H	α-helix	trans	-71.7	-33.3	179.4	-149	170.6	-167	0	0	111.9	S8	E5-S8 PolarHBondContact O-OG 3.09Å
6	Y	55.8	Low	59.8	Low	172 Å²	172	104.9 Å²	104.9	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-73.5	-26.5	179	-107.7	-88	0	0	0	114.5	L158	Y6-L158 HydrophobicContact CD1-CD1 4.46Å
7	C	65.1	Low	60.6	Low	48 Å²	48	105.2 Å²	105.2	32%	0.324	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.1	-1.9	179.5	-50.5	0	0	0	0	113	S3 P85 C86	S3-C7 PolarHBondContact O-SG 2.84Å; C7-P85 PolarHBondContact SG-O 3.34Å; C7-C86 HydrophobicContact CB-CB 3.91Å; C7-C86 WeakPolarHBondContact CB-SG 3.5Å; C7-C86 WeakPolarHBondContact SG-CB 3.26Å; C7-C86 CovalentContact SG-SG 2.05Å; C7-C86 PolarHBondContact SG-SG 3.47Å
8	S	56.9	Low	61.2	Low	84 Å²	84	107.7 Å²	107.7	59%	0.587	57%	0.571	S	S	*	*	S	Bend	trans	-81.1	-21.3	-167.9	66.2	0	0	0	0	115.2	E5	E5-S8 PolarHBondContact O-OG 3.09Å
9	V	56.3	Low	62	Low	114 Å²	114	104.4 Å²	104.4	69%	0.691	56%	0.555	S	S	*	*	S	Bend	trans	-131.8	101.5	170.8	-174.4	0	0	0	0	108.2	P11	V9-P11 WeakPolarHBondContact O-CD 3.41Å
10	P	58.1	Low	62.9	Low	92 Å²	92	104.7 Å²	104.7	60%	0.597	55%	0.553	S	S	*	*			trans	-65.3	121.5	-176.1	22.9	-29.8	0	0	0	109.2
11	P	65.5	Low	63.7	Low	45 Å²	45	100.4 Å²	100.4	29%	0.292	53%	0.531	S	S	.	.			trans	-60.3	151.1	173	25	-31.4	0	0	0	109	V9 W13 P24	V9-P11 WeakPolarHBondContact O-CD 3.41Å; P11-W13 HydrophobicContact CG-CD2 4.3Å; P11-W13 HydrophobicContact CG-CH2 4.01Å; P11-W13 HydrophobicContact CG-CZ2 3.61Å; P11-W13 PolarHBondContact O-N 3.4Å; P11-W13 PolarHBondContact O-NE1 3.4Å; P11-P24 HydrophobicContact CB-CB 4.03Å; P11-P24 HydrophobicContact CG-CB 4.26Å; P11-P24 HydrophobicContact CG-CG 4.31Å
12	R	72.8	Confident	65.8	Low	208 Å²	208	92.6 Å²	92.6	79%	0.785	49%	0.492	S	S	*	.			trans	-64.6	103.7	172.8	-175.6	177.4	179.8	173.2	2	108.3	A25	R12-A25 HydrophobicContact CB-CB 4.34Å; R12-A25 WeakPolarHBondContact O-CB 3.44Å; R12-A25 PolarHBondContact O-N 3.03Å
13	W	77	Confident	67.8	Low	53 Å²	53	89.1 Å²	89.1	20%	0.201	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.3	179.7	-60.5	104.3	0	0	0	111.4	P11 E22 F23 P24 A89 H90 L158	P11-W13 HydrophobicContact CG-CD2 4.3Å; P11-W13 HydrophobicContact CG-CH2 4.01Å; P11-W13 HydrophobicContact CG-CZ2 3.61Å; P11-W13 PolarHBondContact O-N 3.4Å; P11-W13 PolarHBondContact O-NE1 3.4Å; W13-E22 HydrophobicContact CB-CB 4.4Å; W13-E22 HydrophobicContact CE3-CB 4.25Å; W13-F23 VanDerWaalsContact CE3-C 3.43Å; W13-P24 HydrophobicContact CE3-CG 4.34Å; W13-P24 HydrophobicContact CH2-CG 4.28Å; W13-P24 HydrophobicContact CZ3-CG 3.78Å; W13-A89 PolarHBondContact NE1-O 3.47Å; W13-A89 VanDerWaalsContact NE1-O 3.12Å; W13-H90 AromaticContact CE3-CE1 3.87Å; W13-H90 AromaticContact CH2-CE1 3.65Å; W13-H90 AromaticContact CZ3-CE1 3.55Å; W13-L158 HydrophobicContact CH2-CD1 4.37Å
14	R	75.1	Confident	69.7	Low	151 Å²	151	86.9 Å²	86.9	57%	0.57	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.8	165.4	-77.7	-178.1	-179.3	-174	1.3	108.2	E22 F23 A25	R14-E22 CarbonylContact O-C 3.53Å; R14-E22 VanDerWaalsContact O-CA 3.29Å; R14-E22 WeakPolarHBondContact O-CA 3.31Å; R14-F23 HydrophobicContact CB-CE1 4.31Å; R14-F23 HydrophobicContact CB-CE2 4.22Å; R14-F23 HydrophobicContact CB-CZ 3.98Å; R14-F23 PolarHBondContact N-O 3.15Å; R14-F23 WeakPolarHBondContact O-CD1 3.42Å; R14-F23 WeakPolarHBondContact O-CE1 3.29Å; R14-F23 PolarHBondContact O-N 3.3Å; R14-A25 HydrophobicContact CG-CB 3.98Å
15	S	78.9	Confident	71.3	Confident	58 Å²	58	82.2 Å²	82.2	41%	0.406	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	149.5	176.4	54.7	0	0	0	0	111.7	S17 V21	S15-S17 PolarHBondContact O-N 2.93Å; S15-V21 CarbonylContact C-O 3.56Å; S15-V21 VanDerWaalsContact CA-O 3.29Å; S15-V21 WeakPolarHBondContact CA-O 3.48Å
16	I	77	Confident	72.8	Confident	15 Å²	15	78.4 Å²	78.4	8%	0.077	43%	0.432	C	S	.	.			trans	-68.1	122.5	163.7	-59.9	175.6	0	0	0	107.3	L18 T19 H20 V21 F23 A34 Y35 L38	I16-L18 PolarHBondContact O-N 2.81Å; I16-L18 VanDerWaalsContact O-N 3.12Å; I16-T19 PolarHBondContact O-N 3.36Å; I16-H20 WeakPolarHBondContact O-CA 3.37Å; I16-H20 PolarHBondContact O-N 2.75Å; I16-V21 HydrophobicContact CD1-CB 4.33Å; I16-V21 PolarHBondContact N-O 3.42Å; I16-F23 HydrophobicContact CG1-CD1 4.37Å; I16-F23 HydrophobicContact CG1-CE1 3.99Å; I16-A34 HydrophobicContact CD1-CB 3.94Å; I16-Y35 HydrophobicContact CD1-CD1 3.79Å; I16-Y35 HydrophobicContact CD1-CE1 3.78Å; I16-Y35 HydrophobicContact CD1-CG 4.21Å; I16-Y35 HydrophobicContact CG1-CE1 4.38Å; I16-Y35 HydrophobicContact CG2-CE1 4.25Å; I16-L38 HydrophobicContact CD1-CD1 4.05Å
17	S	73.5	Confident	74.2	Confident	110 Å²	110	71.9 Å²	71.9	77%	0.769	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.7	-169.6	51.9	0	0	0	0	114.8	S15	S15-S17 PolarHBondContact O-N 2.93Å
18	L	72.3	Confident	75.4	Confident	151 Å²	151	75.8 Å²	75.8	79%	0.791	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-37	-177.9	-175.1	64.5	0	0	0	113.5	I16	I16-L18 PolarHBondContact O-N 2.81Å; I16-L18 VanDerWaalsContact O-N 3.12Å
19	T	75.9	Confident	76.9	Confident	44 Å²	44	75.3 Å²	75.3	27%	0.27	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-2.7	-166.9	54.2	0	0	0	0	113.5	I16 V21 L38	I16-T19 PolarHBondContact O-N 3.36Å; T19-V21 PolarHBondContact O-N 3.44Å; T19-L38 HydrophobicContact CG2-CD1 4.06Å; T19-L38 HydrophobicContact CG2-CD2 3.8Å; T19-L38 WeakPolarHBondContact OG1-CD2 3.28Å
20	H	79.6	Confident	78.3	Confident	110 Å²	110	69.9 Å²	69.9	51%	0.509	39%	0.386	S	S	.	.			trans	56.4	19.8	178.3	-63.2	-76.4	0	0	0	115.1	I16 E22 T92	I16-H20 WeakPolarHBondContact O-CA 3.37Å; I16-H20 PolarHBondContact O-N 2.75Å; H20-E22 PolarHBondContact O-N 3.22Å; H20-T92 HydrophobicContact CB-CG2 4.07Å; H20-T92 PolarHBondContact O-OG1 3.04Å
21	V	80.3	Confident	79.8	Confident	16 Å²	16	68.8 Å²	68.8	10%	0.097	37%	0.373	C	S	.	.			trans	-71.8	118.4	172.3	178.7	0	0	0	0	108.9	S15 I16 T19 A34 L38	S15-V21 CarbonylContact C-O 3.56Å; S15-V21 VanDerWaalsContact CA-O 3.29Å; S15-V21 WeakPolarHBondContact CA-O 3.48Å; I16-V21 HydrophobicContact CD1-CB 4.33Å; I16-V21 PolarHBondContact N-O 3.42Å; T19-V21 PolarHBondContact O-N 3.44Å; V21-A34 HydrophobicContact CG1-CB 3.82Å; V21-L38 HydrophobicContact CG2-CD2 3.55Å
22	E	82.9	Confident	81	Confident	21 Å²	21	72.3 Å²	72.3	10%	0.098	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	140.2	-178.7	-64.7	174.1	160	0	0	112	W13 R14 H20 H90 T92 Y159	W13-E22 HydrophobicContact CB-CB 4.4Å; W13-E22 HydrophobicContact CE3-CB 4.25Å; R14-E22 CarbonylContact O-C 3.53Å; R14-E22 VanDerWaalsContact O-CA 3.29Å; R14-E22 WeakPolarHBondContact O-CA 3.31Å; H20-E22 PolarHBondContact O-N 3.22Å; E22-H90 WeakPolarHBondContact OE2-CA 3.45Å; E22-H90 VanDerWaalsContact OE2-CB 3.23Å; E22-H90 WeakPolarHBondContact OE2-CB 3.29Å; E22-H90 IonicContact OE2-CG 3.39Å; E22-H90 IonicContact OE2-ND1 2.8Å; E22-H90 PolarHBondContact OE2-ND1 2.9Å; E22-T92 HydrophobicContact CG-CG2 4.48Å; E22-T92 WeakPolarHBondContact OE1-CG2 3.21Å; E22-Y159 PolarHBondContact N-OH 3.12Å; E22-Y159 PolarHBondContact O-OH 3.32Å
23	F	82.9	Confident	81.8	Confident	16 Å²	16	63.2 Å²	63.2	7%	0.07	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	157.4	175.6	62.4	-85.2	0	0	0	110.9	W13 R14 I16 A25 Q31 A34 L157	W13-F23 VanDerWaalsContact CE3-C 3.43Å; R14-F23 HydrophobicContact CB-CE1 4.31Å; R14-F23 HydrophobicContact CB-CE2 4.22Å; R14-F23 HydrophobicContact CB-CZ 3.98Å; R14-F23 PolarHBondContact N-O 3.15Å; R14-F23 WeakPolarHBondContact O-CD1 3.42Å; R14-F23 WeakPolarHBondContact O-CE1 3.29Å; R14-F23 PolarHBondContact O-N 3.3Å; I16-F23 HydrophobicContact CG1-CD1 4.37Å; I16-F23 HydrophobicContact CG1-CE1 3.99Å; F23-A25 PolarHBondContact O-N 3.47Å; F23-Q31 HydrophobicContact CD2-CB 3.91Å; F23-Q31 HydrophobicContact CD2-CG 4.41Å; F23-Q31 HydrophobicContact CE1-CG 4.45Å; F23-Q31 HydrophobicContact CE2-CB 3.76Å; F23-Q31 HydrophobicContact CE2-CG 3.87Å; F23-Q31 HydrophobicContact CZ-CB 4.29Å; F23-Q31 HydrophobicContact CZ-CG 3.9Å; F23-A34 HydrophobicContact CB-CB 4.11Å; F23-A34 HydrophobicContact CD1-CB 4.01Å; F23-A34 HydrophobicContact CG-CB 4.31Å; F23-L157 HydrophobicContact CB-CD2 3.87Å
24	P	81.2	Confident	82.4	Confident	25 Å²	25	60.7 Å²	60.7	16%	0.162	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	132.9	-179.3	-22.1	34.9	0	0	0	112.3	P11 W13 G26 D27	P11-P24 HydrophobicContact CB-CB 4.03Å; P11-P24 HydrophobicContact CG-CB 4.26Å; P11-P24 HydrophobicContact CG-CG 4.31Å; W13-P24 HydrophobicContact CE3-CG 4.34Å; W13-P24 HydrophobicContact CH2-CG 4.28Å; W13-P24 HydrophobicContact CZ3-CG 3.78Å; P24-G26 PolarHBondContact O-N 3.33Å; P24-D27 HydrophobicContact CB-CB 4.04Å; P24-D27 PolarHBondContact O-N 2.81Å
25	A	79.1	Confident	83.2	Confident	37 Å²	37	59.1 Å²	59.1	31%	0.306	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	130	177.2	0	0	0	0	0	111.4	R12 R14 F23 D27	R12-A25 HydrophobicContact CB-CB 4.34Å; R12-A25 WeakPolarHBondContact O-CB 3.44Å; R12-A25 PolarHBondContact O-N 3.03Å; R14-A25 HydrophobicContact CG-CB 3.98Å; F23-A25 PolarHBondContact O-N 3.47Å; A25-D27 VanDerWaalsContact C-N 3.32Å
26	G	81.8	Confident	83.8	Confident	77 Å²	77	58 Å²	58	79%	0.794	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-2.7	-179.3	0	0	0	0	0	114.3	P24	P24-G26 PolarHBondContact O-N 3.33Å
27	D	86.9	Confident	84.5	Confident	35 Å²	35	57.4 Å²	57.4	19%	0.187	33%	0.329	C	S	.	.			trans	-94.5	101.8	174.3	-176.3	3.4	0	0	0	111.3	P24 A25 T29 G30 Q31 Y156	P24-D27 HydrophobicContact CB-CB 4.04Å; P24-D27 PolarHBondContact O-N 2.81Å; A25-D27 VanDerWaalsContact C-N 3.32Å; D27-T29 VanDerWaalsContact C-N 3.32Å; D27-T29 WeakPolarHBondContact OD1-CA 3.39Å; D27-T29 WeakPolarHBondContact OD1-CB 3.35Å; D27-T29 PolarHBondContact OD1-N 3.4Å; D27-G30 PolarHBondContact O-N 3.1Å; D27-G30 PolarHBondContact OD1-N 3.39Å; D27-G30 WeakPolarHBondContact OD2-CA 3.38Å; D27-G30 PolarHBondContact OD2-N 3.42Å; D27-Q31 WeakPolarHBondContact O-CB 3.46Å; D27-Q31 PolarHBondContact O-N 2.69Å; D27-Y156 PolarHBondContact OD1-OH 3.04Å; D27-Y156 WeakPolarHBondContact OD2-CE1 3.5Å; D27-Y156 PolarHBondContact OD2-OH 3.31Å
28	L	88.6	Confident	85.4	Confident	129 Å²	129	53.2 Å²	53.2	68%	0.675	30%	0.298	S	S	*	.	H	α-helix	trans	-64.5	-36.6	176.2	-68.3	174.9	0	0	0	112.1	Q31 L32	L28-Q31 PolarHBondContact O-N 3.32Å; L28-L32 WeakPolarHBondContact O-CG 3.47Å; L28-L32 PolarHBondContact O-N 3.29Å
29	T	89.1	Confident	86.5	Confident	74 Å²	74	48.7 Å²	48.7	45%	0.454	27%	0.274	S	S	.	.	H	α-helix	trans	-67.9	-45.5	178.1	-63.2	0	0	0	0	109.9	D27 Q31 L32 L33 Y156	D27-T29 VanDerWaalsContact C-N 3.32Å; D27-T29 WeakPolarHBondContact OD1-CA 3.39Å; D27-T29 WeakPolarHBondContact OD1-CB 3.35Å; D27-T29 PolarHBondContact OD1-N 3.4Å; T29-Q31 VanDerWaalsContact C-N 3.31Å; T29-Q31 PolarHBondContact O-N 3.44Å; T29-L32 PolarHBondContact O-N 3Å; T29-L33 HydrophobicContact CG2-CD1 3.93Å; T29-L33 HydrophobicContact CG2-CG 4.49Å; T29-L33 WeakPolarHBondContact O-CB 3.29Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.32Å; T29-L33 PolarHBondContact O-N 3.46Å; T29-Y156 HydrophobicContact CG2-CE1 4.36Å; T29-Y156 HydrophobicContact CG2-CE2 4.34Å
30	G	86.8	Confident	87.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-41.6	172.4	0	0	0	0	0	112.6	D27 L33 A34	D27-G30 PolarHBondContact O-N 3.1Å; D27-G30 PolarHBondContact OD1-N 3.39Å; D27-G30 WeakPolarHBondContact OD2-CA 3.38Å; D27-G30 PolarHBondContact OD2-N 3.42Å; G30-L33 PolarHBondContact O-N 3.46Å; G30-A34 WeakPolarHBondContact O-CB 3.43Å; G30-A34 PolarHBondContact O-N 3.43Å
31	Q	88.3	Confident	88	Confident	69 Å²	69	46.1 Å²	46.1	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-63.3	-46.1	176.1	-172.5	178	12.9	0	0	112.4	F23 D27 L28 T29 A34 Y35	F23-Q31 HydrophobicContact CD2-CB 3.91Å; F23-Q31 HydrophobicContact CD2-CG 4.41Å; F23-Q31 HydrophobicContact CE1-CG 4.45Å; F23-Q31 HydrophobicContact CE2-CB 3.76Å; F23-Q31 HydrophobicContact CE2-CG 3.87Å; F23-Q31 HydrophobicContact CZ-CB 4.29Å; F23-Q31 HydrophobicContact CZ-CG 3.9Å; D27-Q31 WeakPolarHBondContact O-CB 3.46Å; D27-Q31 PolarHBondContact O-N 2.69Å; L28-Q31 PolarHBondContact O-N 3.32Å; T29-Q31 VanDerWaalsContact C-N 3.31Å; T29-Q31 PolarHBondContact O-N 3.44Å; Q31-A34 WeakPolarHBondContact O-CB 3.21Å; Q31-A34 PolarHBondContact O-N 2.95Å; Q31-Y35 HydrophobicContact CG-CD2 4.29Å; Q31-Y35 HydrophobicContact CG-CE2 3.88Å; Q31-Y35 WeakPolarHBondContact O-CD2 3.46Å; Q31-Y35 PolarHBondContact O-N 3.32Å; Q31-Y35 VanDerWaalsContact O-N 3.17Å
32	L	91.1	Very high	88.7	Confident	120 Å²	120	49.7 Å²	49.7	63%	0.628	28%	0.284	S	S	*	.	H	α-helix	trans	-61.3	-45.4	175.9	-72.2	173.6	0	0	0	111.1	L28 T29 A34 Y35 T36	L28-L32 WeakPolarHBondContact O-CG 3.47Å; L28-L32 PolarHBondContact O-N 3.29Å; T29-L32 PolarHBondContact O-N 3Å; L32-A34 VanDerWaalsContact C-N 3.3Å; L32-A34 PolarHBondContact O-N 3.41Å; L32-Y35 PolarHBondContact O-N 2.97Å; L32-Y35 VanDerWaalsContact O-N 3.17Å; L32-T36 WeakPolarHBondContact O-CG2 3.19Å; L32-T36 PolarHBondContact O-N 3.24Å
33	L	90.7	Very high	89.4	Confident	16 Å²	16	50 Å²	50	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-35.9	178.2	-72.1	172.7	0	0	0	112	T29 G30 Y35 T36 S37 Y152 S153 Y156 L157	T29-L33 HydrophobicContact CG2-CD1 3.93Å; T29-L33 HydrophobicContact CG2-CG 4.49Å; T29-L33 WeakPolarHBondContact O-CB 3.29Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.32Å; T29-L33 PolarHBondContact O-N 3.46Å; G30-L33 PolarHBondContact O-N 3.46Å; L33-Y35 VanDerWaalsContact C-N 3.34Å; L33-Y35 PolarHBondContact O-N 2.88Å; L33-T36 WeakPolarHBondContact CA-OG1 3.44Å; L33-T36 PolarHBondContact O-N 2.98Å; L33-T36 PolarHBondContact O-OG1 2.8Å; L33-S37 PolarHBondContact O-N 3.2Å; L33-Y152 HydrophobicContact CD1-CD1 4.06Å; L33-Y152 HydrophobicContact CD1-CE1 3.91Å; L33-Y152 HydrophobicContact CD2-CD1 4.06Å; L33-S153 WeakPolarHBondContact O-CB 3.46Å; L33-Y156 HydrophobicContact CD1-CD1 3.46Å; L33-Y156 VanDerWaalsContact CD1-CD1 3.46Å; L33-Y156 HydrophobicContact CD1-CD2 4.16Å; L33-Y156 HydrophobicContact CD1-CE1 4.05Å; L33-Y156 HydrophobicContact CD1-CG 3.52Å; L33-L157 HydrophobicContact CB-CD1 4.42Å
34	A	89.1	Confident	90	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-43.9	173.5	0	0	0	0	0	111.3	I16 V21 F23 G30 Q31 L32 S37 L157	I16-A34 HydrophobicContact CD1-CB 3.94Å; V21-A34 HydrophobicContact CG1-CB 3.82Å; F23-A34 HydrophobicContact CB-CB 4.11Å; F23-A34 HydrophobicContact CD1-CB 4.01Å; F23-A34 HydrophobicContact CG-CB 4.31Å; G30-A34 WeakPolarHBondContact O-CB 3.43Å; G30-A34 PolarHBondContact O-N 3.43Å; Q31-A34 WeakPolarHBondContact O-CB 3.21Å; Q31-A34 PolarHBondContact O-N 2.95Å; L32-A34 VanDerWaalsContact C-N 3.3Å; L32-A34 PolarHBondContact O-N 3.41Å; A34-S37 PolarHBondContact O-N 3.18Å; A34-S37 PolarHBondContact O-OG 3.17Å; A34-L157 HydrophobicContact CB-CD1 4.09Å
35	Y	90.7	Very high	90.8	Very high	119 Å²	119	55.1 Å²	55.1	47%	0.467	32%	0.315	S	S	.	.	H	α-helix	trans	-64.2	-41.2	173.3	-74.5	-65.7	0	0	0	112.8	I16 Q31 L32 L33 S37 L38	I16-Y35 HydrophobicContact CD1-CD1 3.79Å; I16-Y35 HydrophobicContact CD1-CE1 3.78Å; I16-Y35 HydrophobicContact CD1-CG 4.21Å; I16-Y35 HydrophobicContact CG1-CE1 4.38Å; I16-Y35 HydrophobicContact CG2-CE1 4.25Å; Q31-Y35 HydrophobicContact CG-CD2 4.29Å; Q31-Y35 HydrophobicContact CG-CE2 3.88Å; Q31-Y35 WeakPolarHBondContact O-CD2 3.46Å; Q31-Y35 PolarHBondContact O-N 3.32Å; Q31-Y35 VanDerWaalsContact O-N 3.17Å; L32-Y35 PolarHBondContact O-N 2.97Å; L32-Y35 VanDerWaalsContact O-N 3.17Å; L33-Y35 VanDerWaalsContact C-N 3.34Å; L33-Y35 PolarHBondContact O-N 2.88Å; Y35-S37 PolarHBondContact O-N 2.91Å; Y35-L38 HydrophobicContact CD1-CD1 4.17Å; Y35-L38 WeakPolarHBondContact O-CB 3.5Å; Y35-L38 PolarHBondContact O-N 2.89Å
36	T	91.9	Very high	91.6	Very high	35 Å²	35	54.8 Å²	54.8	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-33.9	176.4	64	0	0	0	0	112	L32 L33 L38 L39 V150	L32-T36 WeakPolarHBondContact O-CG2 3.19Å; L32-T36 PolarHBondContact O-N 3.24Å; L33-T36 WeakPolarHBondContact CA-OG1 3.44Å; L33-T36 PolarHBondContact O-N 2.98Å; L33-T36 PolarHBondContact O-OG1 2.8Å; T36-L38 PolarHBondContact O-N 3.46Å; T36-L38 VanDerWaalsContact O-N 3.14Å; T36-L39 WeakPolarHBondContact O-CB 3.25Å; T36-L39 VanDerWaalsContact O-CG 3.31Å; T36-L39 WeakPolarHBondContact O-CG 3.44Å; T36-L39 PolarHBondContact O-N 3.15Å; T36-L39 VanDerWaalsContact O-N 3.12Å; T36-V150 WeakPolarHBondContact O-CG2 3.42Å
37	S	91.4	Very high	92.4	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.1	177.5	81.2	0	0	0	0	113.8	L33 A34 Y35 L39 P40 H103	L33-S37 PolarHBondContact O-N 3.2Å; A34-S37 PolarHBondContact O-N 3.18Å; A34-S37 PolarHBondContact O-OG 3.17Å; Y35-S37 PolarHBondContact O-N 2.91Å; S37-L39 VanDerWaalsContact C-N 3.31Å; S37-P40 VanDerWaalsContact O-CD 3.29Å; S37-P40 WeakPolarHBondContact O-CD 3.4Å; S37-H103 PolarHBondContact O-CD2 3.12Å; S37-H103 PolarHBondContact O-NE2 3.4Å
38	L	93.3	Very high	92.8	Very high	23 Å²	23	53.7 Å²	53.7	12%	0.12	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-8.1	175.4	-59	179	0	0	0	113.7	I16 T19 V21 Y35 T36 P40 I41 V42	I16-L38 HydrophobicContact CD1-CD1 4.05Å; T19-L38 HydrophobicContact CG2-CD1 4.06Å; T19-L38 HydrophobicContact CG2-CD2 3.8Å; T19-L38 WeakPolarHBondContact OG1-CD2 3.28Å; V21-L38 HydrophobicContact CG2-CD2 3.55Å; Y35-L38 HydrophobicContact CD1-CD1 4.17Å; Y35-L38 WeakPolarHBondContact O-CB 3.5Å; Y35-L38 PolarHBondContact O-N 2.89Å; T36-L38 PolarHBondContact O-N 3.46Å; T36-L38 VanDerWaalsContact O-N 3.14Å; L38-P40 VanDerWaalsContact C-CD 3.49Å; L38-I41 HydrophobicContact CD2-CD1 4.23Å; L38-I41 WeakPolarHBondContact O-CB 3.08Å; L38-I41 PolarHBondContact O-N 3.31Å; L38-V42 PolarHBondContact O-N 3.35Å; L38-V42 VanDerWaalsContact O-N 3.15Å
39	L	94.4	Very high	93.3	Very high	55 Å²	55	50.7 Å²	50.7	29%	0.288	28%	0.281	S	S	.	.	H	α-helix	trans	-54.2	-40.7	-178.6	-78.5	171.9	0	0	0	114.5	T36 S37 I41 V42 I43 V146 V150	T36-L39 WeakPolarHBondContact O-CB 3.25Å; T36-L39 VanDerWaalsContact O-CG 3.31Å; T36-L39 WeakPolarHBondContact O-CG 3.44Å; T36-L39 PolarHBondContact O-N 3.15Å; T36-L39 VanDerWaalsContact O-N 3.12Å; S37-L39 VanDerWaalsContact C-N 3.31Å; L39-I41 VanDerWaalsContact C-N 3.28Å; L39-I41 PolarHBondContact O-N 2.05Å; L39-V42 PolarHBondContact O-N 3.12Å; L39-V42 VanDerWaalsContact O-N 3.17Å; L39-I43 WeakPolarHBondContact O-CB 3.42Å; L39-I43 VanDerWaalsContact O-CG1 3.27Å; L39-I43 WeakPolarHBondContact O-CG1 3.13Å; L39-I43 PolarHBondContact O-N 3.29Å; L39-V146 HydrophobicContact CD1-CG1 3.56Å; L39-V150 HydrophobicContact CB-CG2 4.19Å; L39-V150 HydrophobicContact CD1-CG2 3.88Å
40	P	94.6	Very high	93.5	Very high	11 Å²	11	51.1 Å²	51.1	7%	0.071	28%	0.279	C	S	.	.	H	α-helix	trans	-52.8	-42.5	172.9	-30.6	38.7	0	0	0	113.9	S37 L38 I43 L44 F106	S37-P40 VanDerWaalsContact O-CD 3.29Å; S37-P40 WeakPolarHBondContact O-CD 3.4Å; L38-P40 VanDerWaalsContact C-CD 3.49Å; P40-I43 PolarHBondContact O-N 3.07Å; P40-L44 WeakPolarHBondContact O-CG 3.23Å; P40-L44 PolarHBondContact O-N 3.39Å; P40-F106 HydrophobicContact CB-CD1 3.55Å; P40-F106 HydrophobicContact CB-CE1 3.79Å; P40-F106 HydrophobicContact CB-CG 4.01Å; P40-F106 HydrophobicContact CB-CZ 4.4Å; P40-F106 HydrophobicContact CG-CD1 4Å
41	I	93.7	Very high	94	Very high	90 Å²	90	52.9 Å²	52.9	46%	0.462	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-44.4	178.5	-59.4	172.5	0	0	0	110.1	L38 L39 I43 L44 V45	L38-I41 HydrophobicContact CD2-CD1 4.23Å; L38-I41 WeakPolarHBondContact O-CB 3.08Å; L38-I41 PolarHBondContact O-N 3.31Å; L39-I41 VanDerWaalsContact C-N 3.28Å; L39-I41 PolarHBondContact O-N 2.05Å; I41-I43 VanDerWaalsContact C-N 3.28Å; I41-I43 PolarHBondContact O-N 3.44Å; I41-L44 PolarHBondContact O-N 2.71Å; I41-V45 WeakPolarHBondContact O-CG2 3.05Å; I41-V45 PolarHBondContact O-N 3.09Å
42	V	95.4	Very high	94.4	Very high	91 Å²	91	53.7 Å²	53.7	55%	0.552	30%	0.298	S	S	*	.	H	α-helix	trans	-59.4	-41.5	176.3	176.7	0	0	0	0	110.9	L38 L39 V45 G46	L38-V42 PolarHBondContact O-N 3.35Å; L38-V42 VanDerWaalsContact O-N 3.15Å; L39-V42 PolarHBondContact O-N 3.12Å; L39-V42 VanDerWaalsContact O-N 3.17Å; V42-V45 PolarHBondContact O-N 3.39Å; V42-G46 PolarHBondContact O-N 3.11Å
43	I	96.6	Very high	94.5	Very high	27 Å²	27	54.9 Å²	54.9	14%	0.138	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-46.8	176.1	-70.7	164.9	0	0	0	110.5	L39 P40 I41 V45 G46 F47 L66 F106 I107 F110	L39-I43 WeakPolarHBondContact O-CB 3.42Å; L39-I43 VanDerWaalsContact O-CG1 3.27Å; L39-I43 WeakPolarHBondContact O-CG1 3.13Å; L39-I43 PolarHBondContact O-N 3.29Å; P40-I43 PolarHBondContact O-N 3.07Å; I41-I43 VanDerWaalsContact C-N 3.28Å; I41-I43 PolarHBondContact O-N 3.44Å; I43-V45 PolarHBondContact O-N 2.91Å; I43-G46 CarbonylContact O-C 3.59Å; I43-G46 WeakPolarHBondContact O-CA 3.35Å; I43-G46 PolarHBondContact O-N 3.09Å; I43-G46 VanDerWaalsContact O-N 3.17Å; I43-F47 HydrophobicContact CG2-CD2 3.72Å; I43-F47 HydrophobicContact CG2-CE2 3.65Å; I43-F47 WeakPolarHBondContact O-CD2 3.24Å; I43-F47 PolarHBondContact O-N 3.26Å; I43-L66 HydrophobicContact CG2-CD1 4.36Å; I43-F106 HydrophobicContact CB-CE1 4.08Å; I43-F106 HydrophobicContact CB-CZ 4.41Å; I43-F106 HydrophobicContact CD1-CE1 4.22Å; I43-F106 HydrophobicContact CG2-CE1 3.91Å; I43-F106 HydrophobicContact CG2-CZ 4.05Å; I43-I107 HydrophobicContact CD1-CD1 3.63Å; I43-F110 HydrophobicContact CD1-CD1 4.01Å; I43-F110 HydrophobicContact CD1-CE1 4.18Å; I43-F110 HydrophobicContact CD1-CG 4.18Å; I43-F110 HydrophobicContact CG2-CD2 3.77Å; I43-F110 HydrophobicContact CG2-CE2 3.82Å; I43-F110 HydrophobicContact CG2-CG 4.41Å
44	L	96.2	Very high	94.6	Very high	59 Å²	59	57.9 Å²	57.9	31%	0.309	31%	0.311	S	S	.	.	H	α-helix	trans	-59.2	-47	177.7	-73.6	171.8	0	0	0	112.2	P40 I41 G46 F47 V48 F63 F106	P40-L44 WeakPolarHBondContact O-CG 3.23Å; P40-L44 PolarHBondContact O-N 3.39Å; I41-L44 PolarHBondContact O-N 2.71Å; L44-G46 VanDerWaalsContact C-N 3.29Å; L44-G46 PolarHBondContact O-N 2.95Å; L44-F47 PolarHBondContact O-N 3.31Å; L44-V48 WeakPolarHBondContact O-CG2 3.41Å; L44-V48 PolarHBondContact O-N 3.25Å; L44-F63 HydrophobicContact CD2-CD2 4.32Å; L44-F63 HydrophobicContact CD2-CE2 3.68Å; L44-F106 HydrophobicContact CD1-CE2 4.22Å; L44-F106 HydrophobicContact CD1-CZ 4.45Å; L44-F106 HydrophobicContact CD2-CE2 3.81Å; L44-F106 HydrophobicContact CD2-CZ 3.91Å; L44-F106 HydrophobicContact CG-CE2 3.92Å; L44-F106 HydrophobicContact CG-CZ 3.77Å
45	V	96.5	Very high	94.9	Very high	89 Å²	89	61.4 Å²	61.4	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-40.7	175.7	173.7	0	0	0	0	110.8	I41 V42 I43 F47 V48 T49	I41-V45 WeakPolarHBondContact O-CG2 3.05Å; I41-V45 PolarHBondContact O-N 3.09Å; V42-V45 PolarHBondContact O-N 3.39Å; I43-V45 PolarHBondContact O-N 2.91Å; V45-F47 PolarHBondContact O-N 3.32Å; V45-V48 PolarHBondContact O-N 2.91Å; V45-T49 WeakPolarHBondContact O-CB 3.09Å; V45-T49 PolarHBondContact O-N 3.17Å; V45-T49 PolarHBondContact O-OG1 2.91Å
46	G	97.2	Very high	95.1	Very high	30 Å²	30	56.2 Å²	56.2	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-59	-44.2	173.8	0	0	0	0	0	112.6	V42 I43 L44 T49 L50	V42-G46 PolarHBondContact O-N 3.11Å; I43-G46 CarbonylContact O-C 3.59Å; I43-G46 WeakPolarHBondContact O-CA 3.35Å; I43-G46 PolarHBondContact O-N 3.09Å; I43-G46 VanDerWaalsContact O-N 3.17Å; L44-G46 VanDerWaalsContact C-N 3.29Å; L44-G46 PolarHBondContact O-N 2.95Å; G46-T49 WeakPolarHBondContact O-CB 3.46Å; G46-T49 PolarHBondContact O-N 3.35Å; G46-L50 WeakPolarHBondContact O-CB 3.32Å; G46-L50 VanDerWaalsContact O-CG 3.31Å; G46-L50 WeakPolarHBondContact O-CG 3.29Å; G46-L50 PolarHBondContact O-N 2.87Å
47	F	97.3	Very high	95.3	Very high	14 Å²	14	55 Å²	55	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-47	175.1	-90.6	-77.2	0	0	0	112.7	I43 L44 V45 T49 L50 I51 T59 F62 F63 L66 F110	I43-F47 HydrophobicContact CG2-CD2 3.72Å; I43-F47 HydrophobicContact CG2-CE2 3.65Å; I43-F47 WeakPolarHBondContact O-CD2 3.24Å; I43-F47 PolarHBondContact O-N 3.26Å; L44-F47 PolarHBondContact O-N 3.31Å; V45-F47 PolarHBondContact O-N 3.32Å; F47-T49 PolarHBondContact O-N 2.86Å; F47-L50 PolarHBondContact O-N 3.43Å; F47-L50 VanDerWaalsContact O-N 3.16Å; F47-I51 WeakPolarHBondContact O-CB 3.45Å; F47-I51 VanDerWaalsContact O-CG1 3.25Å; F47-I51 WeakPolarHBondContact O-CG1 3.46Å; F47-I51 PolarHBondContact O-N 3.43Å; F47-T59 HydrophobicContact CD1-CG2 3.86Å; F47-T59 HydrophobicContact CE1-CG2 4.1Å; F47-F62 HydrophobicContact CE1-CB 3.96Å; F47-F62 AromaticContact CE1-CD1 3.81Å; F47-F62 HydrophobicContact CE1-CD1 3.81Å; F47-F62 HydrophobicContact CE1-CE1 4.44Å; F47-F62 AromaticContact CE1-CG 3.85Å; F47-F62 HydrophobicContact CE1-CG 3.85Å; F47-F62 HydrophobicContact CZ-CB 4.28Å; F47-F62 AromaticContact CZ-CD1 3.48Å; F47-F62 HydrophobicContact CZ-CD1 3.48Å; F47-F62 VanDerWaalsContact CZ-CD1 3.48Å; F47-F62 HydrophobicContact CZ-CD2 4.07Å; F47-F62 AromaticContact CZ-CE1 3.69Å; F47-F62 HydrophobicContact CZ-CE1 3.69Å; F47-F62 HydrophobicContact CZ-CE2 4.22Å; F47-F62 AromaticContact CZ-CG 3.67Å; F47-F62 HydrophobicContact CZ-CG 3.67Å; F47-F62 HydrophobicContact CZ-CZ 4.05Å; F47-F63 HydrophobicContact CB-CB 4.3Å; F47-F63 HydrophobicContact CB-CD2 3.41Å; F47-F63 VanDerWaalsContact CB-CD2 3.41Å; F47-F63 HydrophobicContact CB-CE2 4.04Å; F47-F63 HydrophobicContact CB-CG 4.15Å; F47-F63 HydrophobicContact CD1-CB 3.84Å; F47-F63 HydrophobicContact CD1-CD2 4.39Å; F47-F63 HydrophobicContact CD2-CD2 4.48Å; F47-F63 HydrophobicContact CE1-CB 4.47Å; F47-F63 HydrophobicContact CG-CB 4.19Å; F47-F63 AromaticContact CG-CD2 3.88Å; F47-F63 HydrophobicContact CG-CD2 3.88Å; F47-F63 HydrophobicContact CG-CG 4.48Å; F47-L66 HydrophobicContact CD2-CD1 3.57Å; F47-L66 HydrophobicContact CE2-CD1 3.3Å; F47-L66 HydrophobicContact CG-CD1 4.39Å; F47-L66 HydrophobicContact CZ-CD1 3.93Å; F47-F110 AromaticContact CE2-CD2 3.93Å; F47-F110 HydrophobicContact CE2-CD2 3.93Å; F47-F110 AromaticContact CE2-CE2 3.71Å; F47-F110 HydrophobicContact CE2-CE2 3.71Å; F47-F110 HydrophobicContact CZ-CD2 4.38Å; F47-F110 HydrophobicContact CZ-CE2 4.09Å
48	V	97.1	Very high	95.4	Very high	76 Å²	76	56 Å²	56	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-57.3	-44.3	177.2	172.6	0	0	0	0	110	L44 V45 I51 V52 F63	L44-V48 WeakPolarHBondContact O-CG2 3.41Å; L44-V48 PolarHBondContact O-N 3.25Å; V45-V48 PolarHBondContact O-N 2.91Å; V48-I51 PolarHBondContact O-N 3Å; V48-V52 VanDerWaalsContact O-CG2 3.3Å; V48-V52 WeakPolarHBondContact O-CG2 3.31Å; V48-V52 PolarHBondContact O-N 2.8Å; V48-F63 HydrophobicContact CG2-CE2 4.34Å; V48-F63 HydrophobicContact CG2-CZ 4.21Å
49	T	97	Very high	95.5	Very high	66 Å²	66	56.5 Å²	56.5	41%	0.405	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-50.5	175.8	-56.3	0	0	0	0	111.1	V45 G46 F47 I51 V52 F53	V45-T49 WeakPolarHBondContact O-CB 3.09Å; V45-T49 PolarHBondContact O-N 3.17Å; V45-T49 PolarHBondContact O-OG1 2.91Å; G46-T49 WeakPolarHBondContact O-CB 3.46Å; G46-T49 PolarHBondContact O-N 3.35Å; F47-T49 PolarHBondContact O-N 2.86Å; T49-I51 VanDerWaalsContact C-N 3.34Å; T49-I51 PolarHBondContact O-N 3.12Å; T49-V52 PolarHBondContact O-N 2.9Å; T49-F53 HydrophobicContact CG2-CD2 3.68Å; T49-F53 HydrophobicContact CG2-CE2 3.84Å; T49-F53 WeakPolarHBondContact O-CD2 3.48Å; T49-F53 PolarHBondContact O-N 2.92Å
50	L	95.1	Very high	95.7	Very high	82 Å²	82	56.7 Å²	56.7	43%	0.429	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-39	178.3	-72	172.8	0	0	0	112.4	G46 F47 F53 K54 R55 T59	G46-L50 WeakPolarHBondContact O-CB 3.32Å; G46-L50 VanDerWaalsContact O-CG 3.31Å; G46-L50 WeakPolarHBondContact O-CG 3.29Å; G46-L50 PolarHBondContact O-N 2.87Å; F47-L50 PolarHBondContact O-N 3.43Å; F47-L50 VanDerWaalsContact O-N 3.16Å; L50-F53 PolarHBondContact O-N 3.42Å; L50-K54 HydrophobicContact CD2-CG 4.27Å; L50-K54 WeakPolarHBondContact O-CA 3.42Å; L50-K54 VanDerWaalsContact O-CB 3.23Å; L50-K54 WeakPolarHBondContact O-CB 3.42Å; L50-K54 PolarHBondContact O-N 3.49Å; L50-R55 PolarHBondContact O-N 3.02Å; L50-T59 HydrophobicContact CB-CG2 3.95Å
51	I	96.4	Very high	95.8	Very high	38 Å²	38	56.6 Å²	56.6	20%	0.195	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-45.2	176.3	-70.6	167.6	0	0	0	109.8	F47 V48 T49 R55 T59 I60 F63	F47-I51 WeakPolarHBondContact O-CB 3.45Å; F47-I51 VanDerWaalsContact O-CG1 3.25Å; F47-I51 WeakPolarHBondContact O-CG1 3.46Å; F47-I51 PolarHBondContact O-N 3.43Å; V48-I51 PolarHBondContact O-N 3Å; T49-I51 VanDerWaalsContact C-N 3.34Å; T49-I51 PolarHBondContact O-N 3.12Å; I51-R55 WeakPolarHBondContact O-CA 3.47Å; I51-R55 WeakPolarHBondContact O-CG 3.32Å; I51-R55 PolarHBondContact O-N 3.41Å; I51-T59 HydrophobicContact CG1-CG2 4.15Å; I51-I60 HydrophobicContact CD1-CG1 4.41Å; I51-I60 HydrophobicContact CG1-CG1 3.96Å; I51-I60 HydrophobicContact CG2-CG1 4.05Å; I51-F63 HydrophobicContact CD1-CB 3.68Å; I51-F63 HydrophobicContact CD1-CD1 3.67Å; I51-F63 HydrophobicContact CD1-CD2 4.44Å; I51-F63 HydrophobicContact CD1-CE1 4.43Å; I51-F63 HydrophobicContact CD1-CG 3.68Å
52	V	95.8	Very high	96	Very high	86 Å²	86	53.1 Å²	53.1	52%	0.521	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-43.8	179.2	170.4	0	0	0	0	111.8	V48 T49 R55	V48-V52 VanDerWaalsContact O-CG2 3.3Å; V48-V52 WeakPolarHBondContact O-CG2 3.31Å; V48-V52 PolarHBondContact O-N 2.8Å; T49-V52 PolarHBondContact O-N 2.9Å; V52-R55 WeakPolarHBondContact O-CG 3.35Å; V52-R55 PolarHBondContact O-NH1 3.05Å
53	F	94	Very high	96.2	Very high	145 Å²	145	51.1 Å²	51.1	64%	0.636	27%	0.271	S	S	*	.	H	α-helix	trans	-89.5	-39.5	-173	-73.6	-70.9	0	0	0	114.6	T49 L50 R55	T49-F53 HydrophobicContact CG2-CD2 3.68Å; T49-F53 HydrophobicContact CG2-CE2 3.84Å; T49-F53 WeakPolarHBondContact O-CD2 3.48Å; T49-F53 PolarHBondContact O-N 2.92Å; L50-F53 PolarHBondContact O-N 3.42Å; F53-R55 PolarHBondContact O-NH1 2.98Å
54	K	92.9	Very high	96.2	Very high	78 Å²	78	51.1 Å²	51.1	34%	0.339	28%	0.278	S	S	.	.	H	α-helix	trans	-98	-32.7	-175.8	-64.8	-70.8	-172.3	175.9	0	112.7	L50 E56 R206 E218	L50-K54 HydrophobicContact CD2-CG 4.27Å; L50-K54 WeakPolarHBondContact O-CA 3.42Å; L50-K54 VanDerWaalsContact O-CB 3.23Å; L50-K54 WeakPolarHBondContact O-CB 3.42Å; L50-K54 PolarHBondContact O-N 3.49Å; K54-E56 HydrophobicContact CB-CG 3.99Å; K54-E56 PolarHBondContact O-N 3.3Å; K54-R206 VanDerWaalsContact O-CZ 3.32Å; K54-R206 PolarHBondContact O-NE 3.46Å; K54-R206 PolarHBondContact O-NH2 2.94Å; K54-E218 IonicContact NZ-OE1 2.74Å; K54-E218 PolarHBondContact NZ-OE1 3.02Å; K54-E218 IonicContact NZ-OE2 3.31Å; K54-E218 PolarHBondContact NZ-OE2 3.35Å
55	R	94.7	Very high	96.4	Very high	74 Å²	74	48.3 Å²	48.3	28%	0.279	26%	0.263	S	S	.	.			trans	52.8	40.2	174.4	-61.2	174.8	-70.4	-87.9	0.4	113.3	L50 I51 V52 F53 F203 L204 V205 R206	L50-R55 PolarHBondContact O-N 3.02Å; I51-R55 WeakPolarHBondContact O-CA 3.47Å; I51-R55 WeakPolarHBondContact O-CG 3.32Å; I51-R55 PolarHBondContact O-N 3.41Å; V52-R55 WeakPolarHBondContact O-CG 3.35Å; V52-R55 PolarHBondContact O-NH1 3.05Å; F53-R55 PolarHBondContact O-NH1 2.98Å; R55-F203 WeakPolarHBondContact CD-O 3.49Å; R55-F203 PolarHBondContact NE-O 3.31Å; R55-L204 PolarHBondContact NE-O 3.05Å; R55-V205 HydrophobicContact CB-CG2 4.2Å; R55-R206 PolarHBondContact O-N 3.47Å
56	E	94.8	Very high	96.4	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.047	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-91.6	131.5	-176.4	-68.8	-60.5	146.4	0	0	111.4	K54 H58 T59 I60 R206 T208	K54-E56 HydrophobicContact CB-CG 3.99Å; K54-E56 PolarHBondContact O-N 3.3Å; E56-H58 VanDerWaalsContact C-N 3.32Å; E56-H58 PolarHBondContact O-N 3.07Å; E56-T59 WeakPolarHBondContact O-CB 3.45Å; E56-T59 PolarHBondContact O-N 3.38Å; E56-I60 WeakPolarHBondContact O-CG1 3.46Å; E56-I60 PolarHBondContact O-N 2.98Å; E56-R206 WeakPolarHBondContact OE1-CB 3.43Å; E56-R206 IonicContact OE1-CZ 3.15Å; E56-R206 IonicContact OE1-NE 3.17Å; E56-R206 PolarHBondContact OE1-NE 3.01Å; E56-R206 IonicContact OE1-NH1 3.65Å; E56-R206 IonicContact OE1-NH2 2.64Å; E56-R206 PolarHBondContact OE1-NH2 3.44Å; E56-T208 VanDerWaalsContact CD-CG2 3.47Å; E56-T208 WeakPolarHBondContact OE1-CG2 3.26Å; E56-T208 VanDerWaalsContact OE2-CB 3.29Å; E56-T208 WeakPolarHBondContact OE2-CB 3.34Å; E56-T208 WeakPolarHBondContact OE2-CG2 3.29Å; E56-T208 PolarHBondContact OE2-OG1 2.91Å
57	L	96	Very high	96.5	Very high	10 Å²	10	46.5 Å²	46.5	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-59.1	-38.7	-178.9	-74.5	172.3	0	0	0	113.4	T59 I60 S61 F191 M194 A195 V205 R206 D207	L57-T59 PolarHBondContact O-N 3.02Å; L57-I60 PolarHBondContact O-N 3.27Å; L57-S61 WeakPolarHBondContact O-CB 3.05Å; L57-S61 PolarHBondContact O-N 3.09Å; L57-F191 HydrophobicContact CB-CD1 3.93Å; L57-F191 HydrophobicContact CB-CD2 3.85Å; L57-F191 HydrophobicContact CB-CE1 3.96Å; L57-F191 HydrophobicContact CB-CE2 3.93Å; L57-F191 HydrophobicContact CB-CG 3.87Å; L57-F191 HydrophobicContact CB-CZ 3.98Å; L57-F191 HydrophobicContact CD1-CB 3.56Å; L57-F191 HydrophobicContact CD1-CD1 3.89Å; L57-F191 HydrophobicContact CD1-CD2 4.38Å; L57-F191 HydrophobicContact CD1-CG 3.71Å; L57-F191 WeakPolarHBondContact CD1-O 3.31Å; L57-F191 HydrophobicContact CG-CD1 4.36Å; L57-F191 HydrophobicContact CG-CG 4.39Å; L57-M194 HydrophobicContact CD1-CB 4.4Å; L57-M194 HydrophobicContact CD2-CE 4.36Å; L57-A195 HydrophobicContact CD1-CB 4.12Å; L57-V205 HydrophobicContact CD1-CG1 4.42Å; L57-V205 HydrophobicContact CD2-CG1 3.58Å; L57-V205 HydrophobicContact CG-CG1 3.66Å; L57-R206 PolarHBondContact N-O 3.44Å; L57-D207 HydrophobicContact CD1-CB 4.09Å
58	H	94.9	Very high	96.5	Very high	23 Å²	23	49.5 Å²	49.5	11%	0.106	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-38.7	174.6	-83.8	-65.9	0	0	0	112.4	E56 F62 R121 T188 F191 S209	E56-H58 VanDerWaalsContact C-N 3.32Å; E56-H58 PolarHBondContact O-N 3.07Å; H58-F62 WeakPolarHBondContact O-CB 3.3Å; H58-F62 PolarHBondContact O-N 3.45Å; H58-R121 PolarHBondContact NE2-NH2 3.14Å; H58-T188 PolarHBondContact CE1-OG1 2.99Å; H58-F191 AromaticContact CD2-CE2 3.99Å; H58-F191 AromaticContact CE1-CE2 3.69Å; H58-F191 AromaticContact CG-CE2 3.81Å; H58-F191 AromaticContact ND1-CE2 3.63Å; H58-F191 AromaticContact NE2-CE2 3.96Å; H58-S209 PolarHBondContact NE2-OG 2.99Å
59	T	95.9	Very high	96.6	Very high	32 Å²	32	45.9 Å²	45.9	20%	0.196	24%	0.24	C	C	.	.	H	α-helix	trans	-68.8	-42.2	176.7	-57.8	0	0	0	0	111.2	F47 L50 I51 E56 L57 F62 F63	F47-T59 HydrophobicContact CD1-CG2 3.86Å; F47-T59 HydrophobicContact CE1-CG2 4.1Å; L50-T59 HydrophobicContact CB-CG2 3.95Å; I51-T59 HydrophobicContact CG1-CG2 4.15Å; E56-T59 WeakPolarHBondContact O-CB 3.45Å; E56-T59 PolarHBondContact O-N 3.38Å; L57-T59 PolarHBondContact O-N 3.02Å; T59-F62 PolarHBondContact O-N 3.29Å; T59-F63 PolarHBondContact O-N 2.85Å
60	I	97.3	Very high	96.5	Very high	59 Å²	59	46.5 Å²	46.5	30%	0.303	24%	0.238	S	C	.	.	H	α-helix	trans	-62.1	-44.6	175.4	-65.9	165.1	0	0	0	110.3	I51 E56 L57 F63 G64 V205	I51-I60 HydrophobicContact CD1-CG1 4.41Å; I51-I60 HydrophobicContact CG1-CG1 3.96Å; I51-I60 HydrophobicContact CG2-CG1 4.05Å; E56-I60 WeakPolarHBondContact O-CG1 3.46Å; E56-I60 PolarHBondContact O-N 2.98Å; L57-I60 PolarHBondContact O-N 3.27Å; I60-F63 PolarHBondContact O-N 3.15Å; I60-G64 PolarHBondContact O-N 3.32Å; I60-V205 HydrophobicContact CD1-CG1 4.37Å; I60-V205 HydrophobicContact CD1-CG2 4.41Å
61	S	97.7	Very high	96.6	Very high	10 Å²	10	44.5 Å²	44.5	7%	0.07	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-46.1	176.2	-176	0	0	0	0	111.9	L57 F63 G64 G65 W179 T183 L187	L57-S61 WeakPolarHBondContact O-CB 3.05Å; L57-S61 PolarHBondContact O-N 3.09Å; S61-F63 VanDerWaalsContact C-N 3.33Å; S61-F63 PolarHBondContact O-N 2.93Å; S61-G64 PolarHBondContact O-N 3.23Å; S61-G64 VanDerWaalsContact O-N 3.13Å; S61-G65 PolarHBondContact O-N 2.86Å; S61-W179 PolarHBondContact O-NE1 3.2Å; S61-T183 WeakPolarHBondContact OG-CG2 3.31Å; S61-T183 PolarHBondContact OG-OG1 3.43Å; S61-L187 VanDerWaalsContact OG-CD1 3.22Å; S61-L187 WeakPolarHBondContact OG-CD1 3.29Å
62	F	97.9	Very high	96.7	Very high	16 Å²	16	44.7 Å²	44.7	7%	0.07	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-43.4	178.8	-171.3	179.9	0	0	0	111.1	F47 H58 T59 G64 G65 L66 F109 F110 Y113 F114	F47-F62 HydrophobicContact CE1-CB 3.96Å; F47-F62 AromaticContact CE1-CD1 3.81Å; F47-F62 HydrophobicContact CE1-CD1 3.81Å; F47-F62 HydrophobicContact CE1-CE1 4.44Å; F47-F62 AromaticContact CE1-CG 3.85Å; F47-F62 HydrophobicContact CE1-CG 3.85Å; F47-F62 HydrophobicContact CZ-CB 4.28Å; F47-F62 AromaticContact CZ-CD1 3.48Å; F47-F62 HydrophobicContact CZ-CD1 3.48Å; F47-F62 VanDerWaalsContact CZ-CD1 3.48Å; F47-F62 HydrophobicContact CZ-CD2 4.07Å; F47-F62 AromaticContact CZ-CE1 3.69Å; F47-F62 HydrophobicContact CZ-CE1 3.69Å; F47-F62 HydrophobicContact CZ-CE2 4.22Å; F47-F62 AromaticContact CZ-CG 3.67Å; F47-F62 HydrophobicContact CZ-CG 3.67Å; F47-F62 HydrophobicContact CZ-CZ 4.05Å; H58-F62 WeakPolarHBondContact O-CB 3.3Å; H58-F62 PolarHBondContact O-N 3.45Å; T59-F62 PolarHBondContact O-N 3.29Å; F62-G64 PolarHBondContact O-N 2.8Å; F62-G65 PolarHBondContact O-N 2.88Å; F62-G65 VanDerWaalsContact O-N 3.16Å; F62-L66 HydrophobicContact CD2-CG 4.47Å; F62-L66 HydrophobicContact CE2-CG 4.41Å; F62-L66 PolarHBondContact O-N 3.47Å; F62-F109 AromaticContact CD2-CE1 3.8Å; F62-F109 HydrophobicContact CD2-CE1 3.8Å; F62-F109 HydrophobicContact CD2-CZ 4.49Å; F62-F109 HydrophobicContact CE2-CD1 4.14Å; F62-F109 AromaticContact CE2-CE1 3.6Å; F62-F109 HydrophobicContact CE2-CE1 3.6Å; F62-F110 HydrophobicContact CE1-CD2 4.29Å; F62-F110 HydrophobicContact CE1-CE2 4.22Å; F62-F110 HydrophobicContact CE2-CD2 4.15Å; F62-F110 AromaticContact CZ-CD2 3.55Å; F62-F110 HydrophobicContact CZ-CD2 3.55Å; F62-F110 AromaticContact CZ-CE2 3.92Å; F62-F110 HydrophobicContact CZ-CE2 3.92Å; F62-F110 HydrophobicContact CZ-CG 4.32Å; F62-Y113 HydrophobicContact CB-CE1 3.89Å; F62-Y113 AromaticContact CD1-CD1 3.49Å; F62-Y113 HydrophobicContact CD1-CD1 3.49Å; F62-Y113 VanDerWaalsContact CD1-CD1 3.49Å; F62-Y113 AromaticContact CD1-CE1 3.41Å; F62-Y113 HydrophobicContact CD1-CE1 3.41Å; F62-Y113 VanDerWaalsContact CD1-CE1 3.41Å; F62-Y113 HydrophobicContact CD1-CG 4.47Å; F62-Y113 AromaticContact CD2-CD1 3.55Å; F62-Y113 HydrophobicContact CD2-CD1 3.55Å; F62-Y113 HydrophobicContact CD2-CD2 4.12Å; F62-Y113 AromaticContact CD2-CE1 3.78Å; F62-Y113 HydrophobicContact CD2-CE1 3.78Å; F62-Y113 HydrophobicContact CD2-CE2 4.32Å; F62-Y113 AromaticContact CD2-CG 3.74Å; F62-Y113 HydrophobicContact CD2-CG 3.74Å; F62-Y113 AromaticContact CE1-CD1 3.37Å; F62-Y113 HydrophobicContact CE1-CD1 3.37Å; F62-Y113 AromaticContact CE1-CE1 3.81Å; F62-Y113 HydrophobicContact CE1-CE1 3.81Å; F62-Y113 HydrophobicContact CE1-CG 4.25Å; F62-Y113 AromaticContact CE2-CD1 3.46Å; F62-Y113 HydrophobicContact CE2-CD1 3.46Å; F62-Y113 VanDerWaalsContact CE2-CD1 3.46Å; F62-Y113 HydrophobicContact CE2-CD2 4.26Å; F62-Y113 HydrophobicContact CE2-CE1 4.17Å; F62-Y113 AromaticContact CE2-CG 3.52Å; F62-Y113 HydrophobicContact CE2-CG 3.52Å; F62-Y113 AromaticContact CG-CD1 3.61Å; F62-Y113 HydrophobicContact CG-CD1 3.61Å; F62-Y113 AromaticContact CG-CE1 3.42Å; F62-Y113 HydrophobicContact CG-CE1 3.42Å; F62-Y113 VanDerWaalsContact CG-CE1 3.42Å; F62-Y113 HydrophobicContact CG-CG 4.26Å; F62-Y113 AromaticContact CG-CZ 3.92Å; F62-Y113 AromaticContact CZ-CD1 3.37Å; F62-Y113 HydrophobicContact CZ-CD1 3.37Å; F62-Y113 HydrophobicContact CZ-CE1 4.19Å; F62-Y113 AromaticContact CZ-CG 3.8Å; F62-Y113 HydrophobicContact CZ-CG 3.8Å; F62-F114 HydrophobicContact CE1-CD2 4.19Å
63	F	98.3	Very high	96.7	Very high	49 Å²	49	40.7 Å²	40.7	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-42.6	172.7	-178	-107.5	0	0	0	112.7	L44 F47 V48 I51 T59 I60 S61 G65 L66 V67	L44-F63 HydrophobicContact CD2-CD2 4.32Å; L44-F63 HydrophobicContact CD2-CE2 3.68Å; F47-F63 HydrophobicContact CB-CB 4.3Å; F47-F63 HydrophobicContact CB-CD2 3.41Å; F47-F63 VanDerWaalsContact CB-CD2 3.41Å; F47-F63 HydrophobicContact CB-CE2 4.04Å; F47-F63 HydrophobicContact CB-CG 4.15Å; F47-F63 HydrophobicContact CD1-CB 3.84Å; F47-F63 HydrophobicContact CD1-CD2 4.39Å; F47-F63 HydrophobicContact CD2-CD2 4.48Å; F47-F63 HydrophobicContact CE1-CB 4.47Å; F47-F63 HydrophobicContact CG-CB 4.19Å; F47-F63 AromaticContact CG-CD2 3.88Å; F47-F63 HydrophobicContact CG-CD2 3.88Å; F47-F63 HydrophobicContact CG-CG 4.48Å; V48-F63 HydrophobicContact CG2-CE2 4.34Å; V48-F63 HydrophobicContact CG2-CZ 4.21Å; I51-F63 HydrophobicContact CD1-CB 3.68Å; I51-F63 HydrophobicContact CD1-CD1 3.67Å; I51-F63 HydrophobicContact CD1-CD2 4.44Å; I51-F63 HydrophobicContact CD1-CE1 4.43Å; I51-F63 HydrophobicContact CD1-CG 3.68Å; T59-F63 PolarHBondContact O-N 2.85Å; I60-F63 PolarHBondContact O-N 3.15Å; S61-F63 VanDerWaalsContact C-N 3.33Å; S61-F63 PolarHBondContact O-N 2.93Å; F63-G65 PolarHBondContact O-N 3.42Å; F63-L66 WeakPolarHBondContact O-CB 3.35Å; F63-L66 PolarHBondContact O-N 3Å; F63-L66 VanDerWaalsContact O-N 3.09Å; F63-V67 HydrophobicContact CD1-CG2 4.29Å; F63-V67 HydrophobicContact CE1-CG2 3.89Å; F63-V67 HydrophobicContact CE2-CG2 4.45Å; F63-V67 HydrophobicContact CZ-CG2 3.99Å; F63-V67 WeakPolarHBondContact O-CG2 3.38Å; F63-V67 PolarHBondContact O-N 3.41Å
64	G	98.3	Very high	96.8	Very high	28 Å²	28	41.7 Å²	41.7	29%	0.289	22%	0.216	S	C	.	.	H	α-helix	trans	-57	-39.1	173.7	0	0	0	0	0	112.6	I60 S61 F62 V67 L68	I60-G64 PolarHBondContact O-N 3.32Å; S61-G64 PolarHBondContact O-N 3.23Å; S61-G64 VanDerWaalsContact O-N 3.13Å; F62-G64 PolarHBondContact O-N 2.8Å; G64-V67 PolarHBondContact O-N 2.88Å; G64-L68 WeakPolarHBondContact O-CB 3.35Å; G64-L68 PolarHBondContact O-N 2.75Å
65	G	98.4	Very high	97	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-38.9	174	0	0	0	0	0	113.7	S61 F62 F63 L68 N69 W179	S61-G65 PolarHBondContact O-N 2.86Å; F62-G65 PolarHBondContact O-N 2.88Å; F62-G65 VanDerWaalsContact O-N 3.16Å; F63-G65 PolarHBondContact O-N 3.42Å; G65-L68 PolarHBondContact O-N 2.96Å; G65-N69 VanDerWaalsContact O-CB 3.24Å; G65-N69 WeakPolarHBondContact O-CB 3.27Å; G65-N69 PolarHBondContact O-N 2.95Å; G65-W179 VanDerWaalsContact CA-NE1 3.29Å
66	L	98.2	Very high	97	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-43.6	173.5	-72.4	169.4	0	0	0	111.6	I43 F47 F62 F63 N69 E70 F106 F109 F110	I43-L66 HydrophobicContact CG2-CD1 4.36Å; F47-L66 HydrophobicContact CD2-CD1 3.57Å; F47-L66 HydrophobicContact CE2-CD1 3.3Å; F47-L66 HydrophobicContact CG-CD1 4.39Å; F47-L66 HydrophobicContact CZ-CD1 3.93Å; F62-L66 HydrophobicContact CD2-CG 4.47Å; F62-L66 HydrophobicContact CE2-CG 4.41Å; F62-L66 PolarHBondContact O-N 3.47Å; F63-L66 WeakPolarHBondContact O-CB 3.35Å; F63-L66 PolarHBondContact O-N 3Å; F63-L66 VanDerWaalsContact O-N 3.09Å; L66-N69 PolarHBondContact O-N 3.22Å; L66-E70 PolarHBondContact O-N 2.85Å; L66-F106 HydrophobicContact CB-CE2 4.12Å; L66-F106 HydrophobicContact CD1-CE2 4.43Å; L66-F106 HydrophobicContact CD1-CZ 4.01Å; L66-F106 HydrophobicContact CD2-CD1 4.47Å; L66-F106 HydrophobicContact CD2-CD2 4.15Å; L66-F106 HydrophobicContact CD2-CE1 4.07Å; L66-F106 HydrophobicContact CD2-CE2 3.73Å; L66-F106 HydrophobicContact CD2-CZ 3.69Å; L66-F106 HydrophobicContact CG-CE2 4.33Å; L66-F106 HydrophobicContact CG-CZ 4.31Å; L66-F109 HydrophobicContact CD2-CD1 3.3Å; L66-F109 HydrophobicContact CD2-CE1 3.65Å; L66-F109 HydrophobicContact CD2-CG 4.33Å; L66-F109 HydrophobicContact CG-CD1 3.98Å; L66-F109 HydrophobicContact CG-CE1 3.78Å; L66-F110 HydrophobicContact CD2-CB 4.3Å
67	V	98.1	Very high	96.9	Very high	79 Å²	79	41.2 Å²	41.2	48%	0.479	22%	0.221	S	C	.	.	H	α-helix	trans	-64.2	-44.5	177.3	174.3	0	0	0	0	110.9	F63 G64 N69 E70 G71	F63-V67 HydrophobicContact CD1-CG2 4.29Å; F63-V67 HydrophobicContact CE1-CG2 3.89Å; F63-V67 HydrophobicContact CE2-CG2 4.45Å; F63-V67 HydrophobicContact CZ-CG2 3.99Å; F63-V67 WeakPolarHBondContact O-CG2 3.38Å; F63-V67 PolarHBondContact O-N 3.41Å; G64-V67 PolarHBondContact O-N 2.88Å; V67-N69 VanDerWaalsContact C-N 3.34Å; V67-N69 PolarHBondContact O-N 3.46Å; V67-E70 PolarHBondContact O-N 3.31Å; V67-G71 PolarHBondContact O-N 3.39Å
68	L	98.2	Very high	96.7	Very high	77 Å²	77	43.5 Å²	43.5	40%	0.403	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-44	175.2	-178.5	149.1	0	0	0	111.3	G64 G65 E70 G71 V72 I175 W179	G64-L68 WeakPolarHBondContact O-CB 3.35Å; G64-L68 PolarHBondContact O-N 2.75Å; G65-L68 PolarHBondContact O-N 2.96Å; L68-E70 VanDerWaalsContact C-N 3.31Å; L68-E70 PolarHBondContact O-N 3.47Å; L68-G71 WeakPolarHBondContact O-CA 3.18Å; L68-G71 PolarHBondContact O-N 3.28Å; L68-G71 VanDerWaalsContact O-N 3.12Å; L68-V72 HydrophobicContact CD2-CG2 3.92Å; L68-V72 WeakPolarHBondContact O-CG2 3.4Å; L68-V72 PolarHBondContact O-N 2.96Å; L68-I175 HydrophobicContact CD2-CG2 4.09Å; L68-W179 HydrophobicContact CD1-CE3 4.28Å; L68-W179 HydrophobicContact CD1-CH2 4.28Å; L68-W179 HydrophobicContact CD1-CZ3 3.65Å
69	N	98.1	Very high	96.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-40.7	178	-178	56.1	0	0	0	111.9	G65 L66 V67 V72 N73 Q105 F109 I175	G65-N69 VanDerWaalsContact O-CB 3.24Å; G65-N69 WeakPolarHBondContact O-CB 3.27Å; G65-N69 PolarHBondContact O-N 2.95Å; L66-N69 PolarHBondContact O-N 3.22Å; V67-N69 VanDerWaalsContact C-N 3.34Å; V67-N69 PolarHBondContact O-N 3.46Å; N69-V72 PolarHBondContact O-N 3.49Å; N69-N73 PolarHBondContact O-N 3.44Å; N69-Q105 PolarHBondContact ND2-O 2.81Å; N69-Q105 VanDerWaalsContact ND2-O 3.17Å; N69-Q105 PolarHBondContact O-NE2 2.81Å; N69-Q105 WeakPolarHBondContact OD1-CG 3.44Å; N69-Q105 PolarHBondContact OD1-NE2 3.37Å; N69-F109 HydrophobicContact CB-CD2 3.94Å; N69-F109 HydrophobicContact CB-CE2 4.38Å; N69-F109 HydrophobicContact CB-CG 4.23Å; N69-I175 HydrophobicContact CB-CG2 4.25Å; N69-I175 VanDerWaalsContact OD1-CD1 3.32Å; N69-I175 WeakPolarHBondContact OD1-CD1 3.25Å
70	E	96.3	Very high	96.6	Very high	79 Å²	79	50.6 Å²	50.6	37%	0.369	27%	0.269	S	S	.	.	H	α-helix	trans	-65.9	-40.6	173.9	-168.4	61.9	-154.5	0	0	111.7	L66 V67 L68 V72 N73 W74	L66-E70 PolarHBondContact O-N 2.85Å; V67-E70 PolarHBondContact O-N 3.31Å; L68-E70 VanDerWaalsContact C-N 3.31Å; L68-E70 PolarHBondContact O-N 3.47Å; E70-V72 VanDerWaalsContact C-N 3.32Å; E70-V72 PolarHBondContact O-N 2.92Å; E70-N73 WeakPolarHBondContact O-CB 3.3Å; E70-N73 PolarHBondContact O-N 3.49Å; E70-W74 PolarHBondContact O-N 2.88Å
71	G	97.1	Very high	96.4	Very high	40 Å²	40	54.9 Å²	54.9	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-59.1	-41.8	173.1	0	0	0	0	0	112.7	V67 L68 W74 L75	V67-G71 PolarHBondContact O-N 3.39Å; L68-G71 WeakPolarHBondContact O-CA 3.18Å; L68-G71 PolarHBondContact O-N 3.28Å; L68-G71 VanDerWaalsContact O-N 3.12Å; G71-W74 PolarHBondContact O-N 3.47Å; G71-L75 WeakPolarHBondContact O-CB 3.39Å; G71-L75 PolarHBondContact O-N 2.9Å
72	V	97.6	Very high	96.1	Very high	43 Å²	43	57.4 Å²	57.4	26%	0.261	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-41.2	174.1	174.9	0	0	0	0	111	L68 N69 E70 W74 L75 L76 I175	L68-V72 HydrophobicContact CD2-CG2 3.92Å; L68-V72 WeakPolarHBondContact O-CG2 3.4Å; L68-V72 PolarHBondContact O-N 2.96Å; N69-V72 PolarHBondContact O-N 3.49Å; E70-V72 VanDerWaalsContact C-N 3.32Å; E70-V72 PolarHBondContact O-N 2.92Å; V72-W74 VanDerWaalsContact C-N 3.34Å; V72-W74 PolarHBondContact O-N 2.88Å; V72-L75 PolarHBondContact O-N 3.43Å; V72-L76 HydrophobicContact CG1-CD1 3.83Å; V72-L76 HydrophobicContact CG1-CG 4.13Å; V72-L76 WeakPolarHBondContact O-CB 3.24Å; V72-L76 VanDerWaalsContact O-CG 3.29Å; V72-L76 WeakPolarHBondContact O-CG 3.24Å; V72-L76 PolarHBondContact O-N 2.71Å; V72-I175 HydrophobicContact CB-CD1 4.03Å; V72-I175 HydrophobicContact CG1-CD1 3.71Å; V72-I175 HydrophobicContact CG2-CD1 4.37Å
73	N	96.9	Very high	95.7	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-58.1	-48.3	174.8	-175.8	-93.5	0	0	0	111.3	N69 E70 L75 L76 K77 P100 S102 Q105	N69-N73 PolarHBondContact O-N 3.44Å; E70-N73 WeakPolarHBondContact O-CB 3.3Å; E70-N73 PolarHBondContact O-N 3.49Å; N73-L75 VanDerWaalsContact C-N 3.34Å; N73-L75 PolarHBondContact O-N 3.16Å; N73-L76 PolarHBondContact O-N 3.35Å; N73-K77 WeakPolarHBondContact O-CG 3.19Å; N73-K77 PolarHBondContact O-N 3.34Å; N73-K77 WeakPolarHBondContact OD1-CD 3.23Å; N73-K77 WeakPolarHBondContact OD1-CE 3.48Å; N73-K77 PolarHBondContact OD1-NZ 3.09Å; N73-K77 VanDerWaalsContact OD1-NZ 3.15Å; N73-P100 PolarHBondContact ND2-O 3.05Å; N73-S102 WeakPolarHBondContact ND2-CA 3.42Å; N73-S102 WeakPolarHBondContact OD1-CB 3.42Å; N73-Q105 PolarHBondContact ND2-OE1 3.48Å
74	W	95.2	Very high	95.3	Very high	166 Å²	166	58.7 Å²	58.7	63%	0.629	30%	0.304	S	S	*	.	H	α-helix	trans	-58.5	-46.3	177.4	176.6	87	0	0	0	111.2	E70 G71 V72 K77 N78	E70-W74 PolarHBondContact O-N 2.88Å; G71-W74 PolarHBondContact O-N 3.47Å; V72-W74 VanDerWaalsContact C-N 3.34Å; V72-W74 PolarHBondContact O-N 2.88Å; W74-K77 PolarHBondContact O-N 3.48Å; W74-N78 VanDerWaalsContact CE2-ND2 3.31Å; W74-N78 PolarHBondContact NE1-ND2 3.14Å; W74-N78 PolarHBondContact O-N 2.84Å; W74-N78 PolarHBondContact O-ND2 3.17Å
75	L	96.4	Very high	94.7	Very high	90 Å²	90	59.1 Å²	59.1	47%	0.471	30%	0.302	S	S	.	.	H	α-helix	trans	-60	-49.2	177.2	178.9	61.7	0	0	0	111.6	G71 V72 N73 K77 N78 I79	G71-L75 WeakPolarHBondContact O-CB 3.39Å; G71-L75 PolarHBondContact O-N 2.9Å; V72-L75 PolarHBondContact O-N 3.43Å; N73-L75 VanDerWaalsContact C-N 3.34Å; N73-L75 PolarHBondContact O-N 3.16Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 2.9Å; L75-N78 PolarHBondContact O-N 3.32Å; L75-N78 VanDerWaalsContact O-N 3.15Å; L75-I79 HydrophobicContact CD1-CD1 3.93Å; L75-I79 HydrophobicContact CD1-CG1 4.38Å; L75-I79 HydrophobicContact CG-CD1 3.82Å; L75-I79 WeakPolarHBondContact O-CG1 3.49Å; L75-I79 PolarHBondContact O-N 3.38Å; L75-I79 VanDerWaalsContact O-N 3.09Å
76	L	95.5	Very high	93.8	Very high	45 Å²	45	59.6 Å²	59.6	24%	0.236	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-39.7	-179.2	-71	174.9	0	0	0	112.3	V72 N73 N78 I79 L80 P100 T171	V72-L76 HydrophobicContact CG1-CD1 3.83Å; V72-L76 HydrophobicContact CG1-CG 4.13Å; V72-L76 WeakPolarHBondContact O-CB 3.24Å; V72-L76 VanDerWaalsContact O-CG 3.29Å; V72-L76 WeakPolarHBondContact O-CG 3.24Å; V72-L76 PolarHBondContact O-N 2.71Å; N73-L76 PolarHBondContact O-N 3.35Å; L76-N78 VanDerWaalsContact C-N 3.3Å; L76-N78 PolarHBondContact O-N 2.86Å; L76-I79 PolarHBondContact O-N 3Å; L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.35Å; L76-P100 HydrophobicContact CB-CG 4.1Å; L76-P100 HydrophobicContact CD1-CG 3.99Å; L76-T171 HydrophobicContact CD1-CG2 3.79Å
77	K	93.2	Very high	92.4	Very high	17 Å²	17	66.5 Å²	66.5	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-59.7	-40.6	174.9	-79.4	178.6	175.8	172.8	0	112.7	N73 W74 L75 I79 R81 M99 P100	N73-K77 WeakPolarHBondContact O-CG 3.19Å; N73-K77 PolarHBondContact O-N 3.34Å; N73-K77 WeakPolarHBondContact OD1-CD 3.23Å; N73-K77 WeakPolarHBondContact OD1-CE 3.48Å; N73-K77 PolarHBondContact OD1-NZ 3.09Å; N73-K77 VanDerWaalsContact OD1-NZ 3.15Å; W74-K77 PolarHBondContact O-N 3.48Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 2.9Å; K77-I79 VanDerWaalsContact C-N 3.31Å; K77-R81 WeakPolarHBondContact O-CA 3.48Å; K77-R81 PolarHBondContact O-N 3.05Å; K77-M99 VanDerWaalsContact CA-O 3.31Å; K77-M99 WeakPolarHBondContact CA-O 3.4Å; K77-M99 VanDerWaalsContact CG-O 3.28Å; K77-M99 WeakPolarHBondContact CG-O 3.4Å; K77-P100 WeakPolarHBondContact CE-O 3.34Å
78	N	92.2	Very high	90.9	Very high	58 Å²	58	66.5 Å²	66.5	31%	0.31	35%	0.354	S	S	.	.	H	α-helix	trans	-75.1	-20.6	179.5	-74.4	-74.1	0	0	0	113.4	W74 L75 L76 R81	W74-N78 VanDerWaalsContact CE2-ND2 3.31Å; W74-N78 PolarHBondContact NE1-ND2 3.14Å; W74-N78 PolarHBondContact O-N 2.84Å; W74-N78 PolarHBondContact O-ND2 3.17Å; L75-N78 PolarHBondContact O-N 3.32Å; L75-N78 VanDerWaalsContact O-N 3.15Å; L76-N78 VanDerWaalsContact C-N 3.3Å; L76-N78 PolarHBondContact O-N 2.86Å; N78-R81 WeakPolarHBondContact O-CG 3.25Å; N78-R81 PolarHBondContact O-NE 3.34Å
79	I	95.1	Very high	89.6	Confident	110 Å²	110	63.8 Å²	63.8	56%	0.564	34%	0.343	S	S	*	.	H	α-helix	trans	-84.8	-52.4	174.5	-66.6	168.6	0	0	0	110.9	L75 L76 K77	L75-I79 HydrophobicContact CD1-CD1 3.93Å; L75-I79 HydrophobicContact CD1-CG1 4.38Å; L75-I79 HydrophobicContact CG-CD1 3.82Å; L75-I79 WeakPolarHBondContact O-CG1 3.49Å; L75-I79 PolarHBondContact O-N 3.38Å; L75-I79 VanDerWaalsContact O-N 3.09Å; L76-I79 PolarHBondContact O-N 3Å; K77-I79 VanDerWaalsContact C-N 3.31Å
80	L	93.7	Very high	88.5	Confident	94 Å²	94	64.3 Å²	64.3	49%	0.492	35%	0.345	S	S	.	.	H	α-helix	trans	-77.5	-36.6	-172.1	-64.6	175.5	0	0	0	112.8	L76 E82 M99	L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.35Å; L80-E82 PolarHBondContact O-N 3.01Å; L80-M99 HydrophobicContact CB-CG 4.4Å; L80-M99 HydrophobicContact CD1-CG 3.62Å
81	R	92	Very high	87	Confident	150 Å²	150	65.1 Å²	65.1	57%	0.566	37%	0.365	S	S	*	.			trans	51.3	29.5	174.8	-57.1	-175.1	-178.2	-175.4	-2.8	115.1	K77 N78 Y97	K77-R81 WeakPolarHBondContact O-CA 3.48Å; K77-R81 PolarHBondContact O-N 3.05Å; N78-R81 WeakPolarHBondContact O-CG 3.25Å; N78-R81 PolarHBondContact O-NE 3.34Å; R81-Y97 VanDerWaalsContact CA-CD1 3.46Å; R81-Y97 HydrophobicContact CB-CD1 3.82Å; R81-Y97 HydrophobicContact CB-CD2 4.49Å; R81-Y97 HydrophobicContact CB-CE1 3.58Å; R81-Y97 HydrophobicContact CB-CE2 4.27Å; R81-Y97 HydrophobicContact CB-CG 4.3Å; R81-Y97 HydrophobicContact CG-CD1 4.39Å; R81-Y97 HydrophobicContact CG-CD2 4.22Å; R81-Y97 HydrophobicContact CG-CE1 4.01Å; R81-Y97 HydrophobicContact CG-CE2 3.81Å; R81-Y97 WeakPolarHBondContact O-CD1 3.49Å
82	E	90.8	Very high	85.7	Confident	62 Å²	62	66 Å²	66	29%	0.29	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-71	132.6	177.8	-165.7	-172	129.3	0	0	110.1	L80 Y97 G98 M99 Q164	L80-E82 PolarHBondContact O-N 3.01Å; E82-Y97 CarbonylContact O-C 3.32Å; E82-Y97 WeakPolarHBondContact O-CA 3.47Å; E82-G98 PolarHBondContact O-N 2.79Å; E82-M99 HydrophobicContact CB-CB 3.44Å; E82-M99 VanDerWaalsContact CB-CB 3.44Å; E82-M99 HydrophobicContact CB-CG 4.27Å; E82-M99 HydrophobicContact CG-CB 4.23Å; E82-M99 WeakPolarHBondContact OE2-CB 3.49Å; E82-M99 VanDerWaalsContact OE2-CG 3.29Å; E82-M99 WeakPolarHBondContact OE2-CG 3.45Å; E82-Q164 WeakPolarHBondContact OE1-CG 3.49Å; E82-Q164 PolarHBondContact OE1-NE2 3.19Å
83	P	90.2	Very high	84.5	Confident	68 Å²	68	66.6 Å²	66.6	44%	0.442	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-69.3	158.4	-178.6	29.2	-35.8	0	0	0	112.3	E87 Q164	P83-E87 WeakPolarHBondContact CB-OE1 3.2Å; P83-Q164 PolarHBondContact O-NE2 2.92Å
84	R	88.9	Confident	83.1	Confident	24 Å²	24	73.6 Å²	73.6	9%	0.091	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-75	159.6	172	-74	175.2	-173.6	-100	9.1	111.3	C86 T95 E96 Y159 H160	R84-C86 PolarHBondContact O-N 2.8Å; R84-T95 PolarHBondContact NE-O 2.88Å; R84-T95 PolarHBondContact NH2-O 3.44Å; R84-E96 WeakPolarHBondContact CG-O 3.38Å; R84-E96 PolarHBondContact N-O 3.19Å; R84-Y159 PolarHBondContact NH1-O 3.25Å; R84-H160 PolarHBondContact NH1-NE2 2.93Å
85	P	85.9	Confident	82.1	Confident	37 Å²	37	67.9 Å²	67.9	24%	0.24	39%	0.39	C	S	.	.	S	Bend	trans	-61.9	-37.9	-176.9	21	-32.4	0	0	0	114.6	C7 L158 T161	C7-P85 PolarHBondContact SG-O 3.34Å; P85-L158 WeakPolarHBondContact CG-O 3.43Å; P85-T161 HydrophobicContact CB-CG2 3.89Å; P85-T161 HydrophobicContact CG-CG2 4.23Å
86	C	80.4	Confident	81.2	Confident	11 Å²	11	70.6 Å²	70.6	7%	0.074	40%	0.401	C	S	.	.	S	Bend	trans	-125.4	99.4	174	-55.4	0	0	0	0	109.2	C7 R84 A89	C7-C86 HydrophobicContact CB-CB 3.91Å; C7-C86 WeakPolarHBondContact CB-SG 3.5Å; C7-C86 WeakPolarHBondContact SG-CB 3.26Å; C7-C86 CovalentContact SG-SG 2.05Å; C7-C86 PolarHBondContact SG-SG 3.47Å; R84-C86 PolarHBondContact O-N 2.8Å; C86-A89 HydrophobicContact CB-CB 3.49Å; C86-A89 VanDerWaalsContact CB-CB 3.49Å; C86-A89 WeakPolarHBondContact O-CB 3.2Å; C86-A89 PolarHBondContact O-N 3.01Å
87	E	68.9	Low	80.8	Confident	145 Å²	145	71.5 Å²	71.5	68%	0.678	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	135.1	174.4	-70.6	-177.4	176.4	0	0	110.6	P83 A89	P83-E87 WeakPolarHBondContact CB-OE1 3.2Å; E87-A89 PolarHBondContact O-N 2.61Å; E87-A89 VanDerWaalsContact O-N 3.1Å
88	G	66.8	Low	80.5	Confident	80 Å²	80	70.7 Å²	70.7	83%	0.825	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	-0.2	-180	0	0	0	0	0	116	H90	G88-H90 PolarHBondContact O-N 3.24Å
89	A	70.9	Confident	80.5	Confident	20 Å²	20	68.7 Å²	68.7	17%	0.165	39%	0.387	C	S	.	.	S	Bend	trans	-64.9	-28.5	177.4	0	0	0	0	0	113	W13 C86 E87	W13-A89 PolarHBondContact NE1-O 3.47Å; W13-A89 VanDerWaalsContact NE1-O 3.12Å; C86-A89 HydrophobicContact CB-CB 3.49Å; C86-A89 VanDerWaalsContact CB-CB 3.49Å; C86-A89 WeakPolarHBondContact O-CB 3.2Å; C86-A89 PolarHBondContact O-N 3.01Å; E87-A89 PolarHBondContact O-N 2.61Å; E87-A89 VanDerWaalsContact O-N 3.1Å
90	H	73.9	Confident	80.5	Confident	10 Å²	10	63.5 Å²	63.5	5%	0.046	36%	0.361	C	S	.	.			trans	-119.1	114	178.5	-65.4	-64.8	0	0	0	110.9	W13 E22 G88 T92 L93 L157 Y159	W13-H90 AromaticContact CE3-CE1 3.87Å; W13-H90 AromaticContact CH2-CE1 3.65Å; W13-H90 AromaticContact CZ3-CE1 3.55Å; E22-H90 WeakPolarHBondContact OE2-CA 3.45Å; E22-H90 VanDerWaalsContact OE2-CB 3.23Å; E22-H90 WeakPolarHBondContact OE2-CB 3.29Å; E22-H90 IonicContact OE2-CG 3.39Å; E22-H90 IonicContact OE2-ND1 2.8Å; E22-H90 PolarHBondContact OE2-ND1 2.9Å; G88-H90 PolarHBondContact O-N 3.24Å; H90-T92 PolarHBondContact O-N 3.37Å; H90-L93 HydrophobicContact CB-CD1 3.57Å; H90-L93 HydrophobicContact CB-CG 3.66Å; H90-L157 PolarHBondContact NE2-O 3.06Å; H90-L157 VanDerWaalsContact NE2-O 3.09Å; H90-Y159 HydrophobicContact CB-CE1 4.41Å; H90-Y159 AromaticContact CD2-CD1 3.81Å; H90-Y159 AromaticContact CD2-CE1 3.79Å; H90-Y159 AromaticContact CE1-CE2 3.65Å; H90-Y159 AromaticContact CE1-CZ 3.64Å; H90-Y159 AromaticContact CG-CE1 3.86Å; H90-Y159 AromaticContact ND1-CZ 3.78Å; H90-Y159 AromaticContact NE2-CD2 3.73Å; H90-Y159 AromaticContact NE2-CE1 4Å; H90-Y159 AromaticContact NE2-CE2 3.64Å; H90-Y159 AromaticContact NE2-CG 3.93Å; H90-Y159 AromaticContact NE2-CZ 3.78Å
91	A	65.9	Low	80.6	Confident	97 Å²	97	59 Å²	59	80%	0.802	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.3	-176.8	0	0	0	0	0	112.8
92	T	68.7	Low	80.8	Confident	59 Å²	59	52.7 Å²	52.7	36%	0.362	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.5	-176	57.8	0	0	0	0	113.8	H20 E22 H90 T94	H20-T92 HydrophobicContact CB-CG2 4.07Å; H20-T92 PolarHBondContact O-OG1 3.04Å; E22-T92 HydrophobicContact CG-CG2 4.48Å; E22-T92 WeakPolarHBondContact OE1-CG2 3.21Å; H90-T92 PolarHBondContact O-N 3.37Å; T92-T94 PolarHBondContact O-N 3.11Å
93	L	72.9	Confident	81	Confident	54 Å²	54	51.6 Å²	51.6	28%	0.283	31%	0.311	S	S	.	.			trans	-78.6	121.1	-178.8	-70.3	178.5	0	0	0	111.4	H90 T95 Y159	H90-L93 HydrophobicContact CB-CD1 3.57Å; H90-L93 HydrophobicContact CB-CG 3.66Å; L93-T95 VanDerWaalsContact C-N 3.33Å; L93-Y159 HydrophobicContact CD1-CD1 4.1Å; L93-Y159 HydrophobicContact CD1-CE1 4.38Å; L93-Y159 HydrophobicContact CD2-CD1 3.9Å; L93-Y159 HydrophobicContact CD2-CE1 3.86Å; L93-Y159 HydrophobicContact CG-CD1 4.41Å; L93-Y159 HydrophobicContact CG-CE1 4.29Å
94	T	66.9	Low	81.4	Confident	149 Å²	149	48.4 Å²	48.4	91%	0.914	29%	0.29	S	S	*	.	S	Bend	trans	-81.4	-10.4	178.8	55	0	0	0	0	113.9	T92	T92-T94 PolarHBondContact O-N 3.11Å
95	T	74.7	Confident	81.8	Confident	45 Å²	45	47.3 Å²	47.3	28%	0.276	29%	0.286	S	S	.	.			trans	-140.1	132.2	180	-178.8	0	0	0	0	111.5	R84 L93 Y97	R84-T95 PolarHBondContact NE-O 2.88Å; R84-T95 PolarHBondContact NH2-O 3.44Å; L93-T95 VanDerWaalsContact C-N 3.33Å; T95-Y97 PolarHBondContact O-N 2.65Å; T95-Y97 PolarHBondContact OG1-N 2.98Å
96	E	78.5	Confident	82.4	Confident	147 Å²	147	45.8 Å²	45.8	69%	0.687	28%	0.275	S	S	*	.	S	Bend	trans	-73.5	-17.3	176.2	-63.1	175.8	174.2	0	0	112.2	R84	R84-E96 WeakPolarHBondContact CG-O 3.38Å; R84-E96 PolarHBondContact N-O 3.19Å
97	Y	87.1	Confident	83.3	Confident	65 Å²	65	45.3 Å²	45.3	26%	0.255	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-84	127.1	-176.7	-51.8	-40.6	0	0	0	112.7	R81 E82 T95	R81-Y97 VanDerWaalsContact CA-CD1 3.46Å; R81-Y97 HydrophobicContact CB-CD1 3.82Å; R81-Y97 HydrophobicContact CB-CD2 4.49Å; R81-Y97 HydrophobicContact CB-CE1 3.58Å; R81-Y97 HydrophobicContact CB-CE2 4.27Å; R81-Y97 HydrophobicContact CB-CG 4.3Å; R81-Y97 HydrophobicContact CG-CD1 4.39Å; R81-Y97 HydrophobicContact CG-CD2 4.22Å; R81-Y97 HydrophobicContact CG-CE1 4.01Å; R81-Y97 HydrophobicContact CG-CE2 3.81Å; R81-Y97 WeakPolarHBondContact O-CD1 3.49Å; E82-Y97 CarbonylContact O-C 3.32Å; E82-Y97 WeakPolarHBondContact O-CA 3.47Å; T95-Y97 PolarHBondContact O-N 2.65Å; T95-Y97 PolarHBondContact OG1-N 2.98Å
98	G	85.9	Confident	84.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.248	C	C	.	.			trans	-100.6	-20.4	-174.9	0	0	0	0	0	115.1	E82 P100 S101 H160 Q164	E82-G98 PolarHBondContact O-N 2.79Å; G98-P100 CarbonylContact O-C 3.59Å; G98-S101 PolarHBondContact O-N 2.83Å; G98-H160 PolarHBondContact O-CE1 3.49Å; G98-H160 PolarHBondContact O-ND1 2.77Å; G98-Q164 PolarHBondContact O-OE1 3.2Å
99	M	91.5	Very high	86.2	Confident	15 Å²	15	36.7 Å²	36.7	7%	0.074	21%	0.208	C	C	.	.	S	Bend	trans	-106.5	129.1	-170.4	-178	68.2	157.7	0	0	113.3	K77 L80 E82 Q164 Y167	K77-M99 VanDerWaalsContact CA-O 3.31Å; K77-M99 WeakPolarHBondContact CA-O 3.4Å; K77-M99 VanDerWaalsContact CG-O 3.28Å; K77-M99 WeakPolarHBondContact CG-O 3.4Å; L80-M99 HydrophobicContact CB-CG 4.4Å; L80-M99 HydrophobicContact CD1-CG 3.62Å; E82-M99 HydrophobicContact CB-CB 3.44Å; E82-M99 VanDerWaalsContact CB-CB 3.44Å; E82-M99 HydrophobicContact CB-CG 4.27Å; E82-M99 HydrophobicContact CG-CB 4.23Å; E82-M99 WeakPolarHBondContact OE2-CB 3.49Å; E82-M99 VanDerWaalsContact OE2-CG 3.29Å; E82-M99 WeakPolarHBondContact OE2-CG 3.45Å; M99-Q164 HydrophobicContact CB-CG 4Å; M99-Q164 HydrophobicContact SD-CB 4.31Å; M99-Q164 HydrophobicContact SD-CG 3.97Å; M99-Y167 VanDerWaalsContact CE-CB 3.42Å; M99-Y167 HydrophobicContact CE-CD1 4.02Å; M99-Y167 HydrophobicContact CE-CD2 3.1Å; M99-Y167 HydrophobicContact CE-CE2 3.75Å; M99-Y167 HydrophobicContact CE-CG 3.25Å; M99-Y167 HydrophobicContact SD-CD2 4.04Å; M99-Y167 HydrophobicContact SD-CG 4.21Å
100	P	96	Very high	87.5	Confident	2 Å²	2	37 Å²	37	1%	0.013	21%	0.206	C	C	.	.	S	Bend	cis	-79.1	160.9	-13.9	28.3	-28.7	0	0	0	112.4	N73 L76 K77 G98 S102	N73-P100 PolarHBondContact ND2-O 3.05Å; L76-P100 HydrophobicContact CB-CG 4.1Å; L76-P100 HydrophobicContact CD1-CG 3.99Å; K77-P100 WeakPolarHBondContact CE-O 3.34Å; G98-P100 CarbonylContact O-C 3.59Å; P100-S102 PolarHBondContact O-N 2.95Å
101	S	96.4	Very high	88.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.205	C	C	.	.			trans	-64.7	119.7	177.6	-175	0	0	0	0	111.9	G98 H103 S104 Q105 H160 Q164	G98-S101 PolarHBondContact O-N 2.83Å; S101-H103 PolarHBondContact O-N 3.23Å; S101-S104 PolarHBondContact O-N 2.84Å; S101-Q105 WeakPolarHBondContact O-CB 3.4Å; S101-Q105 PolarHBondContact O-N 3.28Å; S101-H160 PolarHBondContact OG-CD2 3.25Å; S101-H160 VanDerWaalsContact OG-CD2 3.27Å; S101-H160 PolarHBondContact OG-NE2 2.91Å; S101-Q164 WeakPolarHBondContact CB-O 3.29Å; S101-Q164 PolarHBondContact N-O 3.37Å
102	S	95.1	Very high	90.2	Very high	17 Å²	17	33.4 Å²	33.4	12%	0.119	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-41.8	-179	55.5	0	0	0	0	112.8	N73 P100 S104 Q105 F106	N73-S102 WeakPolarHBondContact ND2-CA 3.42Å; N73-S102 WeakPolarHBondContact OD1-CB 3.42Å; P100-S102 PolarHBondContact O-N 2.95Å; S102-S104 PolarHBondContact O-N 3.48Å; S102-Q105 PolarHBondContact O-N 2.95Å; S102-F106 VanDerWaalsContact O-CB 3.25Å; S102-F106 WeakPolarHBondContact O-CB 3.23Å; S102-F106 PolarHBondContact O-N 3.1Å
103	H	95.9	Very high	91.6	Very high	39 Å²	39	30.8 Å²	30.8	18%	0.181	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-42.1	-179.8	-72.5	54.3	0	0	0	111.7	S37 S101 I107 V150 R154	S37-H103 PolarHBondContact O-CD2 3.12Å; S37-H103 PolarHBondContact O-NE2 3.4Å; S101-H103 PolarHBondContact O-N 3.23Å; H103-I107 WeakPolarHBondContact O-CG2 3.3Å; H103-I107 PolarHBondContact O-N 3.24Å; H103-I107 VanDerWaalsContact O-N 3.09Å; H103-V150 HydrophobicContact CB-CG1 4.19Å; H103-R154 HydrophobicContact CB-CG 3.91Å
104	S	97.8	Very high	92.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.5	-47.1	176.4	-165.2	0	0	0	0	110.7	S101 S102 F106 I107 W108 S151 V165 G169	S101-S104 PolarHBondContact O-N 2.84Å; S102-S104 PolarHBondContact O-N 3.48Å; S104-F106 VanDerWaalsContact C-N 3.32Å; S104-F106 PolarHBondContact O-N 2.89Å; S104-I107 WeakPolarHBondContact O-CG2 3.33Å; S104-I107 PolarHBondContact O-N 3.37Å; S104-W108 WeakPolarHBondContact O-CB 3.4Å; S104-W108 PolarHBondContact O-N 3.11Å; S104-S151 PolarHBondContact OG-OG 3.43Å; S104-V165 PolarHBondContact OG-O 3.32Å; S104-G169 PolarHBondContact OG-N 2.95Å
105	Q	98.4	Very high	94	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-59.2	-42	177.8	-168.6	-179.9	-36.9	0	0	112.8	N69 N73 S101 S102 F109 G168 T171 G172	N69-Q105 PolarHBondContact ND2-O 2.81Å; N69-Q105 VanDerWaalsContact ND2-O 3.17Å; N69-Q105 PolarHBondContact O-NE2 2.81Å; N69-Q105 WeakPolarHBondContact OD1-CG 3.44Å; N69-Q105 PolarHBondContact OD1-NE2 3.37Å; N73-Q105 PolarHBondContact ND2-OE1 3.48Å; S101-Q105 WeakPolarHBondContact O-CB 3.4Å; S101-Q105 PolarHBondContact O-N 3.28Å; S102-Q105 PolarHBondContact O-N 2.95Å; Q105-F109 WeakPolarHBondContact O-CB 3.37Å; Q105-F109 PolarHBondContact O-N 3.26Å; Q105-F109 VanDerWaalsContact O-N 3.14Å; Q105-G168 WeakPolarHBondContact CA-O 3.22Å; Q105-G168 WeakPolarHBondContact CB-O 3.45Å; Q105-T171 HydrophobicContact CG-CG2 4.22Å; Q105-G172 VanDerWaalsContact O-CA 3.3Å; Q105-G172 WeakPolarHBondContact O-CA 3.26Å
106	F	98.4	Very high	95	Very high	6 Å²	6	26.8 Å²	26.8	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-52.6	177.2	-175	-79.5	0	0	0	111.9	P40 I43 L44 L66 S102 S104 W108 F109 F110	P40-F106 HydrophobicContact CB-CD1 3.55Å; P40-F106 HydrophobicContact CB-CE1 3.79Å; P40-F106 HydrophobicContact CB-CG 4.01Å; P40-F106 HydrophobicContact CB-CZ 4.4Å; P40-F106 HydrophobicContact CG-CD1 4Å; I43-F106 HydrophobicContact CB-CE1 4.08Å; I43-F106 HydrophobicContact CB-CZ 4.41Å; I43-F106 HydrophobicContact CD1-CE1 4.22Å; I43-F106 HydrophobicContact CG2-CE1 3.91Å; I43-F106 HydrophobicContact CG2-CZ 4.05Å; L44-F106 HydrophobicContact CD1-CE2 4.22Å; L44-F106 HydrophobicContact CD1-CZ 4.45Å; L44-F106 HydrophobicContact CD2-CE2 3.81Å; L44-F106 HydrophobicContact CD2-CZ 3.91Å; L44-F106 HydrophobicContact CG-CE2 3.92Å; L44-F106 HydrophobicContact CG-CZ 3.77Å; L66-F106 HydrophobicContact CB-CE2 4.12Å; L66-F106 HydrophobicContact CD1-CE2 4.43Å; L66-F106 HydrophobicContact CD1-CZ 4.01Å; L66-F106 HydrophobicContact CD2-CD1 4.47Å; L66-F106 HydrophobicContact CD2-CD2 4.15Å; L66-F106 HydrophobicContact CD2-CE1 4.07Å; L66-F106 HydrophobicContact CD2-CE2 3.73Å; L66-F106 HydrophobicContact CD2-CZ 3.69Å; L66-F106 HydrophobicContact CG-CE2 4.33Å; L66-F106 HydrophobicContact CG-CZ 4.31Å; S102-F106 VanDerWaalsContact O-CB 3.25Å; S102-F106 WeakPolarHBondContact O-CB 3.23Å; S102-F106 PolarHBondContact O-N 3.1Å; S104-F106 VanDerWaalsContact C-N 3.32Å; S104-F106 PolarHBondContact O-N 2.89Å; F106-W108 PolarHBondContact O-N 3.13Å; F106-F109 PolarHBondContact O-N 2.86Å; F106-F110 PolarHBondContact O-N 2.88Å
107	I	98.4	Very high	95.6	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-69.3	-35.9	-173.1	-160.5	61.8	0	0	0	111.7	I43 H103 S104 F110 V111 V146 A147 V150	I43-I107 HydrophobicContact CD1-CD1 3.63Å; H103-I107 WeakPolarHBondContact O-CG2 3.3Å; H103-I107 PolarHBondContact O-N 3.24Å; H103-I107 VanDerWaalsContact O-N 3.09Å; S104-I107 WeakPolarHBondContact O-CG2 3.33Å; S104-I107 PolarHBondContact O-N 3.37Å; I107-F110 HydrophobicContact CD1-CD1 4.44Å; I107-F110 PolarHBondContact O-N 2.95Å; I107-V111 HydrophobicContact CG1-CG2 4.42Å; I107-V111 WeakPolarHBondContact O-CB 3.39Å; I107-V111 WeakPolarHBondContact O-CG2 3.45Å; I107-V111 PolarHBondContact O-N 2.96Å; I107-V146 HydrophobicContact CD1-CG1 4.09Å; I107-V146 HydrophobicContact CG1-CG1 4.31Å; I107-A147 HydrophobicContact CG1-CB 4.15Å; I107-A147 HydrophobicContact CG2-CB 4.1Å; I107-V150 HydrophobicContact CB-CB 4.49Å; I107-V150 HydrophobicContact CB-CG1 4.26Å; I107-V150 HydrophobicContact CG1-CB 4.36Å; I107-V150 HydrophobicContact CG1-CG2 4.27Å; I107-V150 HydrophobicContact CG2-CB 4.17Å; I107-V150 HydrophobicContact CG2-CG1 4.05Å
108	W	98.6	Very high	95.7	Very high	43 Å²	43	19.7 Å²	19.7	16%	0.163	9%	0.092	C	C	.	.	H	α-helix	trans	-70.1	-38.1	176.7	-81	101.8	0	0	0	112.4	S104 F106 F110 V112 L144 A147 F148 S151	S104-W108 WeakPolarHBondContact O-CB 3.4Å; S104-W108 PolarHBondContact O-N 3.11Å; F106-W108 PolarHBondContact O-N 3.13Å; W108-F110 VanDerWaalsContact C-N 3.34Å; W108-F110 PolarHBondContact O-N 3.42Å; W108-V112 HydrophobicContact CE3-CG2 4.3Å; W108-V112 VanDerWaalsContact O-CB 3.32Å; W108-V112 WeakPolarHBondContact O-CB 3.22Å; W108-V112 VanDerWaalsContact O-CG2 3.29Å; W108-V112 WeakPolarHBondContact O-CG2 3.35Å; W108-V112 PolarHBondContact O-N 2.99Å; W108-L144 HydrophobicContact CH2-CD2 4.4Å; W108-L144 HydrophobicContact CZ3-CD2 4.18Å; W108-A147 HydrophobicContact CD2-CB 4.26Å; W108-A147 HydrophobicContact CZ2-CB 4.26Å; W108-F148 AromaticContact CH2-CE1 3.97Å; W108-F148 HydrophobicContact CH2-CE1 3.97Å; W108-F148 HydrophobicContact CH2-CE2 4.04Å; W108-F148 AromaticContact CH2-CZ 3.66Å; W108-F148 HydrophobicContact CH2-CZ 3.66Å; W108-F148 HydrophobicContact CZ2-CD1 4.01Å; W108-F148 AromaticContact CZ2-CE1 3.68Å; W108-F148 HydrophobicContact CZ2-CE1 3.68Å; W108-F148 HydrophobicContact CZ2-CE2 4.36Å; W108-F148 HydrophobicContact CZ2-CG 4.49Å; W108-F148 AromaticContact CZ2-CZ 3.87Å; W108-F148 HydrophobicContact CZ2-CZ 3.87Å; W108-S151 PolarHBondContact NE1-OG 3.42Å
109	F	98.6	Very high	95.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-55.9	-51.6	168.7	174.4	-79.5	0	0	0	110.7	F62 L66 N69 Q105 F106 V111 Y113 G172 I175 G176 W179	F62-F109 AromaticContact CD2-CE1 3.8Å; F62-F109 HydrophobicContact CD2-CE1 3.8Å; F62-F109 HydrophobicContact CD2-CZ 4.49Å; F62-F109 HydrophobicContact CE2-CD1 4.14Å; F62-F109 AromaticContact CE2-CE1 3.6Å; F62-F109 HydrophobicContact CE2-CE1 3.6Å; L66-F109 HydrophobicContact CD2-CD1 3.3Å; L66-F109 HydrophobicContact CD2-CE1 3.65Å; L66-F109 HydrophobicContact CD2-CG 4.33Å; L66-F109 HydrophobicContact CG-CD1 3.98Å; L66-F109 HydrophobicContact CG-CE1 3.78Å; N69-F109 HydrophobicContact CB-CD2 3.94Å; N69-F109 HydrophobicContact CB-CE2 4.38Å; N69-F109 HydrophobicContact CB-CG 4.23Å; Q105-F109 WeakPolarHBondContact O-CB 3.37Å; Q105-F109 PolarHBondContact O-N 3.26Å; Q105-F109 VanDerWaalsContact O-N 3.14Å; F106-F109 PolarHBondContact O-N 2.86Å; F109-V111 PolarHBondContact O-N 2.86Å; F109-Y113 HydrophobicContact CZ-CD2 4.32Å; F109-Y113 VanDerWaalsContact O-CB 3.25Å; F109-Y113 WeakPolarHBondContact O-CB 3.25Å; F109-Y113 PolarHBondContact O-N 3.49Å; F109-G172 VanDerWaalsContact CA-O 3.24Å; F109-G172 WeakPolarHBondContact CA-O 3.37Å; F109-G172 WeakPolarHBondContact CB-O 3.46Å; F109-I175 HydrophobicContact CD2-CB 4.1Å; F109-I175 HydrophobicContact CD2-CG2 3.84Å; F109-I175 HydrophobicContact CE2-CB 4.48Å; F109-I175 HydrophobicContact CE2-CG2 3.82Å; F109-G176 VanDerWaalsContact CD2-N 3.27Å; F109-G176 VanDerWaalsContact CE2-CA 3.47Å; F109-W179 HydrophobicContact CE2-CB 3.88Å; F109-W179 HydrophobicContact CE2-CG 4.3Å; F109-W179 HydrophobicContact CZ-CB 4.1Å; F109-W179 AromaticContact CZ-CD1 3.91Å; F109-W179 HydrophobicContact CZ-CG 4.1Å
110	F	98.4	Very high	95.8	Very high	27 Å²	27	27.4 Å²	27.4	12%	0.118	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-50.6	-177.5	175.1	-95.8	0	0	0	111.8	I43 F47 F62 L66 F106 I107 W108 F114 L143	I43-F110 HydrophobicContact CD1-CD1 4.01Å; I43-F110 HydrophobicContact CD1-CE1 4.18Å; I43-F110 HydrophobicContact CD1-CG 4.18Å; I43-F110 HydrophobicContact CG2-CD2 3.77Å; I43-F110 HydrophobicContact CG2-CE2 3.82Å; I43-F110 HydrophobicContact CG2-CG 4.41Å; F47-F110 AromaticContact CE2-CD2 3.93Å; F47-F110 HydrophobicContact CE2-CD2 3.93Å; F47-F110 AromaticContact CE2-CE2 3.71Å; F47-F110 HydrophobicContact CE2-CE2 3.71Å; F47-F110 HydrophobicContact CZ-CD2 4.38Å; F47-F110 HydrophobicContact CZ-CE2 4.09Å; F62-F110 HydrophobicContact CE1-CD2 4.29Å; F62-F110 HydrophobicContact CE1-CE2 4.22Å; F62-F110 HydrophobicContact CE2-CD2 4.15Å; F62-F110 AromaticContact CZ-CD2 3.55Å; F62-F110 HydrophobicContact CZ-CD2 3.55Å; F62-F110 AromaticContact CZ-CE2 3.92Å; F62-F110 HydrophobicContact CZ-CE2 3.92Å; F62-F110 HydrophobicContact CZ-CG 4.32Å; L66-F110 HydrophobicContact CD2-CB 4.3Å; F106-F110 PolarHBondContact O-N 2.88Å; I107-F110 HydrophobicContact CD1-CD1 4.44Å; I107-F110 PolarHBondContact O-N 2.95Å; W108-F110 VanDerWaalsContact C-N 3.34Å; W108-F110 PolarHBondContact O-N 3.42Å; F110-F114 HydrophobicContact CZ-CD2 4.4Å; F110-F114 VanDerWaalsContact O-CB 3.22Å; F110-F114 WeakPolarHBondContact O-CB 3.32Å; F110-F114 PolarHBondContact O-N 3.46Å; F110-L143 HydrophobicContact CE1-CD2 3.98Å
111	V	98	Very high	95.2	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.024	14%	0.139	C	C	.	.	H	α-helix	trans	-66.6	-43.3	-176.5	169.6	0	0	0	0	111.8	I107 F109 F114 F115 L143 L144 A147	I107-V111 HydrophobicContact CG1-CG2 4.42Å; I107-V111 WeakPolarHBondContact O-CB 3.39Å; I107-V111 WeakPolarHBondContact O-CG2 3.45Å; I107-V111 PolarHBondContact O-N 2.96Å; F109-V111 PolarHBondContact O-N 2.86Å; V111-F114 PolarHBondContact O-N 2.83Å; V111-F115 VanDerWaalsContact O-CB 3.24Å; V111-F115 WeakPolarHBondContact O-CB 3.4Å; V111-F115 PolarHBondContact O-N 3.47Å; V111-L143 HydrophobicContact CG1-CB 4.07Å; V111-L143 HydrophobicContact CG2-CB 4.06Å; V111-L143 WeakPolarHBondContact CG2-O 3.47Å; V111-L144 HydrophobicContact CG1-CD2 4.05Å; V111-L144 HydrophobicContact CG1-CG 4.46Å; V111-A147 HydrophobicContact CB-CB 4.4Å; V111-A147 HydrophobicContact CG2-CB 3.97Å
112	V	98.3	Very high	94.4	Very high	28 Å²	28	32.7 Å²	32.7	17%	0.17	15%	0.151	C	C	.	.	H	α-helix	trans	-66.8	-45.5	178.8	171.7	0	0	0	0	111.1	W108 F114 F115 L116 V177	W108-V112 HydrophobicContact CE3-CG2 4.3Å; W108-V112 VanDerWaalsContact O-CB 3.32Å; W108-V112 WeakPolarHBondContact O-CB 3.22Å; W108-V112 VanDerWaalsContact O-CG2 3.29Å; W108-V112 WeakPolarHBondContact O-CG2 3.35Å; W108-V112 PolarHBondContact O-N 2.99Å; V112-F114 VanDerWaalsContact C-N 3.33Å; V112-F114 PolarHBondContact O-N 2.83Å; V112-F115 WeakPolarHBondContact O-CB 3.38Å; V112-F115 PolarHBondContact O-N 2.98Å; V112-L116 HydrophobicContact CG1-CD1 4.26Å; V112-L116 WeakPolarHBondContact O-CG 3.35Å; V112-L116 PolarHBondContact O-N 3.43Å; V112-V177 HydrophobicContact CG1-CG2 3.68Å
113	Y	98	Very high	93.3	Very high	4 Å²	4	38 Å²	38	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-59.8	-45.8	175.9	-173	-73.4	0	0	0	111.1	F62 F109 F115 L116 F117 W179 F180	F62-Y113 HydrophobicContact CB-CE1 3.89Å; F62-Y113 AromaticContact CD1-CD1 3.49Å; F62-Y113 HydrophobicContact CD1-CD1 3.49Å; F62-Y113 VanDerWaalsContact CD1-CD1 3.49Å; F62-Y113 AromaticContact CD1-CE1 3.41Å; F62-Y113 HydrophobicContact CD1-CE1 3.41Å; F62-Y113 VanDerWaalsContact CD1-CE1 3.41Å; F62-Y113 HydrophobicContact CD1-CG 4.47Å; F62-Y113 AromaticContact CD2-CD1 3.55Å; F62-Y113 HydrophobicContact CD2-CD1 3.55Å; F62-Y113 HydrophobicContact CD2-CD2 4.12Å; F62-Y113 AromaticContact CD2-CE1 3.78Å; F62-Y113 HydrophobicContact CD2-CE1 3.78Å; F62-Y113 HydrophobicContact CD2-CE2 4.32Å; F62-Y113 AromaticContact CD2-CG 3.74Å; F62-Y113 HydrophobicContact CD2-CG 3.74Å; F62-Y113 AromaticContact CE1-CD1 3.37Å; F62-Y113 HydrophobicContact CE1-CD1 3.37Å; F62-Y113 AromaticContact CE1-CE1 3.81Å; F62-Y113 HydrophobicContact CE1-CE1 3.81Å; F62-Y113 HydrophobicContact CE1-CG 4.25Å; F62-Y113 AromaticContact CE2-CD1 3.46Å; F62-Y113 HydrophobicContact CE2-CD1 3.46Å; F62-Y113 VanDerWaalsContact CE2-CD1 3.46Å; F62-Y113 HydrophobicContact CE2-CD2 4.26Å; F62-Y113 HydrophobicContact CE2-CE1 4.17Å; F62-Y113 AromaticContact CE2-CG 3.52Å; F62-Y113 HydrophobicContact CE2-CG 3.52Å; F62-Y113 AromaticContact CG-CD1 3.61Å; F62-Y113 HydrophobicContact CG-CD1 3.61Å; F62-Y113 AromaticContact CG-CE1 3.42Å; F62-Y113 HydrophobicContact CG-CE1 3.42Å; F62-Y113 VanDerWaalsContact CG-CE1 3.42Å; F62-Y113 HydrophobicContact CG-CG 4.26Å; F62-Y113 AromaticContact CG-CZ 3.92Å; F62-Y113 AromaticContact CZ-CD1 3.37Å; F62-Y113 HydrophobicContact CZ-CD1 3.37Å; F62-Y113 HydrophobicContact CZ-CE1 4.19Å; F62-Y113 AromaticContact CZ-CG 3.8Å; F62-Y113 HydrophobicContact CZ-CG 3.8Å; F109-Y113 HydrophobicContact CZ-CD2 4.32Å; F109-Y113 VanDerWaalsContact O-CB 3.25Å; F109-Y113 WeakPolarHBondContact O-CB 3.25Å; F109-Y113 PolarHBondContact O-N 3.49Å; Y113-F115 VanDerWaalsContact C-N 3.33Å; Y113-F115 PolarHBondContact O-N 3.49Å; Y113-L116 PolarHBondContact O-N 2.9Å; Y113-F117 WeakPolarHBondContact O-CB 3.29Å; Y113-F117 PolarHBondContact O-N 3.03Å; Y113-W179 AromaticContact CE2-CD1 3.65Å; Y113-F180 HydrophobicContact CD1-CD2 4.3Å; Y113-F180 HydrophobicContact CD2-CB 3.77Å; Y113-F180 HydrophobicContact CD2-CD2 4.16Å; Y113-F180 HydrophobicContact CD2-CG 4.5Å; Y113-F180 HydrophobicContact CE1-CD2 4.09Å; Y113-F180 VanDerWaalsContact CE2-CA 3.48Å; Y113-F180 HydrophobicContact CE2-CB 3.84Å; Y113-F180 AromaticContact CE2-CD2 3.95Å; Y113-F180 HydrophobicContact CE2-CD2 3.95Å; Y113-F180 HydrophobicContact CE2-CG 4.39Å; Y113-F180 HydrophobicContact CG-CD2 4.33Å; Y113-F180 AromaticContact CZ-CD2 3.92Å
114	F	95.5	Very high	91.7	Very high	51 Å²	51	38.7 Å²	38.7	22%	0.224	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-37.8	179.8	-161.8	-90.6	0	0	0	111.8	F62 F110 V111 V112 F117 L118 L139 L143	F62-F114 HydrophobicContact CE1-CD2 4.19Å; F110-F114 HydrophobicContact CZ-CD2 4.4Å; F110-F114 VanDerWaalsContact O-CB 3.22Å; F110-F114 WeakPolarHBondContact O-CB 3.32Å; F110-F114 PolarHBondContact O-N 3.46Å; V111-F114 PolarHBondContact O-N 2.83Å; V112-F114 VanDerWaalsContact C-N 3.33Å; V112-F114 PolarHBondContact O-N 2.83Å; F114-F117 WeakPolarHBondContact O-CB 3.46Å; F114-F117 PolarHBondContact O-N 3.32Å; F114-L118 HydrophobicContact CD1-CD1 3.79Å; F114-L118 HydrophobicContact CD1-CD2 4.37Å; F114-L118 HydrophobicContact CD1-CG 3.81Å; F114-L118 HydrophobicContact CE1-CD1 3.7Å; F114-L118 HydrophobicContact CE1-CD2 3.78Å; F114-L118 HydrophobicContact CE1-CG 3.71Å; F114-L118 HydrophobicContact CZ-CD2 4.31Å; F114-L118 WeakPolarHBondContact O-CG 3.28Å; F114-L118 PolarHBondContact O-N 3.37Å; F114-L139 HydrophobicContact CE1-CD2 3.75Å; F114-L139 HydrophobicContact CE1-CG 4.2Å; F114-L139 HydrophobicContact CZ-CD2 4.32Å; F114-L143 HydrophobicContact CB-CD1 4.36Å; F114-L143 HydrophobicContact CD1-CD1 3.25Å; F114-L143 HydrophobicContact CE1-CD1 3.74Å; F114-L143 HydrophobicContact CG-CD1 4.03Å
115	F	94.7	Very high	90	Very high	87 Å²	87	40.8 Å²	40.8	38%	0.382	19%	0.19	S	C	.	.	H	α-helix	trans	-59.4	-51.1	173	-175.2	-91.1	0	0	0	111.1	V111 V112 Y113 F117 L118 Y119	V111-F115 VanDerWaalsContact O-CB 3.24Å; V111-F115 WeakPolarHBondContact O-CB 3.4Å; V111-F115 PolarHBondContact O-N 3.47Å; V112-F115 WeakPolarHBondContact O-CB 3.38Å; V112-F115 PolarHBondContact O-N 2.98Å; Y113-F115 VanDerWaalsContact C-N 3.33Å; Y113-F115 PolarHBondContact O-N 3.49Å; F115-F117 VanDerWaalsContact C-N 3.26Å; F115-F117 PolarHBondContact O-N 3.38Å; F115-L118 PolarHBondContact O-N 3.13Å; F115-L118 VanDerWaalsContact O-N 3.11Å; F115-Y119 HydrophobicContact CD1-CD2 4.04Å; F115-Y119 HydrophobicContact CD1-CE2 4.48Å; F115-Y119 AromaticContact CD2-CD2 3.89Å; F115-Y119 HydrophobicContact CD2-CD2 3.89Å; F115-Y119 AromaticContact CD2-CE2 3.54Å; F115-Y119 HydrophobicContact CD2-CE2 3.54Å; F115-Y119 AromaticContact CE1-CD2 3.84Å; F115-Y119 HydrophobicContact CE1-CD2 3.84Å; F115-Y119 HydrophobicContact CE1-CE2 4.19Å; F115-Y119 AromaticContact CE2-CD2 3.7Å; F115-Y119 HydrophobicContact CE2-CD2 3.7Å; F115-Y119 AromaticContact CE2-CE2 3.19Å; F115-Y119 HydrophobicContact CE2-CE2 3.19Å; F115-Y119 AromaticContact CE2-CZ 4Å; F115-Y119 HydrophobicContact CG-CD2 4.05Å; F115-Y119 HydrophobicContact CG-CE2 4.18Å; F115-Y119 AromaticContact CZ-CD2 3.66Å; F115-Y119 HydrophobicContact CZ-CD2 3.66Å; F115-Y119 AromaticContact CZ-CE2 3.55Å; F115-Y119 HydrophobicContact CZ-CE2 3.55Å; F115-Y119 HydrophobicContact CZ-CG 4.49Å; F115-Y119 VanDerWaalsContact O-CD2 3.29Å; F115-Y119 WeakPolarHBondContact O-CD2 3.42Å; F115-Y119 PolarHBondContact O-N 3.09Å; F115-Y119 VanDerWaalsContact O-N 3.09Å
116	L	95	Very high	88	Confident	25 Å²	25	48.3 Å²	48.3	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-40.2	176.1	-65.5	172.2	0	0	0	111.7	V112 Y113 Y119 L120 V177 F180	V112-L116 HydrophobicContact CG1-CD1 4.26Å; V112-L116 WeakPolarHBondContact O-CG 3.35Å; V112-L116 PolarHBondContact O-N 3.43Å; Y113-L116 PolarHBondContact O-N 2.9Å; L116-Y119 PolarHBondContact O-N 3.46Å; L116-L120 HydrophobicContact CB-CD1 4.4Å; L116-L120 HydrophobicContact CD2-CD1 3.74Å; L116-L120 HydrophobicContact CD2-CG 4.48Å; L116-L120 WeakPolarHBondContact O-CA 3.5Å; L116-L120 VanDerWaalsContact O-CB 3.24Å; L116-L120 WeakPolarHBondContact O-CB 3.47Å; L116-L120 PolarHBondContact O-N 3.42Å; L116-V177 HydrophobicContact CD1-CB 4.42Å; L116-V177 HydrophobicContact CD1-CG2 4.14Å; L116-F180 HydrophobicContact CB-CD1 3.81Å; L116-F180 HydrophobicContact CB-CD2 3.75Å; L116-F180 HydrophobicContact CB-CE1 3.87Å; L116-F180 HydrophobicContact CB-CE2 3.82Å; L116-F180 HydrophobicContact CB-CG 3.74Å; L116-F180 HydrophobicContact CB-CZ 3.87Å; L116-F180 HydrophobicContact CD1-CB 3.72Å; L116-F180 HydrophobicContact CD1-CD1 3.89Å; L116-F180 HydrophobicContact CD1-CD2 4.49Å; L116-F180 HydrophobicContact CD1-CG 3.78Å; L116-F180 HydrophobicContact CG-CD1 4.41Å; L116-F180 HydrophobicContact CG-CG 4.42Å
117	F	91.8	Very high	86.2	Confident	60 Å²	60	56 Å²	56	26%	0.263	27%	0.271	S	S	.	.	I	π-helix	trans	-60.4	-46.5	174.2	174.1	-100.4	0	0	0	112.7	Y113 F114 F115 Y119 R121 M122 F180	Y113-F117 WeakPolarHBondContact O-CB 3.29Å; Y113-F117 PolarHBondContact O-N 3.03Å; F114-F117 WeakPolarHBondContact O-CB 3.46Å; F114-F117 PolarHBondContact O-N 3.32Å; F115-F117 VanDerWaalsContact C-N 3.26Å; F115-F117 PolarHBondContact O-N 3.38Å; F117-Y119 PolarHBondContact O-N 2.9Å; F117-R121 HydrophobicContact CD2-CB 3.9Å; F117-R121 HydrophobicContact CD2-CG 4Å; F117-R121 HydrophobicContact CE2-CB 4.37Å; F117-R121 HydrophobicContact CE2-CG 4.08Å; F117-R121 WeakPolarHBondContact O-CB 3.4Å; F117-R121 PolarHBondContact O-N 2.98Å; F117-M122 HydrophobicContact CD1-CE 4.25Å; F117-M122 HydrophobicContact CE1-CE 3.53Å; F117-M122 HydrophobicContact CZ-CE 4.18Å; F117-M122 PolarHBondContact O-N 2.87Å; F117-F180 HydrophobicContact CB-CE2 4.09Å
118	L	89.8	Confident	84.6	Confident	4 Å²	4	58 Å²	58	2%	0.021	29%	0.288	C	S	.	.	I	π-helix	trans	-64.3	-37.1	-179.8	-71.3	-178.8	0	0	0	113.5	F114 F115 M122 R136 L139	F114-L118 HydrophobicContact CD1-CD1 3.79Å; F114-L118 HydrophobicContact CD1-CD2 4.37Å; F114-L118 HydrophobicContact CD1-CG 3.81Å; F114-L118 HydrophobicContact CE1-CD1 3.7Å; F114-L118 HydrophobicContact CE1-CD2 3.78Å; F114-L118 HydrophobicContact CE1-CG 3.71Å; F114-L118 HydrophobicContact CZ-CD2 4.31Å; F114-L118 WeakPolarHBondContact O-CG 3.28Å; F114-L118 PolarHBondContact O-N 3.37Å; F115-L118 PolarHBondContact O-N 3.13Å; F115-L118 VanDerWaalsContact O-N 3.11Å; L118-M122 HydrophobicContact CD2-CE 3.65Å; L118-M122 HydrophobicContact CD2-SD 4.3Å; L118-R136 PolarHBondContact O-NH1 3.12Å; L118-L139 HydrophobicContact CD1-CB 4.46Å; L118-L139 HydrophobicContact CD1-CD2 3.95Å; L118-L139 HydrophobicContact CD1-CG 4.13Å; L118-L139 HydrophobicContact CD2-CD2 4.17Å
119	Y	89.3	Confident	83.4	Confident	68 Å²	68	64.1 Å²	64.1	27%	0.267	31%	0.311	S	S	.	.	I	π-helix	trans	-98.5	-35.6	-173.7	-70.9	-83	0	0	0	114.2	F115 L116 F117 H137 S140	F115-Y119 HydrophobicContact CD1-CD2 4.04Å; F115-Y119 HydrophobicContact CD1-CE2 4.48Å; F115-Y119 AromaticContact CD2-CD2 3.89Å; F115-Y119 HydrophobicContact CD2-CD2 3.89Å; F115-Y119 AromaticContact CD2-CE2 3.54Å; F115-Y119 HydrophobicContact CD2-CE2 3.54Å; F115-Y119 AromaticContact CE1-CD2 3.84Å; F115-Y119 HydrophobicContact CE1-CD2 3.84Å; F115-Y119 HydrophobicContact CE1-CE2 4.19Å; F115-Y119 AromaticContact CE2-CD2 3.7Å; F115-Y119 HydrophobicContact CE2-CD2 3.7Å; F115-Y119 AromaticContact CE2-CE2 3.19Å; F115-Y119 HydrophobicContact CE2-CE2 3.19Å; F115-Y119 AromaticContact CE2-CZ 4Å; F115-Y119 HydrophobicContact CG-CD2 4.05Å; F115-Y119 HydrophobicContact CG-CE2 4.18Å; F115-Y119 AromaticContact CZ-CD2 3.66Å; F115-Y119 HydrophobicContact CZ-CD2 3.66Å; F115-Y119 AromaticContact CZ-CE2 3.55Å; F115-Y119 HydrophobicContact CZ-CE2 3.55Å; F115-Y119 HydrophobicContact CZ-CG 4.49Å; F115-Y119 VanDerWaalsContact O-CD2 3.29Å; F115-Y119 WeakPolarHBondContact O-CD2 3.42Å; F115-Y119 PolarHBondContact O-N 3.09Å; F115-Y119 VanDerWaalsContact O-N 3.09Å; L116-Y119 PolarHBondContact O-N 3.46Å; F117-Y119 PolarHBondContact O-N 2.9Å; Y119-H137 AromaticContact CE1-CE1 3.81Å; Y119-H137 AromaticContact CZ-ND1 3.87Å; Y119-H137 PolarHBondContact OH-ND1 3.24Å; Y119-S140 WeakPolarHBondContact CE2-OG 3.34Å; Y119-S140 PolarHBondContact OH-OG 2.96Å; Y119-S140 VanDerWaalsContact OH-OG 3.06Å
120	L	89.4	Confident	82.5	Confident	108 Å²	108	69 Å²	69	57%	0.565	34%	0.344	S	S	*	.	I	π-helix	trans	-96.1	-33.8	-176	-55.3	-177	0	0	0	112.6	L116 F180 F181	L116-L120 HydrophobicContact CB-CD1 4.4Å; L116-L120 HydrophobicContact CD2-CD1 3.74Å; L116-L120 HydrophobicContact CD2-CG 4.48Å; L116-L120 WeakPolarHBondContact O-CA 3.5Å; L116-L120 VanDerWaalsContact O-CB 3.24Å; L116-L120 WeakPolarHBondContact O-CB 3.47Å; L116-L120 PolarHBondContact O-N 3.42Å; L120-F180 HydrophobicContact CB-CE1 4.28Å; L120-F180 HydrophobicContact CB-CZ 4.22Å; L120-F180 HydrophobicContact CD1-CE1 3.99Å; L120-F181 HydrophobicContact CD1-CZ 4.35Å
121	R	84.1	Confident	81.7	Confident	65 Å²	65	72.8 Å²	72.8	25%	0.245	37%	0.369	C	S	.	.	I	π-helix	trans	-100	-42.5	-172.4	-171.1	56.2	165	114.5	3.8	113.9	H58 F117 H123 F180 S209	H58-R121 PolarHBondContact NE2-NH2 3.14Å; F117-R121 HydrophobicContact CD2-CB 3.9Å; F117-R121 HydrophobicContact CD2-CG 4Å; F117-R121 HydrophobicContact CE2-CB 4.37Å; F117-R121 HydrophobicContact CE2-CG 4.08Å; F117-R121 WeakPolarHBondContact O-CB 3.4Å; F117-R121 PolarHBondContact O-N 2.98Å; R121-H123 PolarHBondContact O-N 3.36Å; R121-H123 VanDerWaalsContact O-N 3.11Å; R121-F180 HydrophobicContact CB-CZ 4.27Å; R121-S209 VanDerWaalsContact CZ-O 3.31Å; R121-S209 PolarHBondContact NH1-O 3.28Å; R121-S209 VanDerWaalsContact NH1-O 3.07Å; R121-S209 VanDerWaalsContact NH2-C 3.34Å; R121-S209 PolarHBondContact NH2-O 3.46Å
122	M	79.3	Confident	80.9	Confident	49 Å²	49	74.3 Å²	74.3	24%	0.241	38%	0.375	C	S	.	.	S	Bend	trans	-72.6	105.4	-176.7	-167.2	-178.7	-68.9	0	0	110.1	F117 L118 R136	F117-M122 HydrophobicContact CD1-CE 4.25Å; F117-M122 HydrophobicContact CE1-CE 3.53Å; F117-M122 HydrophobicContact CZ-CE 4.18Å; F117-M122 PolarHBondContact O-N 2.87Å; L118-M122 HydrophobicContact CD2-CE 3.65Å; L118-M122 HydrophobicContact CD2-SD 4.3Å; M122-R136 PolarHBondContact O-NH1 3.14Å; M122-R136 PolarHBondContact O-NH2 3.05Å
123	H	70.9	Confident	80.3	Confident	129 Å²	129	76.2 Å²	76.2	60%	0.597	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-74.4	140.1	179.8	-166.6	-84.5	0	0	0	110.9	R121 P212	R121-H123 PolarHBondContact O-N 3.36Å; R121-H123 VanDerWaalsContact O-N 3.11Å; H123-P212 HydrophobicContact CB-CB 3.84Å
124	Q	64.1	Low	79.8	Confident	53 Å²	53	80.9 Å²	80.9	25%	0.248	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-71.5	143	178.2	-100.6	170.8	-27.3	0	0	111.2	R129 E132	Q124-R129 PolarHBondContact NE2-O 2.89Å; Q124-E132 WeakPolarHBondContact CA-OE2 3.29Å; Q124-E132 WeakPolarHBondContact CG-OE2 3.35Å
125	T	60.1	Low	79.4	Confident	44 Å²	44	86.6 Å²	86.6	27%	0.27	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-93.7	137.2	167.5	75.4	0	0	0	0	109.8	N127 E132 N213	T125-N127 PolarHBondContact O-N 2.99Å; T125-N127 VanDerWaalsContact O-N 3.1Å; T125-E132 PolarHBondContact N-OE2 3.43Å; T125-E132 PolarHBondContact OG1-OE1 3.19Å; T125-N213 HydrophobicContact CG2-CB 4.1Å
126	N	58.1	Low	79.2	Confident	159 Å²	159	83.2 Å²	83.2	85%	0.85	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.8	-163.6	-133.4	7.7	0	0	0	114.5
127	N	60	Low	79	Confident	168 Å²	168	85.9 Å²	85.9	90%	0.898	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-10.8	-170.8	-81.1	-9.2	0	0	0	115.1	T125	T125-N127 PolarHBondContact O-N 2.99Å; T125-N127 VanDerWaalsContact O-N 3.1Å
128	A	65.1	Low	79.1	Confident	42 Å²	42	86.9 Å²	86.9	35%	0.347	43%	0.433	S	S	.	.			trans	-144.9	38.8	-175.1	0	0	0	0	0	114.2	C130 V131 E132	A128-C130 VanDerWaalsContact C-N 3.34Å; A128-C130 PolarHBondContact O-N 3.48Å; A128-V131 PolarHBondContact O-N 3.45Å; A128-E132 HydrophobicContact CB-CG 4.47Å; A128-E132 PolarHBondContact O-N 3.43Å
129	R	72.9	Confident	79.3	Confident	172 Å²	172	88.8 Å²	88.8	65%	0.649	44%	0.443	S	S	*	.	H	α-helix	trans	-50.8	-44.9	-171.3	-167.7	179.7	-178.3	-174.7	-3.3	114.6	Q124 L133	Q124-R129 PolarHBondContact NE2-O 2.89Å; R129-L133 VanDerWaalsContact O-CB 3.26Å; R129-L133 WeakPolarHBondContact O-CB 3.47Å; R129-L133 PolarHBondContact O-N 2.98Å
130	C	79.8	Confident	79.5	Confident	103 Å²	103	85.8 Å²	85.8	70%	0.696	43%	0.432	S	S	*	.	H	α-helix	trans	-67.3	-46.9	-178	-176.8	0	0	0	0	112.2	A128 L133 L134	A128-C130 VanDerWaalsContact C-N 3.34Å; A128-C130 PolarHBondContact O-N 3.48Å; C130-L133 PolarHBondContact O-N 3.2Å; C130-L134 WeakPolarHBondContact O-CB 3.44Å; C130-L134 PolarHBondContact O-N 3.3Å
131	V	82.7	Confident	79.8	Confident	105 Å²	105	86.3 Å²	86.3	64%	0.636	43%	0.434	S	S	*	.	H	α-helix	trans	-66.6	-42.6	-179.4	178.8	0	0	0	0	110.9	A128 L133 L134 W135	A128-V131 PolarHBondContact O-N 3.45Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 2.99Å; V131-L134 PolarHBondContact O-N 3.02Å; V131-W135 WeakPolarHBondContact O-CB 3.31Å; V131-W135 PolarHBondContact O-N 2.99Å
132	E	80.3	Confident	80.4	Confident	36 Å²	36	87 Å²	87	17%	0.168	45%	0.446	C	S	.	.	H	α-helix	trans	-62.3	-41.5	175.9	-72.3	-171.3	173.5	0	0	111.8	Q124 T125 A128 R136	Q124-E132 WeakPolarHBondContact CA-OE2 3.29Å; Q124-E132 WeakPolarHBondContact CG-OE2 3.35Å; T125-E132 PolarHBondContact N-OE2 3.43Å; T125-E132 PolarHBondContact OG1-OE1 3.19Å; A128-E132 HydrophobicContact CB-CG 4.47Å; A128-E132 PolarHBondContact O-N 3.43Å; E132-R136 VanDerWaalsContact O-CG 3.29Å; E132-R136 WeakPolarHBondContact O-CG 3.3Å; E132-R136 PolarHBondContact O-N 3.37Å; E132-R136 VanDerWaalsContact O-N 3.1Å
133	L	85.1	Confident	81.2	Confident	68 Å²	68	86 Å²	86	36%	0.356	44%	0.441	S	S	.	.	H	α-helix	trans	-68.2	-44	179.1	-163.8	75.9	0	0	0	111.5	R129 C130 V131 W135 R136 H137	R129-L133 VanDerWaalsContact O-CB 3.26Å; R129-L133 WeakPolarHBondContact O-CB 3.47Å; R129-L133 PolarHBondContact O-N 2.98Å; C130-L133 PolarHBondContact O-N 3.2Å; V131-L133 VanDerWaalsContact C-N 3.34Å; V131-L133 PolarHBondContact O-N 2.99Å; L133-W135 VanDerWaalsContact C-N 3.35Å; L133-W135 PolarHBondContact O-N 3.17Å; L133-R136 PolarHBondContact O-N 3.15Å; L133-H137 PolarHBondContact O-CD2 3.26Å; L133-H137 PolarHBondContact O-N 3.39Å
134	L	88.9	Confident	82.4	Confident	103 Å²	103	82.8 Å²	82.8	54%	0.539	43%	0.428	S	S	.	.	H	α-helix	trans	-59.4	-45.7	176.4	-178.7	64.1	0	0	0	111.3	C130 V131 R136 H137 I138	C130-L134 WeakPolarHBondContact O-CB 3.44Å; C130-L134 PolarHBondContact O-N 3.3Å; V131-L134 PolarHBondContact O-N 3.02Å; L134-R136 VanDerWaalsContact C-N 3.35Å; L134-R136 PolarHBondContact O-N 2.84Å; L134-H137 PolarHBondContact O-N 3.29Å; L134-I138 HydrophobicContact CD1-CD1 4.11Å; L134-I138 HydrophobicContact CD1-CG1 4.35Å; L134-I138 HydrophobicContact CD2-CD1 4.48Å; L134-I138 HydrophobicContact CG-CD1 3.86Å; L134-I138 HydrophobicContact CG-CG1 4.47Å; L134-I138 WeakPolarHBondContact O-CG1 3.34Å; L134-I138 PolarHBondContact O-N 2.69Å
135	W	87.2	Confident	83.9	Confident	171 Å²	171	82.2 Å²	82.2	65%	0.648	44%	0.437	S	S	*	.	H	α-helix	trans	-59.7	-43.5	176.6	177	-103.5	0	0	0	112.2	V131 L133 H137 I138 L139	V131-W135 WeakPolarHBondContact O-CB 3.31Å; V131-W135 PolarHBondContact O-N 2.99Å; L133-W135 VanDerWaalsContact C-N 3.35Å; L133-W135 PolarHBondContact O-N 3.17Å; W135-H137 PolarHBondContact O-N 2.95Å; W135-I138 PolarHBondContact O-N 3.19Å; W135-L139 VanDerWaalsContact O-CB 3.28Å; W135-L139 WeakPolarHBondContact O-CB 3.36Å; W135-L139 PolarHBondContact O-N 2.98Å
136	R	89.5	Confident	85.6	Confident	15 Å²	15	82.2 Å²	82.2	6%	0.057	44%	0.436	C	S	.	.	H	α-helix	trans	-60.4	-44.1	175.8	-71.8	172.5	-169.9	-152.4	7.3	111.8	L118 M122 E132 L133 L134 S140	L118-R136 PolarHBondContact O-NH1 3.12Å; M122-R136 PolarHBondContact O-NH1 3.14Å; M122-R136 PolarHBondContact O-NH2 3.05Å; E132-R136 VanDerWaalsContact O-CG 3.29Å; E132-R136 WeakPolarHBondContact O-CG 3.3Å; E132-R136 PolarHBondContact O-N 3.37Å; E132-R136 VanDerWaalsContact O-N 3.1Å; L133-R136 PolarHBondContact O-N 3.15Å; L134-R136 VanDerWaalsContact C-N 3.35Å; L134-R136 PolarHBondContact O-N 2.84Å; R136-S140 WeakPolarHBondContact O-CB 3.4Å; R136-S140 PolarHBondContact O-N 3.32Å; R136-S140 PolarHBondContact O-OG 2.97Å
137	H	91.5	Very high	87.5	Confident	81 Å²	81	74.6 Å²	74.6	38%	0.375	40%	0.396	S	S	.	.	H	α-helix	trans	-64.8	-47.3	177.9	-72.1	-52.9	0	0	0	112.2	Y119 L133 L134 W135 L139 S140 I141	Y119-H137 AromaticContact CE1-CE1 3.81Å; Y119-H137 AromaticContact CZ-ND1 3.87Å; Y119-H137 PolarHBondContact OH-ND1 3.24Å; L133-H137 PolarHBondContact O-CD2 3.26Å; L133-H137 PolarHBondContact O-N 3.39Å; L134-H137 PolarHBondContact O-N 3.29Å; W135-H137 PolarHBondContact O-N 2.95Å; H137-L139 VanDerWaalsContact C-N 3.35Å; H137-L139 PolarHBondContact O-N 3.45Å; H137-S140 WeakPolarHBondContact O-CB 3.46Å; H137-S140 PolarHBondContact O-N 2.84Å; H137-I141 VanDerWaalsContact O-CG1 3.31Å; H137-I141 WeakPolarHBondContact O-CG1 3.4Å; H137-I141 PolarHBondContact O-N 3.45Å
138	I	93.9	Very high	89.3	Confident	81 Å²	81	72.4 Å²	72.4	42%	0.415	38%	0.378	S	S	.	.	H	α-helix	trans	-56.8	-51	176.7	-69.5	169.7	0	0	0	109.9	L134 W135 S140 I141 T142	L134-I138 HydrophobicContact CD1-CD1 4.11Å; L134-I138 HydrophobicContact CD1-CG1 4.35Å; L134-I138 HydrophobicContact CD2-CD1 4.48Å; L134-I138 HydrophobicContact CG-CD1 3.86Å; L134-I138 HydrophobicContact CG-CG1 4.47Å; L134-I138 WeakPolarHBondContact O-CG1 3.34Å; L134-I138 PolarHBondContact O-N 2.69Å; W135-I138 PolarHBondContact O-N 3.19Å; I138-S140 VanDerWaalsContact C-N 3.3Å; I138-S140 PolarHBondContact O-N 3.39Å; I138-I141 PolarHBondContact O-N 3.29Å; I138-T142 PolarHBondContact O-N 3.42Å; I138-T142 PolarHBondContact O-OG1 3.17Å
139	L	93.1	Very high	90.8	Very high	45 Å²	45	72.4 Å²	72.4	24%	0.236	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-41.1	179.2	-177.1	56.7	0	0	0	112.1	F114 L118 W135 H137 T142 L143	F114-L139 HydrophobicContact CE1-CD2 3.75Å; F114-L139 HydrophobicContact CE1-CG 4.2Å; F114-L139 HydrophobicContact CZ-CD2 4.32Å; L118-L139 HydrophobicContact CD1-CB 4.46Å; L118-L139 HydrophobicContact CD1-CD2 3.95Å; L118-L139 HydrophobicContact CD1-CG 4.13Å; L118-L139 HydrophobicContact CD2-CD2 4.17Å; W135-L139 VanDerWaalsContact O-CB 3.28Å; W135-L139 WeakPolarHBondContact O-CB 3.36Å; W135-L139 PolarHBondContact O-N 2.98Å; H137-L139 VanDerWaalsContact C-N 3.35Å; H137-L139 PolarHBondContact O-N 3.45Å; L139-T142 PolarHBondContact O-N 3.42Å; L139-L143 HydrophobicContact CD1-CD1 4.37Å; L139-L143 HydrophobicContact CD1-CG 4.4Å; L139-L143 HydrophobicContact CG-CD1 4.23Å; L139-L143 WeakPolarHBondContact O-CB 3.39Å; L139-L143 VanDerWaalsContact O-CG 3.25Å; L139-L143 WeakPolarHBondContact O-CG 3.17Å; L139-L143 PolarHBondContact O-N 2.97Å
140	S	93.8	Very high	92	Very high	5 Å²	5	64.2 Å²	64.2	4%	0.035	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-45.1	177.7	-56.8	0	0	0	0	112.1	Y119 R136 H137 I138 L143 L144	Y119-S140 WeakPolarHBondContact CE2-OG 3.34Å; Y119-S140 PolarHBondContact OH-OG 2.96Å; Y119-S140 VanDerWaalsContact OH-OG 3.06Å; R136-S140 WeakPolarHBondContact O-CB 3.4Å; R136-S140 PolarHBondContact O-N 3.32Å; R136-S140 PolarHBondContact O-OG 2.97Å; H137-S140 WeakPolarHBondContact O-CB 3.46Å; H137-S140 PolarHBondContact O-N 2.84Å; I138-S140 VanDerWaalsContact C-N 3.3Å; I138-S140 PolarHBondContact O-N 3.39Å; S140-L143 PolarHBondContact O-N 2.91Å; S140-L144 WeakPolarHBondContact O-CG 3.47Å; S140-L144 PolarHBondContact O-N 3.17Å
141	I	95.6	Very high	92.8	Very high	118 Å²	118	59.7 Å²	59.7	61%	0.605	31%	0.314	S	S	*	.	H	α-helix	trans	-63.5	-43.5	177.8	-68.4	165.2	0	0	0	110.2	H137 I138 L143 L144 G145	H137-I141 VanDerWaalsContact O-CG1 3.31Å; H137-I141 WeakPolarHBondContact O-CG1 3.4Å; H137-I141 PolarHBondContact O-N 3.45Å; I138-I141 PolarHBondContact O-N 3.29Å; I141-L143 PolarHBondContact O-N 3.37Å; I141-L144 PolarHBondContact O-N 3.22Å; I141-G145 PolarHBondContact O-N 2.89Å
142	T	96	Very high	93.4	Very high	81 Å²	81	59.6 Å²	59.6	50%	0.497	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-45.4	175.7	-58.7	0	0	0	0	111.6	I138 L139 G145 V146	I138-T142 PolarHBondContact O-N 3.42Å; I138-T142 PolarHBondContact O-OG1 3.17Å; L139-T142 PolarHBondContact O-N 3.42Å; T142-G145 PolarHBondContact O-N 3.31Å; T142-V146 WeakPolarHBondContact O-CG2 3.49Å; T142-V146 PolarHBondContact O-N 2.97Å
143	L	95.8	Very high	94.1	Very high	27 Å²	27	57.9 Å²	57.9	14%	0.141	30%	0.295	C	S	.	.	H	α-helix	trans	-64.4	-40.6	178.7	-74.3	173.3	0	0	0	112.6	F110 V111 F114 L139 S140 I141 V146 A147	F110-L143 HydrophobicContact CE1-CD2 3.98Å; V111-L143 HydrophobicContact CG1-CB 4.07Å; V111-L143 HydrophobicContact CG2-CB 4.06Å; V111-L143 WeakPolarHBondContact CG2-O 3.47Å; F114-L143 HydrophobicContact CB-CD1 4.36Å; F114-L143 HydrophobicContact CD1-CD1 3.25Å; F114-L143 HydrophobicContact CE1-CD1 3.74Å; F114-L143 HydrophobicContact CG-CD1 4.03Å; L139-L143 HydrophobicContact CD1-CD1 4.37Å; L139-L143 HydrophobicContact CD1-CG 4.4Å; L139-L143 HydrophobicContact CG-CD1 4.23Å; L139-L143 WeakPolarHBondContact O-CB 3.39Å; L139-L143 VanDerWaalsContact O-CG 3.25Å; L139-L143 WeakPolarHBondContact O-CG 3.17Å; L139-L143 PolarHBondContact O-N 2.97Å; S140-L143 PolarHBondContact O-N 2.91Å; I141-L143 PolarHBondContact O-N 3.37Å; L143-V146 WeakPolarHBondContact O-CB 3.35Å; L143-V146 PolarHBondContact O-N 2.94Å; L143-A147 PolarHBondContact O-N 2.95Å
144	L	96.4	Very high	94.6	Very high	62 Å²	62	55 Å²	55	33%	0.325	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-46	172.8	-73.9	170.6	0	0	0	111.1	W108 V111 S140 I141 V146 A147 F148	W108-L144 HydrophobicContact CH2-CD2 4.4Å; W108-L144 HydrophobicContact CZ3-CD2 4.18Å; V111-L144 HydrophobicContact CG1-CD2 4.05Å; V111-L144 HydrophobicContact CG1-CG 4.46Å; S140-L144 WeakPolarHBondContact O-CG 3.47Å; S140-L144 PolarHBondContact O-N 3.17Å; I141-L144 PolarHBondContact O-N 3.22Å; L144-V146 VanDerWaalsContact C-N 3.26Å; L144-V146 PolarHBondContact O-N 3.32Å; L144-A147 PolarHBondContact O-N 2.99Å; L144-A147 VanDerWaalsContact O-N 3.12Å; L144-F148 WeakPolarHBondContact O-CD2 3.45Å; L144-F148 PolarHBondContact O-N 3.28Å
145	G	97.1	Very high	94.8	Very high	41 Å²	41	51.1 Å²	51.1	42%	0.423	26%	0.26	S	S	.	.	H	α-helix	trans	-56.6	-40.5	174.7	0	0	0	0	0	112.6	I141 T142 S149	I141-G145 PolarHBondContact O-N 2.89Å; T142-G145 PolarHBondContact O-N 3.31Å; G145-S149 VanDerWaalsContact O-CB 3.26Å; G145-S149 WeakPolarHBondContact O-CB 3.39Å; G145-S149 PolarHBondContact O-N 2.92Å
146	V	96	Very high	94.9	Very high	43 Å²	43	46.9 Å²	46.9	26%	0.261	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-47.8	173.5	165.5	0	0	0	0	111.8	L39 I107 T142 L143 L144 F148 S149 V150	L39-V146 HydrophobicContact CD1-CG1 3.56Å; I107-V146 HydrophobicContact CD1-CG1 4.09Å; I107-V146 HydrophobicContact CG1-CG1 4.31Å; T142-V146 WeakPolarHBondContact O-CG2 3.49Å; T142-V146 PolarHBondContact O-N 2.97Å; L143-V146 WeakPolarHBondContact O-CB 3.35Å; L143-V146 PolarHBondContact O-N 2.94Å; L144-V146 VanDerWaalsContact C-N 3.26Å; L144-V146 PolarHBondContact O-N 3.32Å; V146-F148 VanDerWaalsContact C-N 3.33Å; V146-F148 PolarHBondContact O-N 2.95Å; V146-S149 PolarHBondContact O-N 2.86Å; V146-V150 HydrophobicContact CG1-CG2 4.31Å; V146-V150 WeakPolarHBondContact O-CG2 3.5Å; V146-V150 PolarHBondContact O-N 2.74Å
147	A	97.3	Very high	94.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-42.8	179	0	0	0	0	0	112.5	I107 W108 V111 L143 L144 S151	I107-A147 HydrophobicContact CG1-CB 4.15Å; I107-A147 HydrophobicContact CG2-CB 4.1Å; W108-A147 HydrophobicContact CD2-CB 4.26Å; W108-A147 HydrophobicContact CZ2-CB 4.26Å; V111-A147 HydrophobicContact CB-CB 4.4Å; V111-A147 HydrophobicContact CG2-CB 3.97Å; L143-A147 PolarHBondContact O-N 2.95Å; L144-A147 PolarHBondContact O-N 2.99Å; L144-A147 VanDerWaalsContact O-N 3.12Å; A147-S151 VanDerWaalsContact O-CB 3.23Å; A147-S151 WeakPolarHBondContact O-CB 3.49Å; A147-S151 PolarHBondContact O-N 3.29Å; A147-S151 PolarHBondContact O-OG 3.47Å
148	F	97.6	Very high	94.8	Very high	122 Å²	122	44.1 Å²	44.1	54%	0.535	23%	0.233	S	C	.	.	H	α-helix	trans	-65.8	-43.8	175.1	-75.8	-64	0	0	0	112	W108 L144 V146 S151 Y152	W108-F148 AromaticContact CH2-CE1 3.97Å; W108-F148 HydrophobicContact CH2-CE1 3.97Å; W108-F148 HydrophobicContact CH2-CE2 4.04Å; W108-F148 AromaticContact CH2-CZ 3.66Å; W108-F148 HydrophobicContact CH2-CZ 3.66Å; W108-F148 HydrophobicContact CZ2-CD1 4.01Å; W108-F148 AromaticContact CZ2-CE1 3.68Å; W108-F148 HydrophobicContact CZ2-CE1 3.68Å; W108-F148 HydrophobicContact CZ2-CE2 4.36Å; W108-F148 HydrophobicContact CZ2-CG 4.49Å; W108-F148 AromaticContact CZ2-CZ 3.87Å; W108-F148 HydrophobicContact CZ2-CZ 3.87Å; L144-F148 WeakPolarHBondContact O-CD2 3.45Å; L144-F148 PolarHBondContact O-N 3.28Å; V146-F148 VanDerWaalsContact C-N 3.33Å; V146-F148 PolarHBondContact O-N 2.95Å; F148-S151 PolarHBondContact O-N 3.23Å; F148-Y152 VanDerWaalsContact O-CB 3.28Å; F148-Y152 WeakPolarHBondContact O-CB 3.23Å; F148-Y152 PolarHBondContact O-N 3.29Å
149	S	97	Very high	94.5	Very high	42 Å²	42	40.6 Å²	40.6	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-61.2	-47.9	178.1	-176.7	0	0	0	0	112.1	G145 V146 S151 Y152 S153	G145-S149 VanDerWaalsContact O-CB 3.26Å; G145-S149 WeakPolarHBondContact O-CB 3.39Å; G145-S149 PolarHBondContact O-N 2.92Å; V146-S149 PolarHBondContact O-N 2.86Å; S149-S151 VanDerWaalsContact C-N 3.34Å; S149-S151 PolarHBondContact O-N 2.93Å; S149-Y152 PolarHBondContact O-N 2.83Å; S149-S153 WeakPolarHBondContact O-CB 3.44Å; S149-S153 PolarHBondContact O-N 3.46Å
150	V	97.2	Very high	94.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-44.5	175.3	172.8	0	0	0	0	110.6	T36 L39 H103 I107 V146 S153 R154	T36-V150 WeakPolarHBondContact O-CG2 3.42Å; L39-V150 HydrophobicContact CB-CG2 4.19Å; L39-V150 HydrophobicContact CD1-CG2 3.88Å; H103-V150 HydrophobicContact CB-CG1 4.19Å; I107-V150 HydrophobicContact CB-CB 4.49Å; I107-V150 HydrophobicContact CB-CG1 4.26Å; I107-V150 HydrophobicContact CG1-CB 4.36Å; I107-V150 HydrophobicContact CG1-CG2 4.27Å; I107-V150 HydrophobicContact CG2-CB 4.17Å; I107-V150 HydrophobicContact CG2-CG1 4.05Å; V146-V150 HydrophobicContact CG1-CG2 4.31Å; V146-V150 WeakPolarHBondContact O-CG2 3.5Å; V146-V150 PolarHBondContact O-N 2.74Å; V150-S153 WeakPolarHBondContact O-CB 3.34Å; V150-S153 PolarHBondContact O-N 3.35Å; V150-S153 PolarHBondContact O-OG 3.25Å; V150-R154 WeakPolarHBondContact O-CG 3.37Å
151	S	96.9	Very high	94.6	Very high	8 Å²	8	40.5 Å²	40.5	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-45.7	178.8	-65.8	0	0	0	0	111.8	S104 W108 A147 F148 S149 S153 R154	S104-S151 PolarHBondContact OG-OG 3.43Å; W108-S151 PolarHBondContact NE1-OG 3.42Å; A147-S151 VanDerWaalsContact O-CB 3.23Å; A147-S151 WeakPolarHBondContact O-CB 3.49Å; A147-S151 PolarHBondContact O-N 3.29Å; A147-S151 PolarHBondContact O-OG 3.47Å; F148-S151 PolarHBondContact O-N 3.23Å; S149-S151 VanDerWaalsContact C-N 3.34Å; S149-S151 PolarHBondContact O-N 2.93Å; S151-S153 VanDerWaalsContact C-N 3.34Å; S151-S153 PolarHBondContact O-N 3.28Å; S151-R154 WeakPolarHBondContact O-CB 3.07Å; S151-R154 PolarHBondContact O-N 2.9Å
152	Y	96.1	Very high	94.5	Very high	102 Å²	102	42.7 Å²	42.7	40%	0.4	22%	0.217	S	C	.	.	H	α-helix	trans	-62.9	-39.6	177.3	-179.9	-110	0	0	0	112.2	L33 F148 S149 R154 V155 Y156 W162	L33-Y152 HydrophobicContact CD1-CD1 4.06Å; L33-Y152 HydrophobicContact CD1-CE1 3.91Å; L33-Y152 HydrophobicContact CD2-CD1 4.06Å; F148-Y152 VanDerWaalsContact O-CB 3.28Å; F148-Y152 WeakPolarHBondContact O-CB 3.23Å; F148-Y152 PolarHBondContact O-N 3.29Å; S149-Y152 PolarHBondContact O-N 2.83Å; Y152-R154 PolarHBondContact O-N 3.31Å; Y152-R154 VanDerWaalsContact O-N 3.11Å; Y152-V155 PolarHBondContact O-N 2.8Å; Y152-Y156 AromaticContact CE1-CD2 4Å; Y152-Y156 HydrophobicContact CE1-CD2 4Å; Y152-Y156 HydrophobicContact CE1-CG 4.27Å; Y152-Y156 AromaticContact CZ-CD2 3.87Å; Y152-Y156 WeakPolarHBondContact O-CB 3.48Å; Y152-Y156 PolarHBondContact O-N 3.47Å; Y152-Y156 WeakPolarHBondContact OH-CD2 3.47Å; Y152-W162 AromaticContact CD2-CH2 3.72Å; Y152-W162 HydrophobicContact CD2-CH2 3.72Å; Y152-W162 HydrophobicContact CD2-CZ2 4.35Å; Y152-W162 HydrophobicContact CE2-CH2 4.09Å; Y152-W162 HydrophobicContact CE2-CZ2 4.34Å
153	S	94.8	Very high	94.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-54	-35.1	177.3	79.6	0	0	0	0	112.2	L33 S149 V150 S151 L157	L33-S153 WeakPolarHBondContact O-CB 3.46Å; S149-S153 WeakPolarHBondContact O-CB 3.44Å; S149-S153 PolarHBondContact O-N 3.46Å; V150-S153 WeakPolarHBondContact O-CB 3.34Å; V150-S153 PolarHBondContact O-N 3.35Å; V150-S153 PolarHBondContact O-OG 3.25Å; S151-S153 VanDerWaalsContact C-N 3.34Å; S151-S153 PolarHBondContact O-N 3.28Å; S153-L157 WeakPolarHBondContact O-CB 3.5Å; S153-L157 VanDerWaalsContact O-CG 3.26Å; S153-L157 WeakPolarHBondContact O-CG 3.47Å; S153-L157 PolarHBondContact O-N 3.39Å
154	R	94.3	Very high	94.5	Very high	8 Å²	8	40 Å²	40	3%	0.03	20%	0.203	C	C	.	.	H	α-helix	trans	-72.5	-32.2	-178.5	-58.2	-47.2	-68.1	166.9	-2.3	113.1	H103 V150 S151 Y152 Y159 H160 V165	H103-R154 HydrophobicContact CB-CG 3.91Å; V150-R154 WeakPolarHBondContact O-CG 3.37Å; S151-R154 WeakPolarHBondContact O-CB 3.07Å; S151-R154 PolarHBondContact O-N 2.9Å; Y152-R154 PolarHBondContact O-N 3.31Å; Y152-R154 VanDerWaalsContact O-N 3.11Å; R154-Y159 VanDerWaalsContact CZ-CB 3.47Å; R154-Y159 PolarHBondContact O-N 3.39Å; R154-H160 HydrophobicContact CB-CB 4.24Å; R154-H160 PolarHBondContact O-N 2.94Å; R154-V165 HydrophobicContact CB-CG2 3.99Å
155	V	93.3	Very high	94.6	Very high	21 Å²	21	37.5 Å²	37.5	13%	0.127	19%	0.19	C	C	.	.	H	α-helix	trans	-79.8	-47.3	176.1	-173.6	0	0	0	0	110.3	Y152 L157 L158 H160 W162 V165	Y152-V155 PolarHBondContact O-N 2.8Å; V155-L157 VanDerWaalsContact C-N 3.32Å; V155-L157 PolarHBondContact O-N 2.63Å; V155-L158 PolarHBondContact O-N 3.19Å; V155-H160 WeakPolarHBondContact CA-O 3.39Å; V155-W162 HydrophobicContact CB-CD2 4.41Å; V155-W162 HydrophobicContact CB-CZ2 4.45Å; V155-W162 HydrophobicContact CG1-CD2 3.94Å; V155-W162 HydrophobicContact CG1-CG 4.16Å; V155-W162 HydrophobicContact CG1-CZ2 4.05Å; V155-W162 HydrophobicContact CG2-CD2 3.95Å; V155-W162 HydrophobicContact CG2-CE3 3.9Å; V155-W162 HydrophobicContact CG2-CG 4.41Å; V155-W162 HydrophobicContact CG2-CZ3 4.27Å; V155-V165 HydrophobicContact CG2-CB 4.25Å; V155-V165 HydrophobicContact CG2-CG2 3.69Å
156	Y	90.6	Very high	94.6	Very high	82 Å²	82	41.8 Å²	41.8	32%	0.322	20%	0.198	S	C	.	.	H	α-helix	trans	-60.4	-42.1	-179	-175.4	-85.2	0	0	0	112.1	D27 T29 L33 Y152 L158	D27-Y156 PolarHBondContact OD1-OH 3.04Å; D27-Y156 WeakPolarHBondContact OD2-CE1 3.5Å; D27-Y156 PolarHBondContact OD2-OH 3.31Å; T29-Y156 HydrophobicContact CG2-CE1 4.36Å; T29-Y156 HydrophobicContact CG2-CE2 4.34Å; L33-Y156 HydrophobicContact CD1-CD1 3.46Å; L33-Y156 VanDerWaalsContact CD1-CD1 3.46Å; L33-Y156 HydrophobicContact CD1-CD2 4.16Å; L33-Y156 HydrophobicContact CD1-CE1 4.05Å; L33-Y156 HydrophobicContact CD1-CG 3.52Å; Y152-Y156 AromaticContact CE1-CD2 4Å; Y152-Y156 HydrophobicContact CE1-CD2 4Å; Y152-Y156 HydrophobicContact CE1-CG 4.27Å; Y152-Y156 AromaticContact CZ-CD2 3.87Å; Y152-Y156 WeakPolarHBondContact O-CB 3.48Å; Y152-Y156 PolarHBondContact O-N 3.47Å; Y152-Y156 WeakPolarHBondContact OH-CD2 3.47Å; Y156-L158 PolarHBondContact O-N 3.36Å
157	L	88.8	Confident	94.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	11.5	177.8	-63	172.6	0	0	0	113.4	F23 L33 A34 H90 S153 V155 Y159	F23-L157 HydrophobicContact CB-CD2 3.87Å; L33-L157 HydrophobicContact CB-CD1 4.42Å; A34-L157 HydrophobicContact CB-CD1 4.09Å; H90-L157 PolarHBondContact NE2-O 3.06Å; H90-L157 VanDerWaalsContact NE2-O 3.09Å; S153-L157 WeakPolarHBondContact O-CB 3.5Å; S153-L157 VanDerWaalsContact O-CG 3.26Å; S153-L157 WeakPolarHBondContact O-CG 3.47Å; S153-L157 PolarHBondContact O-N 3.39Å; V155-L157 VanDerWaalsContact C-N 3.32Å; V155-L157 PolarHBondContact O-N 2.63Å; L157-Y159 HydrophobicContact CB-CD2 3.59Å; L157-Y159 HydrophobicContact CB-CE2 3.76Å; L157-Y159 HydrophobicContact CD1-CE2 4.36Å; L157-Y159 WeakPolarHBondContact O-CD2 3.24Å; L157-Y159 PolarHBondContact O-N 2.94Å; L157-Y159 VanDerWaalsContact O-N 3.15Å
158	L	89.3	Confident	94.8	Very high	37 Å²	37	45.3 Å²	45.3	19%	0.194	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	22.3	175	-53	176.7	0	0	0	115.5	Y6 W13 P85 V155 Y156	Y6-L158 HydrophobicContact CD1-CD1 4.46Å; W13-L158 HydrophobicContact CH2-CD1 4.37Å; P85-L158 WeakPolarHBondContact CG-O 3.43Å; V155-L158 PolarHBondContact O-N 3.19Å; Y156-L158 PolarHBondContact O-N 3.36Å
159	Y	88.6	Confident	94.8	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.027	19%	0.185	C	C	.	.	S	Bend	trans	-79.4	-28.7	175.1	-77.7	-91.3	0	0	0	113.3	E22 R84 H90 L93 R154 L157	E22-Y159 PolarHBondContact N-OH 3.12Å; E22-Y159 PolarHBondContact O-OH 3.32Å; R84-Y159 PolarHBondContact NH1-O 3.25Å; H90-Y159 HydrophobicContact CB-CE1 4.41Å; H90-Y159 AromaticContact CD2-CD1 3.81Å; H90-Y159 AromaticContact CD2-CE1 3.79Å; H90-Y159 AromaticContact CE1-CE2 3.65Å; H90-Y159 AromaticContact CE1-CZ 3.64Å; H90-Y159 AromaticContact CG-CE1 3.86Å; H90-Y159 AromaticContact ND1-CZ 3.78Å; H90-Y159 AromaticContact NE2-CD2 3.73Å; H90-Y159 AromaticContact NE2-CE1 4Å; H90-Y159 AromaticContact NE2-CE2 3.64Å; H90-Y159 AromaticContact NE2-CG 3.93Å; H90-Y159 AromaticContact NE2-CZ 3.78Å; L93-Y159 HydrophobicContact CD1-CD1 4.1Å; L93-Y159 HydrophobicContact CD1-CE1 4.38Å; L93-Y159 HydrophobicContact CD2-CD1 3.9Å; L93-Y159 HydrophobicContact CD2-CE1 3.86Å; L93-Y159 HydrophobicContact CG-CD1 4.41Å; L93-Y159 HydrophobicContact CG-CE1 4.29Å; R154-Y159 VanDerWaalsContact CZ-CB 3.47Å; R154-Y159 PolarHBondContact O-N 3.39Å; L157-Y159 HydrophobicContact CB-CD2 3.59Å; L157-Y159 HydrophobicContact CB-CE2 3.76Å; L157-Y159 HydrophobicContact CD1-CE2 4.36Å; L157-Y159 WeakPolarHBondContact O-CD2 3.24Å; L157-Y159 PolarHBondContact O-N 2.94Å; L157-Y159 VanDerWaalsContact O-N 3.15Å
160	H	92.8	Very high	94.9	Very high	3 Å²	3	40.9 Å²	40.9	1%	0.014	19%	0.19	C	C	.	.	S	Bend	trans	-148.3	153	-173.8	-68.7	-78.7	0	0	0	112.2	R84 G98 S101 R154 V155 Q164 V165	R84-H160 PolarHBondContact NH1-NE2 2.93Å; G98-H160 PolarHBondContact O-CE1 3.49Å; G98-H160 PolarHBondContact O-ND1 2.77Å; S101-H160 PolarHBondContact OG-CD2 3.25Å; S101-H160 VanDerWaalsContact OG-CD2 3.27Å; S101-H160 PolarHBondContact OG-NE2 2.91Å; R154-H160 HydrophobicContact CB-CB 4.24Å; R154-H160 PolarHBondContact O-N 2.94Å; V155-H160 WeakPolarHBondContact CA-O 3.39Å; H160-Q164 HydrophobicContact CB-CB 4.13Å; H160-Q164 PolarHBondContact ND1-OE1 3.43Å; H160-V165 HydrophobicContact CB-CG2 3.83Å
161	T	94.4	Very high	94.9	Very high	45 Å²	45	42.4 Å²	42.4	28%	0.276	20%	0.199	S	C	.	.			trans	-78.3	163.5	169.6	66.6	0	0	0	0	111.4	P85 S163 Q164 V165	P85-T161 HydrophobicContact CB-CG2 3.89Å; P85-T161 HydrophobicContact CG-CG2 4.23Å; T161-S163 PolarHBondContact O-N 2.74Å; T161-Q164 PolarHBondContact O-N 3.38Å; T161-Q164 VanDerWaalsContact OG1-CG 3.25Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.13Å; T161-Q164 PolarHBondContact OG1-N 2.91Å; T161-V165 WeakPolarHBondContact O-CG2 3.33Å; T161-V165 PolarHBondContact O-N 3.02Å
162	W	95.1	Very high	95	Very high	165 Å²	165	42 Å²	42	63%	0.625	20%	0.196	S	C	*	.	H	α-helix	trans	-55.5	-39.5	171.3	-73.5	110	0	0	0	112.7	Y152 V155 V165 F166	Y152-W162 AromaticContact CD2-CH2 3.72Å; Y152-W162 HydrophobicContact CD2-CH2 3.72Å; Y152-W162 HydrophobicContact CD2-CZ2 4.35Å; Y152-W162 HydrophobicContact CE2-CH2 4.09Å; Y152-W162 HydrophobicContact CE2-CZ2 4.34Å; V155-W162 HydrophobicContact CB-CD2 4.41Å; V155-W162 HydrophobicContact CB-CZ2 4.45Å; V155-W162 HydrophobicContact CG1-CD2 3.94Å; V155-W162 HydrophobicContact CG1-CG 4.16Å; V155-W162 HydrophobicContact CG1-CZ2 4.05Å; V155-W162 HydrophobicContact CG2-CD2 3.95Å; V155-W162 HydrophobicContact CG2-CE3 3.9Å; V155-W162 HydrophobicContact CG2-CG 4.41Å; V155-W162 HydrophobicContact CG2-CZ3 4.27Å; W162-V165 PolarHBondContact O-N 2.93Å; W162-F166 VanDerWaalsContact O-CB 3.31Å; W162-F166 WeakPolarHBondContact O-CB 3.16Å; W162-F166 PolarHBondContact O-N 3.24Å
163	S	95.9	Very high	95.1	Very high	51 Å²	51	38.5 Å²	38.5	36%	0.357	19%	0.186	S	C	.	.	H	α-helix	trans	-59.3	-52.5	175.5	-178.2	0	0	0	0	110.7	T161 V165 F166 Y167	T161-S163 PolarHBondContact O-N 2.74Å; S163-V165 VanDerWaalsContact C-N 3.27Å; S163-V165 PolarHBondContact O-N 3Å; S163-F166 PolarHBondContact O-N 2.94Å; S163-F166 VanDerWaalsContact O-N 3.09Å; S163-Y167 WeakPolarHBondContact O-CD2 3.46Å; S163-Y167 PolarHBondContact O-N 2.77Å; S163-Y167 WeakPolarHBondContact OG-CD2 3.43Å; S163-Y167 WeakPolarHBondContact OG-CE2 3.43Å
164	Q	96.2	Very high	95.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-37.9	-179.1	-70.8	171.2	-0	0	0	113.2	E82 P83 G98 M99 S101 H160 T161 G168	E82-Q164 WeakPolarHBondContact OE1-CG 3.49Å; E82-Q164 PolarHBondContact OE1-NE2 3.19Å; P83-Q164 PolarHBondContact O-NE2 2.92Å; G98-Q164 PolarHBondContact O-OE1 3.2Å; M99-Q164 HydrophobicContact CB-CG 4Å; M99-Q164 HydrophobicContact SD-CB 4.31Å; M99-Q164 HydrophobicContact SD-CG 3.97Å; S101-Q164 WeakPolarHBondContact CB-O 3.29Å; S101-Q164 PolarHBondContact N-O 3.37Å; H160-Q164 HydrophobicContact CB-CB 4.13Å; H160-Q164 PolarHBondContact ND1-OE1 3.43Å; T161-Q164 PolarHBondContact O-N 3.38Å; T161-Q164 VanDerWaalsContact OG1-CG 3.25Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.13Å; T161-Q164 PolarHBondContact OG1-N 2.91Å; Q164-G168 PolarHBondContact O-N 3.42Å; Q164-G168 VanDerWaalsContact O-N 3.09Å
165	V	97.4	Very high	95.5	Very high	9 Å²	9	43.1 Å²	43.1	6%	0.055	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-46.6	174.7	171.3	0	0	0	0	110.9	S104 R154 V155 H160 T161 W162 S163 G168 G169	S104-V165 PolarHBondContact OG-O 3.32Å; R154-V165 HydrophobicContact CB-CG2 3.99Å; V155-V165 HydrophobicContact CG2-CB 4.25Å; V155-V165 HydrophobicContact CG2-CG2 3.69Å; H160-V165 HydrophobicContact CB-CG2 3.83Å; T161-V165 WeakPolarHBondContact O-CG2 3.33Å; T161-V165 PolarHBondContact O-N 3.02Å; W162-V165 PolarHBondContact O-N 2.93Å; S163-V165 VanDerWaalsContact C-N 3.27Å; S163-V165 PolarHBondContact O-N 3Å; V165-G168 PolarHBondContact O-N 3.34Å; V165-G169 PolarHBondContact O-N 3.38Å
166	F	97.9	Very high	95.7	Very high	132 Å²	132	42.1 Å²	42.1	58%	0.579	21%	0.208	S	C	*	.	H	α-helix	trans	-59.3	-51	178.9	177.1	-99.6	0	0	0	112.3	W162 S163 G168 G169 V170	W162-F166 VanDerWaalsContact O-CB 3.31Å; W162-F166 WeakPolarHBondContact O-CB 3.16Å; W162-F166 PolarHBondContact O-N 3.24Å; S163-F166 PolarHBondContact O-N 2.94Å; S163-F166 VanDerWaalsContact O-N 3.09Å; F166-G168 VanDerWaalsContact C-N 3.29Å; F166-G168 PolarHBondContact O-N 3.38Å; F166-G169 PolarHBondContact O-N 3.05Å; F166-G169 VanDerWaalsContact O-N 3.11Å; F166-V170 HydrophobicContact CD1-CG2 4.29Å; F166-V170 HydrophobicContact CE1-CG2 3.85Å; F166-V170 HydrophobicContact CE2-CG2 4.15Å; F166-V170 HydrophobicContact CZ-CG2 3.77Å; F166-V170 WeakPolarHBondContact O-CG2 3.44Å; F166-V170 PolarHBondContact O-N 3.32Å
167	Y	97.8	Very high	96.1	Very high	116 Å²	116	40.9 Å²	40.9	46%	0.455	21%	0.209	S	C	.	.	H	α-helix	trans	-65.9	-32.3	178	-76	-76	0	0	0	112.6	M99 S163 T171	M99-Y167 VanDerWaalsContact CE-CB 3.42Å; M99-Y167 HydrophobicContact CE-CD1 4.02Å; M99-Y167 HydrophobicContact CE-CD2 3.1Å; M99-Y167 HydrophobicContact CE-CE2 3.75Å; M99-Y167 HydrophobicContact CE-CG 3.25Å; M99-Y167 HydrophobicContact SD-CD2 4.04Å; M99-Y167 HydrophobicContact SD-CG 4.21Å; S163-Y167 WeakPolarHBondContact O-CD2 3.46Å; S163-Y167 PolarHBondContact O-N 2.77Å; S163-Y167 WeakPolarHBondContact OG-CD2 3.43Å; S163-Y167 WeakPolarHBondContact OG-CE2 3.43Å; Y167-T171 VanDerWaalsContact O-CB 3.24Å; Y167-T171 WeakPolarHBondContact O-CB 3.44Å; Y167-T171 PolarHBondContact O-N 2.86Å; Y167-T171 PolarHBondContact O-OG1 3.17Å
168	G	97.9	Very high	96.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58	-52.6	167.6	0	0	0	0	0	111.6	Q105 Q164 V165 F166 V170 T171 G172	Q105-G168 WeakPolarHBondContact CA-O 3.22Å; Q105-G168 WeakPolarHBondContact CB-O 3.45Å; Q164-G168 PolarHBondContact O-N 3.42Å; Q164-G168 VanDerWaalsContact O-N 3.09Å; V165-G168 PolarHBondContact O-N 3.34Å; F166-G168 VanDerWaalsContact C-N 3.29Å; F166-G168 PolarHBondContact O-N 3.38Å; G168-V170 PolarHBondContact O-N 3.16Å; G168-T171 PolarHBondContact O-N 2.87Å; G168-G172 PolarHBondContact O-N 2.89Å
169	G	98.4	Very high	97	Very high	6 Å²	6	45.6 Å²	45.6	6%	0.062	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-44.8	178.1	0	0	0	0	0	114	S104 V165 F166 S173	S104-G169 PolarHBondContact OG-N 2.95Å; V165-G169 PolarHBondContact O-N 3.38Å; F166-G169 PolarHBondContact O-N 3.05Å; F166-G169 VanDerWaalsContact O-N 3.11Å; G169-S173 VanDerWaalsContact O-CB 3.27Å; G169-S173 WeakPolarHBondContact O-CB 3.28Å; G169-S173 PolarHBondContact O-N 2.79Å; G169-S173 PolarHBondContact O-OG 3.48Å
170	V	98.4	Very high	97.5	Very high	66 Å²	66	45.4 Å²	45.4	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-47.2	176.7	172.3	0	0	0	0	111.3	F166 G168 S173 T174	F166-V170 HydrophobicContact CD1-CG2 4.29Å; F166-V170 HydrophobicContact CE1-CG2 3.85Å; F166-V170 HydrophobicContact CE2-CG2 4.15Å; F166-V170 HydrophobicContact CZ-CG2 3.77Å; F166-V170 WeakPolarHBondContact O-CG2 3.44Å; F166-V170 PolarHBondContact O-N 3.32Å; G168-V170 PolarHBondContact O-N 3.16Å; V170-S173 PolarHBondContact O-N 3.49Å; V170-T174 WeakPolarHBondContact O-CB 3.37Å; V170-T174 PolarHBondContact O-N 3.46Å; V170-T174 PolarHBondContact O-OG1 3.06Å
171	T	98.4	Very high	97.7	Very high	32 Å²	32	49.8 Å²	49.8	20%	0.196	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-48.5	179.1	-58	0	0	0	0	110.5	L76 Q105 Y167 G168 S173 T174 I175	L76-T171 HydrophobicContact CD1-CG2 3.79Å; Q105-T171 HydrophobicContact CG-CG2 4.22Å; Y167-T171 VanDerWaalsContact O-CB 3.24Å; Y167-T171 WeakPolarHBondContact O-CB 3.44Å; Y167-T171 PolarHBondContact O-N 2.86Å; Y167-T171 PolarHBondContact O-OG1 3.17Å; G168-T171 PolarHBondContact O-N 2.87Å; T171-S173 PolarHBondContact O-N 3.07Å; T171-T174 PolarHBondContact O-N 3.09Å; T171-I175 HydrophobicContact CG2-CD1 3.69Å; T171-I175 HydrophobicContact CG2-CG1 4.49Å; T171-I175 VanDerWaalsContact O-CG1 3.29Å; T171-I175 WeakPolarHBondContact O-CG1 3.46Å; T171-I175 PolarHBondContact O-N 2.56Å
172	G	98.5	Very high	97.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63	-44.6	-179.3	0	0	0	0	0	112.4	Q105 F109 G168 T174 I175 G176	Q105-G172 VanDerWaalsContact O-CA 3.3Å; Q105-G172 WeakPolarHBondContact O-CA 3.26Å; F109-G172 VanDerWaalsContact CA-O 3.24Å; F109-G172 WeakPolarHBondContact CA-O 3.37Å; F109-G172 WeakPolarHBondContact CB-O 3.46Å; G168-G172 PolarHBondContact O-N 2.89Å; G172-T174 VanDerWaalsContact C-N 3.35Å; G172-T174 PolarHBondContact O-N 3.11Å; G172-I175 PolarHBondContact O-N 3.28Å; G172-G176 PolarHBondContact O-N 2.93Å
173	S	98.7	Very high	98	Very high	27 Å²	27	43.6 Å²	43.6	19%	0.189	23%	0.227	C	C	.	.	H	α-helix	trans	-59.7	-46.1	175.8	-59.6	0	0	0	0	111.3	G169 V170 T171 G176 V177	G169-S173 VanDerWaalsContact O-CB 3.27Å; G169-S173 WeakPolarHBondContact O-CB 3.28Å; G169-S173 PolarHBondContact O-N 2.79Å; G169-S173 PolarHBondContact O-OG 3.48Å; V170-S173 PolarHBondContact O-N 3.49Å; T171-S173 PolarHBondContact O-N 3.07Å; S173-G176 PolarHBondContact O-N 3.21Å; S173-V177 WeakPolarHBondContact O-CG2 3.33Å; S173-V177 PolarHBondContact O-N 2.84Å
174	T	98.6	Very high	98	Very high	78 Å²	78	42.4 Å²	42.4	48%	0.479	22%	0.216	S	C	.	.	H	α-helix	trans	-62.3	-49.3	-179.5	-56.6	0	0	0	0	111.2	V170 T171 G172 G176 V177 V178	V170-T174 WeakPolarHBondContact O-CB 3.37Å; V170-T174 PolarHBondContact O-N 3.46Å; V170-T174 PolarHBondContact O-OG1 3.06Å; T171-T174 PolarHBondContact O-N 3.09Å; G172-T174 VanDerWaalsContact C-N 3.35Å; G172-T174 PolarHBondContact O-N 3.11Å; T174-G176 VanDerWaalsContact C-N 3.27Å; T174-G176 PolarHBondContact O-N 3.31Å; T174-V177 PolarHBondContact O-N 2.91Å; T174-V178 WeakPolarHBondContact O-CG2 3.32Å; T174-V178 PolarHBondContact O-N 2.91Å
175	I	98.5	Very high	98	Very high	28 Å²	28	48.9 Å²	48.9	14%	0.144	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-37.5	177.2	-62.4	167.3	0	0	0	110.2	L68 N69 V72 F109 T171 G172 V178 W179	L68-I175 HydrophobicContact CD2-CG2 4.09Å; N69-I175 HydrophobicContact CB-CG2 4.25Å; N69-I175 VanDerWaalsContact OD1-CD1 3.32Å; N69-I175 WeakPolarHBondContact OD1-CD1 3.25Å; V72-I175 HydrophobicContact CB-CD1 4.03Å; V72-I175 HydrophobicContact CG1-CD1 3.71Å; V72-I175 HydrophobicContact CG2-CD1 4.37Å; F109-I175 HydrophobicContact CD2-CB 4.1Å; F109-I175 HydrophobicContact CD2-CG2 3.84Å; F109-I175 HydrophobicContact CE2-CB 4.48Å; F109-I175 HydrophobicContact CE2-CG2 3.82Å; T171-I175 HydrophobicContact CG2-CD1 3.69Å; T171-I175 HydrophobicContact CG2-CG1 4.49Å; T171-I175 VanDerWaalsContact O-CG1 3.29Å; T171-I175 WeakPolarHBondContact O-CG1 3.46Å; T171-I175 PolarHBondContact O-N 2.56Å; G172-I175 PolarHBondContact O-N 3.28Å; I175-V178 PolarHBondContact O-N 2.91Å; I175-W179 WeakPolarHBondContact O-CB 3.27Å; I175-W179 PolarHBondContact O-N 2.95Å
176	G	98.5	Very high	97.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-46.8	176.2	0	0	0	0	0	112.9	F109 G172 S173 T174 F180	F109-G176 VanDerWaalsContact CD2-N 3.27Å; F109-G176 VanDerWaalsContact CE2-CA 3.47Å; G172-G176 PolarHBondContact O-N 2.93Å; S173-G176 PolarHBondContact O-N 3.21Å; T174-G176 VanDerWaalsContact C-N 3.27Å; T174-G176 PolarHBondContact O-N 3.31Å; G176-F180 VanDerWaalsContact O-CB 3.3Å; G176-F180 WeakPolarHBondContact O-CB 3.48Å; G176-F180 PolarHBondContact O-N 2.92Å
177	V	98.6	Very high	97.9	Very high	55 Å²	55	46.7 Å²	46.7	33%	0.333	24%	0.242	S	C	.	.	H	α-helix	trans	-61.5	-52	175.3	175.4	0	0	0	0	110.6	V112 L116 S173 T174 W179 F180 F181	V112-V177 HydrophobicContact CG1-CG2 3.68Å; L116-V177 HydrophobicContact CD1-CB 4.42Å; L116-V177 HydrophobicContact CD1-CG2 4.14Å; S173-V177 WeakPolarHBondContact O-CG2 3.33Å; S173-V177 PolarHBondContact O-N 2.84Å; T174-V177 PolarHBondContact O-N 2.91Å; V177-W179 VanDerWaalsContact C-N 3.35Å; V177-W179 PolarHBondContact O-N 2.68Å; V177-F180 PolarHBondContact O-N 3.23Å; V177-F181 HydrophobicContact CG1-CD2 3.83Å; V177-F181 HydrophobicContact CG1-CE2 3.79Å; V177-F181 VanDerWaalsContact O-CD2 3.29Å; V177-F181 WeakPolarHBondContact O-CD2 2.96Å; V177-F181 PolarHBondContact O-N 2.95Å; V177-F181 VanDerWaalsContact O-N 3.1Å
178	V	98.6	Very high	97.7	Very high	94 Å²	94	42.3 Å²	42.3	57%	0.57	23%	0.227	S	C	*	.	H	α-helix	trans	-59.6	-46.5	-178.5	171.9	0	0	0	0	110.9	T174 I175 F180 F181 F182	T174-V178 WeakPolarHBondContact O-CG2 3.32Å; T174-V178 PolarHBondContact O-N 2.91Å; I175-V178 PolarHBondContact O-N 2.91Å; V178-F180 VanDerWaalsContact C-N 3.34Å; V178-F180 PolarHBondContact O-N 3.24Å; V178-F181 PolarHBondContact O-N 2.65Å; V178-F182 VanDerWaalsContact O-CB 3.3Å; V178-F182 WeakPolarHBondContact O-CB 3.44Å; V178-F182 PolarHBondContact O-N 3.32Å
179	W	98.6	Very high	97.6	Very high	43 Å²	43	46.4 Å²	46.4	16%	0.163	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-35.1	180	-168.1	-100.5	0	0	0	112.7	S61 G65 L68 F109 Y113 I175 V177 F182 T183	S61-W179 PolarHBondContact O-NE1 3.2Å; G65-W179 VanDerWaalsContact CA-NE1 3.29Å; L68-W179 HydrophobicContact CD1-CE3 4.28Å; L68-W179 HydrophobicContact CD1-CH2 4.28Å; L68-W179 HydrophobicContact CD1-CZ3 3.65Å; F109-W179 HydrophobicContact CE2-CB 3.88Å; F109-W179 HydrophobicContact CE2-CG 4.3Å; F109-W179 HydrophobicContact CZ-CB 4.1Å; F109-W179 AromaticContact CZ-CD1 3.91Å; F109-W179 HydrophobicContact CZ-CG 4.1Å; Y113-W179 AromaticContact CE2-CD1 3.65Å; I175-W179 WeakPolarHBondContact O-CB 3.27Å; I175-W179 PolarHBondContact O-N 2.95Å; V177-W179 VanDerWaalsContact C-N 3.35Å; V177-W179 PolarHBondContact O-N 2.68Å; W179-F182 HydrophobicContact CE3-CD1 4.16Å; W179-F182 HydrophobicContact CH2-CD1 4.41Å; W179-F182 HydrophobicContact CH2-CE1 4.3Å; W179-F182 HydrophobicContact CZ3-CD1 4.08Å; W179-F182 HydrophobicContact CZ3-CE1 4.22Å; W179-T183 WeakPolarHBondContact O-CB 3.3Å; W179-T183 PolarHBondContact O-N 2.92Å; W179-T183 PolarHBondContact O-OG1 2.91Å
180	F	98.2	Very high	97.5	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-61	-53.4	174.3	-178.8	-92.9	0	0	0	111	Y113 L116 F117 L120 R121 G176 V177 V178 F182 T183 Q184	Y113-F180 HydrophobicContact CD1-CD2 4.3Å; Y113-F180 HydrophobicContact CD2-CB 3.77Å; Y113-F180 HydrophobicContact CD2-CD2 4.16Å; Y113-F180 HydrophobicContact CD2-CG 4.5Å; Y113-F180 HydrophobicContact CE1-CD2 4.09Å; Y113-F180 VanDerWaalsContact CE2-CA 3.48Å; Y113-F180 HydrophobicContact CE2-CB 3.84Å; Y113-F180 AromaticContact CE2-CD2 3.95Å; Y113-F180 HydrophobicContact CE2-CD2 3.95Å; Y113-F180 HydrophobicContact CE2-CG 4.39Å; Y113-F180 HydrophobicContact CG-CD2 4.33Å; Y113-F180 AromaticContact CZ-CD2 3.92Å; L116-F180 HydrophobicContact CB-CD1 3.81Å; L116-F180 HydrophobicContact CB-CD2 3.75Å; L116-F180 HydrophobicContact CB-CE1 3.87Å; L116-F180 HydrophobicContact CB-CE2 3.82Å; L116-F180 HydrophobicContact CB-CG 3.74Å; L116-F180 HydrophobicContact CB-CZ 3.87Å; L116-F180 HydrophobicContact CD1-CB 3.72Å; L116-F180 HydrophobicContact CD1-CD1 3.89Å; L116-F180 HydrophobicContact CD1-CD2 4.49Å; L116-F180 HydrophobicContact CD1-CG 3.78Å; L116-F180 HydrophobicContact CG-CD1 4.41Å; L116-F180 HydrophobicContact CG-CG 4.42Å; F117-F180 HydrophobicContact CB-CE2 4.09Å; L120-F180 HydrophobicContact CB-CE1 4.28Å; L120-F180 HydrophobicContact CB-CZ 4.22Å; L120-F180 HydrophobicContact CD1-CE1 3.99Å; R121-F180 HydrophobicContact CB-CZ 4.27Å; G176-F180 VanDerWaalsContact O-CB 3.3Å; G176-F180 WeakPolarHBondContact O-CB 3.48Å; G176-F180 PolarHBondContact O-N 2.92Å; V177-F180 PolarHBondContact O-N 3.23Å; V178-F180 VanDerWaalsContact C-N 3.34Å; V178-F180 PolarHBondContact O-N 3.24Å; F180-F182 PolarHBondContact O-N 3.04Å; F180-T183 WeakPolarHBondContact O-CB 3.3Å; F180-T183 PolarHBondContact O-N 3.34Å; F180-T183 VanDerWaalsContact O-N 3.13Å; F180-Q184 HydrophobicContact CD1-CG 4.05Å; F180-Q184 HydrophobicContact CE1-CG 3.61Å; F180-Q184 HydrophobicContact CE2-CG 4.23Å; F180-Q184 HydrophobicContact CZ-CG 3.72Å; F180-Q184 WeakPolarHBondContact O-CG 3.22Å; F180-Q184 PolarHBondContact O-N 2.61Å
181	F	97.9	Very high	97.4	Very high	95 Å²	95	46.5 Å²	46.5	42%	0.417	25%	0.25	S	S	.	.	H	α-helix	trans	-65.9	-38.3	178.8	-75.6	-69.3	0	0	0	112.4	L120 V177 V178 T183 Q184 E185	L120-F181 HydrophobicContact CD1-CZ 4.35Å; V177-F181 HydrophobicContact CG1-CD2 3.83Å; V177-F181 HydrophobicContact CG1-CE2 3.79Å; V177-F181 VanDerWaalsContact O-CD2 3.29Å; V177-F181 WeakPolarHBondContact O-CD2 2.96Å; V177-F181 PolarHBondContact O-N 2.95Å; V177-F181 VanDerWaalsContact O-N 3.1Å; V178-F181 PolarHBondContact O-N 2.65Å; F181-T183 VanDerWaalsContact C-N 3.27Å; F181-T183 PolarHBondContact O-N 3.47Å; F181-Q184 PolarHBondContact O-N 3.43Å; F181-E185 WeakPolarHBondContact O-CB 3.45Å; F181-E185 WeakPolarHBondContact O-CG 3.4Å; F181-E185 PolarHBondContact O-N 2.71Å
182	F	98.1	Very high	97.3	Very high	80 Å²	80	48.6 Å²	48.6	35%	0.351	26%	0.264	S	S	.	.	I	π-helix	trans	-57.4	-43.4	171.2	178.4	-105.1	0	0	0	111.5	V178 W179 F180 V186 L187	V178-F182 VanDerWaalsContact O-CB 3.3Å; V178-F182 WeakPolarHBondContact O-CB 3.44Å; V178-F182 PolarHBondContact O-N 3.32Å; W179-F182 HydrophobicContact CE3-CD1 4.16Å; W179-F182 HydrophobicContact CH2-CD1 4.41Å; W179-F182 HydrophobicContact CH2-CE1 4.3Å; W179-F182 HydrophobicContact CZ3-CD1 4.08Å; W179-F182 HydrophobicContact CZ3-CE1 4.22Å; F180-F182 PolarHBondContact O-N 3.04Å; F182-V186 HydrophobicContact CD2-CB 3.85Å; F182-V186 HydrophobicContact CD2-CG1 4.32Å; F182-V186 HydrophobicContact CD2-CG2 3.72Å; F182-V186 HydrophobicContact CE2-CB 3.81Å; F182-V186 HydrophobicContact CE2-CG1 3.76Å; F182-V186 HydrophobicContact CE2-CG2 3.98Å; F182-V186 HydrophobicContact CZ-CB 4.45Å; F182-V186 HydrophobicContact CZ-CG1 4.27Å; F182-V186 WeakPolarHBondContact O-CA 3.39Å; F182-V186 VanDerWaalsContact O-CB 3.23Å; F182-V186 WeakPolarHBondContact O-CB 3.24Å; F182-V186 PolarHBondContact O-N 2.85Å; F182-L187 HydrophobicContact CD1-CD1 4Å; F182-L187 HydrophobicContact CD1-CG 4.06Å; F182-L187 HydrophobicContact CE1-CD1 3.75Å; F182-L187 HydrophobicContact CE1-CD2 3.81Å; F182-L187 HydrophobicContact CE1-CG 3.69Å; F182-L187 HydrophobicContact CZ-CD2 4.03Å; F182-L187 HydrophobicContact CZ-CG 4.26Å; F182-L187 PolarHBondContact O-N 3.21Å; F182-L187 VanDerWaalsContact O-N 3.11Å
183	T	97.3	Very high	97.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.294	C	S	.	.	I	π-helix	trans	-64.8	-45.7	176.4	-60.9	0	0	0	0	111.9	S61 W179 F180 F181 L187 T188 F191	S61-T183 WeakPolarHBondContact OG-CG2 3.31Å; S61-T183 PolarHBondContact OG-OG1 3.43Å; W179-T183 WeakPolarHBondContact O-CB 3.3Å; W179-T183 PolarHBondContact O-N 2.92Å; W179-T183 PolarHBondContact O-OG1 2.91Å; F180-T183 WeakPolarHBondContact O-CB 3.3Å; F180-T183 PolarHBondContact O-N 3.34Å; F180-T183 VanDerWaalsContact O-N 3.13Å; F181-T183 VanDerWaalsContact C-N 3.27Å; F181-T183 PolarHBondContact O-N 3.47Å; T183-L187 PolarHBondContact O-N 2.96Å; T183-T188 PolarHBondContact O-N 2.92Å; T183-T188 PolarHBondContact O-OG1 3.48Å; T183-F191 HydrophobicContact CG2-CZ 4.19Å
184	Q	94.9	Very high	97	Very high	26 Å²	26	56.6 Å²	56.6	12%	0.121	30%	0.297	C	S	.	.	I	π-helix	trans	-69.8	-46.8	-178	-61.2	-47	-44.6	0	0	112.3	F180 F181 T188	F180-Q184 HydrophobicContact CD1-CG 4.05Å; F180-Q184 HydrophobicContact CE1-CG 3.61Å; F180-Q184 HydrophobicContact CE2-CG 4.23Å; F180-Q184 HydrophobicContact CZ-CG 3.72Å; F180-Q184 WeakPolarHBondContact O-CG 3.22Å; F180-Q184 PolarHBondContact O-N 2.61Å; F181-Q184 PolarHBondContact O-N 3.43Å; Q184-T188 WeakPolarHBondContact CA-OG1 3.49Å; Q184-T188 VanDerWaalsContact O-CB 3.23Å; Q184-T188 WeakPolarHBondContact O-CB 3.16Å; Q184-T188 PolarHBondContact O-OG1 3.49Å
185	E	95.7	Very high	96.8	Very high	136 Å²	136	54 Å²	54	64%	0.636	28%	0.283	S	S	*	.	I	π-helix	trans	-89.3	-29.7	-170.5	-57	-54.7	139.4	0	0	113.4	F181 P189	F181-E185 WeakPolarHBondContact O-CB 3.45Å; F181-E185 WeakPolarHBondContact O-CG 3.4Å; F181-E185 PolarHBondContact O-N 2.71Å; E185-P189 WeakPolarHBondContact O-CG 3.47Å
186	V	96.9	Very high	96.6	Very high	65 Å²	65	56.1 Å²	56.1	39%	0.394	31%	0.305	S	S	.	.	I	π-helix	trans	-106.8	-51.2	-175.8	-172.7	0	0	0	0	111.4	F182 L190	F182-V186 HydrophobicContact CD2-CB 3.85Å; F182-V186 HydrophobicContact CD2-CG1 4.32Å; F182-V186 HydrophobicContact CD2-CG2 3.72Å; F182-V186 HydrophobicContact CE2-CB 3.81Å; F182-V186 HydrophobicContact CE2-CG1 3.76Å; F182-V186 HydrophobicContact CE2-CG2 3.98Å; F182-V186 HydrophobicContact CZ-CB 4.45Å; F182-V186 HydrophobicContact CZ-CG1 4.27Å; F182-V186 WeakPolarHBondContact O-CA 3.39Å; F182-V186 VanDerWaalsContact O-CB 3.23Å; F182-V186 WeakPolarHBondContact O-CB 3.24Å; F182-V186 PolarHBondContact O-N 2.85Å; V186-L190 WeakPolarHBondContact O-CD1 3.22Å; V186-L190 WeakPolarHBondContact O-CG 3.48Å
187	L	96.6	Very high	96.5	Very high	30 Å²	30	62.8 Å²	62.8	16%	0.157	33%	0.331	C	S	.	.	I	π-helix	trans	-78.5	-40.7	-173.8	-60.3	-179	0	0	0	112.9	S61 F182 T183 L190 F191	S61-L187 VanDerWaalsContact OG-CD1 3.22Å; S61-L187 WeakPolarHBondContact OG-CD1 3.29Å; F182-L187 HydrophobicContact CD1-CD1 4Å; F182-L187 HydrophobicContact CD1-CG 4.06Å; F182-L187 HydrophobicContact CE1-CD1 3.75Å; F182-L187 HydrophobicContact CE1-CD2 3.81Å; F182-L187 HydrophobicContact CE1-CG 3.69Å; F182-L187 HydrophobicContact CZ-CD2 4.03Å; F182-L187 HydrophobicContact CZ-CG 4.26Å; F182-L187 PolarHBondContact O-N 3.21Å; F182-L187 VanDerWaalsContact O-N 3.11Å; T183-L187 PolarHBondContact O-N 2.96Å; L187-L190 CarbonylContact O-C 3.48Å; L187-L190 WeakPolarHBondContact O-CA 3.43Å; L187-L190 WeakPolarHBondContact O-CB 3.36Å; L187-L190 PolarHBondContact O-N 3.43Å; L187-F191 HydrophobicContact CB-CD1 4.23Å; L187-F191 HydrophobicContact CB-CE1 3.51Å; L187-F191 HydrophobicContact CB-CZ 3.78Å; L187-F191 WeakPolarHBondContact O-CD1 3.29Å; L187-F191 WeakPolarHBondContact O-CG 2.95Å; L187-F191 PolarHBondContact O-N 2.77Å
188	T	95.1	Very high	96.4	Very high	23 Å²	23	65.3 Å²	65.3	14%	0.141	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-57	-44.5	-178.3	-53.5	0	0	0	0	112.9	H58 T183 Q184 L190 F191 P192	H58-T188 PolarHBondContact CE1-OG1 2.99Å; T183-T188 PolarHBondContact O-N 2.92Å; T183-T188 PolarHBondContact O-OG1 3.48Å; Q184-T188 WeakPolarHBondContact CA-OG1 3.49Å; Q184-T188 VanDerWaalsContact O-CB 3.23Å; Q184-T188 WeakPolarHBondContact O-CB 3.16Å; Q184-T188 PolarHBondContact O-OG1 3.49Å; T188-L190 PolarHBondContact O-N 2.72Å; T188-F191 HydrophobicContact CG2-CD2 4.5Å; T188-F191 WeakPolarHBondContact O-CB 3.34Å; T188-F191 PolarHBondContact O-N 3.46Å; T188-P192 WeakPolarHBondContact O-CD 3.18Å
189	P	95.8	Very high	96.2	Very high	86 Å²	86	65.9 Å²	65.9	56%	0.558	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63.2	-22.6	173.6	-24.5	36	0	0	0	114.4	E185	E185-P189 WeakPolarHBondContact O-CG 3.47Å
190	L	96.1	Very high	96	Very high	73 Å²	73	64.4 Å²	64.4	38%	0.382	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-90.6	-19.1	178.9	-61.4	175.4	0	0	0	112.8	V186 L187 T188 K193 M194	V186-L190 WeakPolarHBondContact O-CD1 3.22Å; V186-L190 WeakPolarHBondContact O-CG 3.48Å; L187-L190 CarbonylContact O-C 3.48Å; L187-L190 WeakPolarHBondContact O-CA 3.43Å; L187-L190 WeakPolarHBondContact O-CB 3.36Å; L187-L190 PolarHBondContact O-N 3.43Å; T188-L190 PolarHBondContact O-N 2.72Å; L190-K193 WeakPolarHBondContact O-CA 3.21Å; L190-K193 WeakPolarHBondContact O-CB 3.23Å; L190-K193 PolarHBondContact O-N 3.11Å; L190-M194 HydrophobicContact CB-SD 4.35Å; L190-M194 WeakPolarHBondContact O-CG 3.5Å; L190-M194 PolarHBondContact O-N 3.38Å
191	F	96.5	Very high	95.8	Very high	2 Å²	2	71 Å²	71	1%	0.009	37%	0.374	C	S	.	.	H	α-helix	trans	-54.8	-40.9	-177.3	-74.7	-9.4	0	0	0	114.9	L57 H58 T183 L187 T188 K193 M194 A195 S209	L57-F191 HydrophobicContact CB-CD1 3.93Å; L57-F191 HydrophobicContact CB-CD2 3.85Å; L57-F191 HydrophobicContact CB-CE1 3.96Å; L57-F191 HydrophobicContact CB-CE2 3.93Å; L57-F191 HydrophobicContact CB-CG 3.87Å; L57-F191 HydrophobicContact CB-CZ 3.98Å; L57-F191 HydrophobicContact CD1-CB 3.56Å; L57-F191 HydrophobicContact CD1-CD1 3.89Å; L57-F191 HydrophobicContact CD1-CD2 4.38Å; L57-F191 HydrophobicContact CD1-CG 3.71Å; L57-F191 WeakPolarHBondContact CD1-O 3.31Å; L57-F191 HydrophobicContact CG-CD1 4.36Å; L57-F191 HydrophobicContact CG-CG 4.39Å; H58-F191 AromaticContact CD2-CE2 3.99Å; H58-F191 AromaticContact CE1-CE2 3.69Å; H58-F191 AromaticContact CG-CE2 3.81Å; H58-F191 AromaticContact ND1-CE2 3.63Å; H58-F191 AromaticContact NE2-CE2 3.96Å; T183-F191 HydrophobicContact CG2-CZ 4.19Å; L187-F191 HydrophobicContact CB-CD1 4.23Å; L187-F191 HydrophobicContact CB-CE1 3.51Å; L187-F191 HydrophobicContact CB-CZ 3.78Å; L187-F191 WeakPolarHBondContact O-CD1 3.29Å; L187-F191 WeakPolarHBondContact O-CG 2.95Å; L187-F191 PolarHBondContact O-N 2.77Å; T188-F191 HydrophobicContact CG2-CD2 4.5Å; T188-F191 WeakPolarHBondContact O-CB 3.34Å; T188-F191 PolarHBondContact O-N 3.46Å; F191-K193 VanDerWaalsContact C-N 3.26Å; F191-K193 PolarHBondContact O-N 2.97Å; F191-M194 HydrophobicContact CD1-SD 3.87Å; F191-M194 HydrophobicContact CE1-SD 4.3Å; F191-M194 PolarHBondContact O-N 2.77Å; F191-A195 WeakPolarHBondContact O-CB 3.38Å; F191-A195 PolarHBondContact O-N 3.13Å; F191-S209 WeakPolarHBondContact CD2-OG 3.25Å
192	P	94.9	Very high	95.6	Very high	75 Å²	75	74.1 Å²	74.1	49%	0.487	39%	0.388	S	S	.	.	H	α-helix	trans	-59.9	-37.6	175	-26.1	34.6	0	0	0	112.8	T188 A196	T188-P192 WeakPolarHBondContact O-CD 3.18Å; P192-A196 WeakPolarHBondContact O-CB 3.45Å; P192-A196 PolarHBondContact O-N 2.99Å
193	K	95.4	Very high	95.5	Very high	145 Å²	145	76 Å²	76	63%	0.63	40%	0.396	S	S	*	.	H	α-helix	trans	-71.8	-41.7	176.8	-63.7	179.9	-179.1	175.4	0	111.3	L190 F191 A196 W197	L190-K193 WeakPolarHBondContact O-CA 3.21Å; L190-K193 WeakPolarHBondContact O-CB 3.23Å; L190-K193 PolarHBondContact O-N 3.11Å; F191-K193 VanDerWaalsContact C-N 3.26Å; F191-K193 PolarHBondContact O-N 2.97Å; K193-A196 PolarHBondContact O-N 2.83Å; K193-W197 VanDerWaalsContact O-CD1 3.26Å; K193-W197 PolarHBondContact O-NE1 3.44Å
194	M	95.5	Very high	95.3	Very high	50 Å²	50	81.3 Å²	81.3	25%	0.246	42%	0.424	C	S	.	.	H	α-helix	trans	-64.8	-40.9	177.6	-66.8	175	66.6	0	0	111.7	L57 L190 F191 A196 W197 S200	L57-M194 HydrophobicContact CD1-CB 4.4Å; L57-M194 HydrophobicContact CD2-CE 4.36Å; L190-M194 HydrophobicContact CB-SD 4.35Å; L190-M194 WeakPolarHBondContact O-CG 3.5Å; L190-M194 PolarHBondContact O-N 3.38Å; F191-M194 HydrophobicContact CD1-SD 3.87Å; F191-M194 HydrophobicContact CE1-SD 4.3Å; F191-M194 PolarHBondContact O-N 2.77Å; M194-A196 VanDerWaalsContact C-N 3.25Å; M194-A196 PolarHBondContact O-N 3.14Å; M194-W197 HydrophobicContact CB-CE3 4.49Å; M194-W197 HydrophobicContact CB-CZ3 4.48Å; M194-W197 HydrophobicContact CE-CZ3 4.49Å; M194-W197 HydrophobicContact CG-CH2 3.95Å; M194-W197 HydrophobicContact CG-CZ2 4.13Å; M194-W197 HydrophobicContact CG-CZ3 4.22Å; M194-W197 WeakPolarHBondContact O-CB 2.96Å; M194-W197 PolarHBondContact O-N 3.43Å; M194-S200 WeakPolarHBondContact O-CB 3.5Å; M194-S200 PolarHBondContact O-OG 2.79Å
195	A	94.9	Very high	95.4	Very high	23 Å²	23	81.6 Å²	81.6	19%	0.19	43%	0.427	C	S	.	.	H	α-helix	trans	-64.7	-30.4	177.1	0	0	0	0	0	112.3	L57 F191 W197 S200 D207	L57-A195 HydrophobicContact CD1-CB 4.12Å; F191-A195 WeakPolarHBondContact O-CB 3.38Å; F191-A195 PolarHBondContact O-N 3.13Å; A195-W197 VanDerWaalsContact C-N 3.3Å; A195-W197 PolarHBondContact O-N 2.96Å; A195-S200 WeakPolarHBondContact O-CB 3.46Å; A195-D207 HydrophobicContact CB-CB 4.13Å
196	A	94.9	Very high	95.2	Very high	74 Å²	74	79.1 Å²	79.1	61%	0.612	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.5	177.9	0	0	0	0	0	114.5	P192 K193 M194	P192-A196 WeakPolarHBondContact O-CB 3.45Å; P192-A196 PolarHBondContact O-N 2.99Å; K193-A196 PolarHBondContact O-N 2.83Å; M194-A196 VanDerWaalsContact C-N 3.25Å; M194-A196 PolarHBondContact O-N 3.14Å
197	W	96.3	Very high	95	Very high	140 Å²	140	78.4 Å²	78.4	53%	0.53	41%	0.406	S	S	.	.	S	Bend	trans	-68.1	146.5	175.4	-69	-16.1	0	0	0	111.6	K193 M194 A195 I199 S200 E201	K193-W197 VanDerWaalsContact O-CD1 3.26Å; K193-W197 PolarHBondContact O-NE1 3.44Å; M194-W197 HydrophobicContact CB-CE3 4.49Å; M194-W197 HydrophobicContact CB-CZ3 4.48Å; M194-W197 HydrophobicContact CE-CZ3 4.49Å; M194-W197 HydrophobicContact CG-CH2 3.95Å; M194-W197 HydrophobicContact CG-CZ2 4.13Å; M194-W197 HydrophobicContact CG-CZ3 4.22Å; M194-W197 WeakPolarHBondContact O-CB 2.96Å; M194-W197 PolarHBondContact O-N 3.43Å; A195-W197 VanDerWaalsContact C-N 3.3Å; A195-W197 PolarHBondContact O-N 2.96Å; W197-I199 HydrophobicContact CB-CG2 4.22Å; W197-I199 PolarHBondContact O-N 2.92Å; W197-I199 VanDerWaalsContact O-N 3.14Å; W197-S200 WeakPolarHBondContact O-CA 3.2Å; W197-S200 WeakPolarHBondContact O-CB 3.36Å; W197-S200 PolarHBondContact O-N 3.1Å; W197-E201 PolarHBondContact O-N 3.44Å
198	P	96.1	Very high	94.7	Very high	107 Å²	107	78.1 Å²	78.1	70%	0.695	41%	0.405	S	S	*	.	H	α-helix	trans	-56	-36.3	-179.6	-26.9	34.3	0	0	0	113.6	F202	P198-F202 VanDerWaalsContact O-CB 3.3Å; P198-F202 WeakPolarHBondContact O-CB 3.28Å; P198-F202 PolarHBondContact O-N 3.24Å
199	I	95.4	Very high	94.3	Very high	106 Å²	106	77.4 Å²	77.4	54%	0.544	40%	0.401	S	S	.	.	H	α-helix	trans	-69.1	-39	176.7	-166.5	160.7	0	0	0	111.9	W197 F202 F203	W197-I199 HydrophobicContact CB-CG2 4.22Å; W197-I199 PolarHBondContact O-N 2.92Å; W197-I199 VanDerWaalsContact O-N 3.14Å; I199-F202 PolarHBondContact O-N 3.15Å; I199-F203 HydrophobicContact CD1-CE2 4.21Å; I199-F203 HydrophobicContact CG1-CD2 3.76Å; I199-F203 HydrophobicContact CG1-CE2 3.72Å; I199-F203 VanDerWaalsContact O-CD2 3.22Å; I199-F203 WeakPolarHBondContact O-CD2 3.44Å; I199-F203 PolarHBondContact O-N 2.64Å
200	S	93.9	Very high	93.8	Very high	13 Å²	13	81.3 Å²	81.3	9%	0.091	42%	0.417	C	S	.	.	H	α-helix	trans	-66.4	-43	176.9	-63.5	0	0	0	0	110.4	M194 A195 W197 F203 L204 V205	M194-S200 WeakPolarHBondContact O-CB 3.5Å; M194-S200 PolarHBondContact O-OG 2.79Å; A195-S200 WeakPolarHBondContact O-CB 3.46Å; W197-S200 WeakPolarHBondContact O-CA 3.2Å; W197-S200 WeakPolarHBondContact O-CB 3.36Å; W197-S200 PolarHBondContact O-N 3.1Å; S200-F203 PolarHBondContact O-N 3.43Å; S200-L204 PolarHBondContact O-N 2.91Å; S200-V205 VanDerWaalsContact O-CA 3.28Å; S200-V205 WeakPolarHBondContact O-CA 3.29Å; S200-V205 PolarHBondContact O-N 3.48Å
201	E	92.7	Very high	93.2	Very high	142 Å²	142	80 Å²	80	66%	0.664	41%	0.409	S	S	*	.	H	α-helix	trans	-62.7	-45.9	174.6	-171.5	175.5	-174.3	0	0	111.6	W197 F203 L204	W197-E201 PolarHBondContact O-N 3.44Å; E201-F203 VanDerWaalsContact C-N 3.29Å; E201-F203 PolarHBondContact O-N 3.17Å; E201-L204 PolarHBondContact O-N 2.99Å
202	F	94.9	Very high	92.2	Very high	161 Å²	161	83.6 Å²	83.6	71%	0.706	43%	0.433	S	S	*	.	H	α-helix	trans	-55.7	-43.6	176.4	177.3	-97	0	0	0	112.4	P198 I199 L204	P198-F202 VanDerWaalsContact O-CB 3.3Å; P198-F202 WeakPolarHBondContact O-CB 3.28Å; P198-F202 PolarHBondContact O-N 3.24Å; I199-F202 PolarHBondContact O-N 3.15Å; F202-L204 VanDerWaalsContact C-N 3.32Å
203	F	94.9	Very high	91.5	Very high	118 Å²	118	81.5 Å²	81.5	52%	0.518	42%	0.418	S	S	.	.	H	α-helix	trans	-83.3	-2.8	177.9	-75	-65.7	0	0	0	114	R55 I199 S200 E201 V205	R55-F203 WeakPolarHBondContact CD-O 3.49Å; R55-F203 PolarHBondContact NE-O 3.31Å; I199-F203 HydrophobicContact CD1-CE2 4.21Å; I199-F203 HydrophobicContact CG1-CD2 3.76Å; I199-F203 HydrophobicContact CG1-CE2 3.72Å; I199-F203 VanDerWaalsContact O-CD2 3.22Å; I199-F203 WeakPolarHBondContact O-CD2 3.44Å; I199-F203 PolarHBondContact O-N 2.64Å; S200-F203 PolarHBondContact O-N 3.43Å; E201-F203 VanDerWaalsContact C-N 3.29Å; E201-F203 PolarHBondContact O-N 3.17Å; F203-V205 VanDerWaalsContact C-N 3.28Å; F203-V205 HydrophobicContact CB-CG2 4.23Å
204	L	94.2	Very high	91	Very high	113 Å²	113	76.8 Å²	76.8	59%	0.592	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	40.1	-173	-48.6	172.4	0	0	0	112.8	R55 S200 E201 F202 R206	R55-L204 PolarHBondContact NE-O 3.05Å; S200-L204 PolarHBondContact O-N 2.91Å; E201-L204 PolarHBondContact O-N 2.99Å; F202-L204 VanDerWaalsContact C-N 3.32Å; L204-R206 PolarHBondContact O-N 3.33Å
205	V	96	Very high	90.3	Very high	31 Å²	31	80.4 Å²	80.4	19%	0.188	42%	0.419	C	S	.	.			trans	-23.7	104	150.1	-158	0	0	0	0	117.3	R55 L57 I60 S200 F203	R55-V205 HydrophobicContact CB-CG2 4.2Å; L57-V205 HydrophobicContact CD1-CG1 4.42Å; L57-V205 HydrophobicContact CD2-CG1 3.58Å; L57-V205 HydrophobicContact CG-CG1 3.66Å; I60-V205 HydrophobicContact CD1-CG1 4.37Å; I60-V205 HydrophobicContact CD1-CG2 4.41Å; S200-V205 VanDerWaalsContact O-CA 3.28Å; S200-V205 WeakPolarHBondContact O-CA 3.29Å; S200-V205 PolarHBondContact O-N 3.48Å; F203-V205 VanDerWaalsContact C-N 3.28Å; F203-V205 HydrophobicContact CB-CG2 4.23Å
206	R	93.1	Very high	89.8	Confident	85 Å²	85	86.5 Å²	86.5	32%	0.321	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-108.2	135.4	177.5	-62.1	-168.8	-62	159.6	17.9	113.1	K54 R55 E56 L57 L204 E218	K54-R206 VanDerWaalsContact O-CZ 3.32Å; K54-R206 PolarHBondContact O-NE 3.46Å; K54-R206 PolarHBondContact O-NH2 2.94Å; R55-R206 PolarHBondContact O-N 3.47Å; E56-R206 WeakPolarHBondContact OE1-CB 3.43Å; E56-R206 IonicContact OE1-CZ 3.15Å; E56-R206 IonicContact OE1-NE 3.17Å; E56-R206 PolarHBondContact OE1-NE 3.01Å; E56-R206 IonicContact OE1-NH1 3.65Å; E56-R206 IonicContact OE1-NH2 2.64Å; E56-R206 PolarHBondContact OE1-NH2 3.44Å; L57-R206 PolarHBondContact N-O 3.44Å; L204-R206 PolarHBondContact O-N 3.33Å; R206-E218 IonicContact CZ-OE1 3.22Å; R206-E218 IonicContact NH1-OE1 2.94Å; R206-E218 PolarHBondContact NH1-OE1 3.37Å; R206-E218 VanDerWaalsContact NH1-OE1 3.15Å; R206-E218 IonicContact NH2-OE1 2.85Å; R206-E218 PolarHBondContact NH2-OE1 3.31Å
207	D	92.7	Very high	89.5	Confident	50 Å²	50	87.4 Å²	87.4	27%	0.267	43%	0.427	S	S	.	.			trans	-107.1	115.1	165.9	-178.9	11.9	0	0	0	109.6	L57 A195 S209	L57-D207 HydrophobicContact CD1-CB 4.09Å; A195-D207 HydrophobicContact CB-CB 4.13Å; D207-S209 WeakPolarHBondContact OD1-CB 3.45Å; D207-S209 PolarHBondContact OD1-N 3.45Å; D207-S209 PolarHBondContact OD1-OG 3.24Å
208	T	88.7	Confident	89.1	Confident	23 Å²	23	82.5 Å²	82.5	14%	0.141	41%	0.41	C	S	.	.			trans	-111.9	15.9	178.2	50.9	0	0	0	0	112.8	E56 L210 I211 I214	E56-T208 VanDerWaalsContact CD-CG2 3.47Å; E56-T208 WeakPolarHBondContact OE1-CG2 3.26Å; E56-T208 VanDerWaalsContact OE2-CB 3.29Å; E56-T208 WeakPolarHBondContact OE2-CB 3.34Å; E56-T208 WeakPolarHBondContact OE2-CG2 3.29Å; E56-T208 PolarHBondContact OE2-OG1 2.91Å; T208-L210 PolarHBondContact O-N 2.99Å; T208-L210 VanDerWaalsContact O-N 3.14Å; T208-I211 HydrophobicContact CG2-CD1 4.03Å; T208-I211 WeakPolarHBondContact O-CB 3.34Å; T208-I211 PolarHBondContact O-N 2.86Å; T208-I214 HydrophobicContact CG2-CD1 3.52Å; T208-I214 HydrophobicContact CG2-CG1 4.32Å
209	S	86.6	Confident	88.7	Confident	8 Å²	8	83.1 Å²	83.1	6%	0.056	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.5	-172.6	-58.9	0	0	0	0	114.1	H58 R121 F191 D207 I211	H58-S209 PolarHBondContact NE2-OG 2.99Å; R121-S209 VanDerWaalsContact CZ-O 3.31Å; R121-S209 PolarHBondContact NH1-O 3.28Å; R121-S209 VanDerWaalsContact NH1-O 3.07Å; R121-S209 VanDerWaalsContact NH2-C 3.34Å; R121-S209 PolarHBondContact NH2-O 3.46Å; F191-S209 WeakPolarHBondContact CD2-OG 3.25Å; D207-S209 WeakPolarHBondContact OD1-CB 3.45Å; D207-S209 PolarHBondContact OD1-N 3.45Å; D207-S209 PolarHBondContact OD1-OG 3.24Å; S209-I211 VanDerWaalsContact C-N 3.32Å
210	L	85.9	Confident	88.5	Confident	169 Å²	169	80.2 Å²	80.2	89%	0.885	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4	-179.5	-60.3	179.2	0	0	0	113.2	T208 P212	T208-L210 PolarHBondContact O-N 2.99Å; T208-L210 VanDerWaalsContact O-N 3.14Å; L210-P212 WeakPolarHBondContact O-CD 3.33Å
211	I	84.1	Confident	88.4	Confident	44 Å²	44	82.8 Å²	82.8	23%	0.226	40%	0.402	C	S	.	.			trans	-91.4	112.6	-177.1	-55.2	-177.4	0	0	0	109.1	T208 S209 N213 I214 F217	T208-I211 HydrophobicContact CG2-CD1 4.03Å; T208-I211 WeakPolarHBondContact O-CB 3.34Å; T208-I211 PolarHBondContact O-N 2.86Å; S209-I211 VanDerWaalsContact C-N 3.32Å; I211-N213 PolarHBondContact O-N 3.35Å; I211-I214 HydrophobicContact CD1-CD1 4.04Å; I211-I214 HydrophobicContact CG2-CD1 4.27Å; I211-F217 HydrophobicContact CD1-CD1 3.76Å; I211-F217 HydrophobicContact CD1-CE1 3.74Å; I211-F217 HydrophobicContact CD1-CG 4.24Å; I211-F217 HydrophobicContact CD1-CZ 4.22Å; I211-F217 HydrophobicContact CG2-CB 3.61Å; I211-F217 HydrophobicContact CG2-CD1 4.22Å; I211-F217 HydrophobicContact CG2-CD2 4.31Å; I211-F217 HydrophobicContact CG2-CG 3.79Å
212	P	75.6	Confident	88.4	Confident	78 Å²	78	80.6 Å²	80.6	51%	0.506	40%	0.398	S	S	.	.	S	Bend	trans	-67.9	-35.9	-172.1	23.3	-32.4	0	0	0	113.6	H123 L210	H123-P212 HydrophobicContact CB-CB 3.84Å; L210-P212 WeakPolarHBondContact O-CD 3.33Å
213	N	80.4	Confident	88.3	Confident	32 Å²	32	78.1 Å²	78.1	17%	0.171	38%	0.384	C	S	.	.			trans	-135.8	94.6	175	-175.1	-27.2	0	0	0	109.3	T125 I211 L215 W216 F217	T125-N213 HydrophobicContact CG2-CB 4.1Å; I211-N213 PolarHBondContact O-N 3.35Å; N213-L215 VanDerWaalsContact C-N 3.31Å; N213-L215 PolarHBondContact O-N 2.97Å; N213-L215 PolarHBondContact OD1-N 2.96Å; N213-W216 HydrophobicContact CB-CB 4.1Å; N213-W216 PolarHBondContact O-N 3.13Å; N213-W216 WeakPolarHBondContact OD1-CB 3.43Å; N213-W216 PolarHBondContact OD1-N 3.23Å; N213-F217 WeakPolarHBondContact O-CB 3.38Å; N213-F217 PolarHBondContact O-N 3.2Å
214	I	83.6	Confident	88.3	Confident	45 Å²	45	75.2 Å²	75.2	23%	0.231	38%	0.378	C	S	.	.	H	α-helix	trans	-62.3	-37.5	-177.5	-173.6	58.1	0	0	0	112.7	T208 I211 F217 E218	T208-I214 HydrophobicContact CG2-CD1 3.52Å; T208-I214 HydrophobicContact CG2-CG1 4.32Å; I211-I214 HydrophobicContact CD1-CD1 4.04Å; I211-I214 HydrophobicContact CG2-CD1 4.27Å; I214-F217 HydrophobicContact CD1-CD1 4.29Å; I214-F217 PolarHBondContact O-N 3.18Å; I214-E218 HydrophobicContact CD1-CG 3.87Å; I214-E218 HydrophobicContact CG1-CG 4.2Å; I214-E218 WeakPolarHBondContact O-CB 3.44Å; I214-E218 WeakPolarHBondContact O-CG 3.34Å; I214-E218 PolarHBondContact O-N 2.84Å
215	L	82.1	Confident	88.3	Confident	126 Å²	126	73.5 Å²	73.5	66%	0.66	37%	0.367	S	S	*	.	H	α-helix	trans	-65.6	-45.4	-178.5	-63.5	177	0	0	0	111	N213 Y219	N213-L215 VanDerWaalsContact C-N 3.31Å; N213-L215 PolarHBondContact O-N 2.97Å; N213-L215 PolarHBondContact OD1-N 2.96Å; L215-Y219 WeakPolarHBondContact O-CB 3.49Å; L215-Y219 PolarHBondContact O-N 3.43Å; L215-Y219 VanDerWaalsContact O-N 3.13Å
216	W	83.7	Confident	88.1	Confident	152 Å²	152	74.3 Å²	74.3	58%	0.576	38%	0.377	S	S	*	.	H	α-helix	trans	-66.5	-41.8	175.9	-178.2	-105	0	0	0	112	N213 Y219 T220	N213-W216 HydrophobicContact CB-CB 4.1Å; N213-W216 PolarHBondContact O-N 3.13Å; N213-W216 WeakPolarHBondContact OD1-CB 3.43Å; N213-W216 PolarHBondContact OD1-N 3.23Å; W216-Y219 HydrophobicContact CE3-CD1 4.47Å; W216-Y219 HydrophobicContact CZ3-CD1 4.36Å; W216-Y219 PolarHBondContact O-N 3.41Å; W216-T220 HydrophobicContact CD2-CG2 3.97Å; W216-T220 VanDerWaalsContact CE2-CG2 3.49Å; W216-T220 HydrophobicContact CG-CG2 4.4Å; W216-T220 HydrophobicContact CH2-CG2 4.31Å; W216-T220 HydrophobicContact CZ2-CG2 3.69Å; W216-T220 WeakPolarHBondContact O-CB 3.46Å; W216-T220 WeakPolarHBondContact O-CG2 3.34Å; W216-T220 PolarHBondContact O-N 3.1Å; W216-T220 PolarHBondContact O-OG1 2.96Å
217	F	87.8	Confident	88.2	Confident	93 Å²	93	76.1 Å²	76.1	41%	0.408	38%	0.384	S	S	.	.	H	α-helix	trans	-60.7	-52.9	177.7	177.6	-96.6	0	0	0	111.8	I211 N213 I214 Y219 T220 V221	I211-F217 HydrophobicContact CD1-CD1 3.76Å; I211-F217 HydrophobicContact CD1-CE1 3.74Å; I211-F217 HydrophobicContact CD1-CG 4.24Å; I211-F217 HydrophobicContact CD1-CZ 4.22Å; I211-F217 HydrophobicContact CG2-CB 3.61Å; I211-F217 HydrophobicContact CG2-CD1 4.22Å; I211-F217 HydrophobicContact CG2-CD2 4.31Å; I211-F217 HydrophobicContact CG2-CG 3.79Å; N213-F217 WeakPolarHBondContact O-CB 3.38Å; N213-F217 PolarHBondContact O-N 3.2Å; I214-F217 HydrophobicContact CD1-CD1 4.29Å; I214-F217 PolarHBondContact O-N 3.18Å; F217-Y219 VanDerWaalsContact C-N 3.3Å; F217-Y219 PolarHBondContact O-N 2.99Å; F217-T220 PolarHBondContact O-N 2.62Å; F217-T220 PolarHBondContact O-OG1 3.45Å; F217-T220 VanDerWaalsContact O-OG1 3.1Å; F217-V221 HydrophobicContact CD1-CG2 4.48Å; F217-V221 HydrophobicContact CD2-CG2 4.08Å; F217-V221 HydrophobicContact CE1-CG2 4.19Å; F217-V221 HydrophobicContact CE2-CG2 3.76Å; F217-V221 HydrophobicContact CG-CG2 4.44Å; F217-V221 HydrophobicContact CZ-CG2 3.82Å; F217-V221 WeakPolarHBondContact O-CB 3.35Å; F217-V221 WeakPolarHBondContact O-CG2 3.22Å; F217-V221 PolarHBondContact O-N 3.1Å
218	E	88.3	Confident	88.2	Confident	36 Å²	36	77.1 Å²	77.1	17%	0.168	39%	0.39	C	S	.	.	H	α-helix	trans	-59.9	-41.4	179.3	-73.6	-172.5	145.6	0	0	111.4	K54 R206 I214 T222	K54-E218 IonicContact NZ-OE1 2.74Å; K54-E218 PolarHBondContact NZ-OE1 3.02Å; K54-E218 IonicContact NZ-OE2 3.31Å; K54-E218 PolarHBondContact NZ-OE2 3.35Å; R206-E218 IonicContact CZ-OE1 3.22Å; R206-E218 IonicContact NH1-OE1 2.94Å; R206-E218 PolarHBondContact NH1-OE1 3.37Å; R206-E218 VanDerWaalsContact NH1-OE1 3.15Å; R206-E218 IonicContact NH2-OE1 2.85Å; R206-E218 PolarHBondContact NH2-OE1 3.31Å; I214-E218 HydrophobicContact CD1-CG 3.87Å; I214-E218 HydrophobicContact CG1-CG 4.2Å; I214-E218 WeakPolarHBondContact O-CB 3.44Å; I214-E218 WeakPolarHBondContact O-CG 3.34Å; I214-E218 PolarHBondContact O-N 2.84Å; E218-T222 VanDerWaalsContact O-CB 3.22Å; E218-T222 WeakPolarHBondContact O-CB 3.37Å; E218-T222 PolarHBondContact O-N 3Å; E218-T222 VanDerWaalsContact O-N 3.09Å; E218-T222 PolarHBondContact O-OG1 2.68Å
219	Y	88.6	Confident	88.4	Confident	120 Å²	120	83.4 Å²	83.4	47%	0.471	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-51.1	176.9	174.4	-101.3	0	0	0	112.5	L215 W216 F217 R223	L215-Y219 WeakPolarHBondContact O-CB 3.49Å; L215-Y219 PolarHBondContact O-N 3.43Å; L215-Y219 VanDerWaalsContact O-N 3.13Å; W216-Y219 HydrophobicContact CE3-CD1 4.47Å; W216-Y219 HydrophobicContact CZ3-CD1 4.36Å; W216-Y219 PolarHBondContact O-N 3.41Å; F217-Y219 VanDerWaalsContact C-N 3.3Å; F217-Y219 PolarHBondContact O-N 2.99Å; Y219-R223 VanDerWaalsContact O-CB 3.22Å; Y219-R223 WeakPolarHBondContact O-CB 3.47Å; Y219-R223 PolarHBondContact O-N 3.09Å; Y219-R223 PolarHBondContact OH-NH1 2.98Å
220	T	90.4	Very high	88.7	Confident	46 Å²	46	89.5 Å²	89.5	28%	0.282	44%	0.438	S	S	.	.	H	α-helix	trans	-69.1	-42.5	-174	49.6	0	0	0	0	112.4	W216 F217 R223 S224	W216-T220 HydrophobicContact CD2-CG2 3.97Å; W216-T220 VanDerWaalsContact CE2-CG2 3.49Å; W216-T220 HydrophobicContact CG-CG2 4.4Å; W216-T220 HydrophobicContact CH2-CG2 4.31Å; W216-T220 HydrophobicContact CZ2-CG2 3.69Å; W216-T220 WeakPolarHBondContact O-CB 3.46Å; W216-T220 WeakPolarHBondContact O-CG2 3.34Å; W216-T220 PolarHBondContact O-N 3.1Å; W216-T220 PolarHBondContact O-OG1 2.96Å; F217-T220 PolarHBondContact O-N 2.62Å; F217-T220 PolarHBondContact O-OG1 3.45Å; F217-T220 VanDerWaalsContact O-OG1 3.1Å; T220-R223 PolarHBondContact O-N 2.85Å; T220-S224 WeakPolarHBondContact O-CB 3.37Å; T220-S224 PolarHBondContact O-N 3.42Å; T220-S224 PolarHBondContact O-OG 3.33Å
221	V	92.6	Very high	88.9	Confident	66 Å²	66	90 Å²	90	40%	0.4	43%	0.428	S	S	.	.	H	α-helix	trans	-65.8	-44.9	177.6	174.1	0	0	0	0	111.1	F217 R223 S224 E225	F217-V221 HydrophobicContact CD1-CG2 4.48Å; F217-V221 HydrophobicContact CD2-CG2 4.08Å; F217-V221 HydrophobicContact CE1-CG2 4.19Å; F217-V221 HydrophobicContact CE2-CG2 3.76Å; F217-V221 HydrophobicContact CG-CG2 4.44Å; F217-V221 HydrophobicContact CZ-CG2 3.82Å; F217-V221 WeakPolarHBondContact O-CB 3.35Å; F217-V221 WeakPolarHBondContact O-CG2 3.22Å; F217-V221 PolarHBondContact O-N 3.1Å; V221-R223 VanDerWaalsContact C-N 3.35Å; V221-R223 PolarHBondContact O-N 3.01Å; V221-S224 PolarHBondContact O-N 2.96Å; V221-S224 PolarHBondContact O-OG 3.43Å; V221-E225 WeakPolarHBondContact O-CB 3.22Å; V221-E225 PolarHBondContact O-N 3.45Å
222	T	92	Very high	89.2	Confident	97 Å²	97	95 Å²	95	60%	0.595	45%	0.449	S	S	*	.	H	α-helix	trans	-63.5	-43.4	178.6	-55.6	0	0	0	0	111	E218 A226	E218-T222 VanDerWaalsContact O-CB 3.22Å; E218-T222 WeakPolarHBondContact O-CB 3.37Å; E218-T222 PolarHBondContact O-N 3Å; E218-T222 VanDerWaalsContact O-N 3.09Å; E218-T222 PolarHBondContact O-OG1 2.68Å; T222-A226 WeakPolarHBondContact O-CB 3.34Å; T222-A226 PolarHBondContact O-N 3.48Å
223	R	92.6	Very high	89.7	Confident	109 Å²	109	96.6 Å²	96.6	41%	0.411	45%	0.452	S	S	.	.	H	α-helix	trans	-66.6	-40.5	179.8	-177.3	175.7	176.1	174.2	-1.8	112.5	Y219 T220 V221 R227	Y219-R223 VanDerWaalsContact O-CB 3.22Å; Y219-R223 WeakPolarHBondContact O-CB 3.47Å; Y219-R223 PolarHBondContact O-N 3.09Å; Y219-R223 PolarHBondContact OH-NH1 2.98Å; T220-R223 PolarHBondContact O-N 2.85Å; V221-R223 VanDerWaalsContact C-N 3.35Å; V221-R223 PolarHBondContact O-N 3.01Å; R223-R227 WeakPolarHBondContact O-CG 3.37Å; R223-R227 PolarHBondContact O-N 2.74Å
224	S	94.4	Very high	89.6	Confident	56 Å²	56	96.9 Å²	96.9	39%	0.392	46%	0.463	S	S	.	.	H	α-helix	trans	-67.6	-43.8	178.5	66.3	0	0	0	0	111	T220 V221 R227 N228	T220-S224 WeakPolarHBondContact O-CB 3.37Å; T220-S224 PolarHBondContact O-N 3.42Å; T220-S224 PolarHBondContact O-OG 3.33Å; V221-S224 PolarHBondContact O-N 2.96Å; V221-S224 PolarHBondContact O-OG 3.43Å; S224-R227 PolarHBondContact O-N 3.18Å; S224-N228 VanDerWaalsContact O-CG 3.25Å; S224-N228 PolarHBondContact O-N 2.98Å; S224-N228 PolarHBondContact O-ND2 2.95Å
225	E	94.4	Very high	89	Confident	77 Å²	77	99.3 Å²	99.3	36%	0.36	48%	0.48	S	S	.	.	H	α-helix	trans	-64.7	-42.7	178.5	-178.1	59.3	-169.4	0	0	112.1	V221 R227 N228 R229	V221-E225 WeakPolarHBondContact O-CB 3.22Å; V221-E225 PolarHBondContact O-N 3.45Å; E225-R227 VanDerWaalsContact C-N 3.35Å; E225-R227 PolarHBondContact O-N 2.76Å; E225-N228 PolarHBondContact O-N 2.94Å; E225-R229 WeakPolarHBondContact O-CG 3.45Å; E225-R229 PolarHBondContact O-N 3.41Å; E225-R229 IonicContact OE1-CZ 2.71Å; E225-R229 VanDerWaalsContact OE1-CZ 3.22Å; E225-R229 IonicContact OE1-NE 2.85Å; E225-R229 PolarHBondContact OE1-NE 3.15Å; E225-R229 IonicContact OE1-NH2 3.89Å; E225-R229 PolarHBondContact OE1-NH2 3.23Å
226	A	93.3	Very high	88.3	Confident	48 Å²	48	101.9 Å²	101.9	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-58.6	-44.9	175.5	0	0	0	0	0	112.2	T222 R229 Q230	T222-A226 WeakPolarHBondContact O-CB 3.34Å; T222-A226 PolarHBondContact O-N 3.48Å; A226-R229 PolarHBondContact O-N 2.97Å; A226-Q230 WeakPolarHBondContact O-CG 3.41Å; A226-Q230 PolarHBondContact O-N 3.22Å
227	R	93.4	Very high	87.1	Confident	124 Å²	124	102 Å²	102	47%	0.468	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-42.3	176.5	-76.3	172.2	165	-174.2	-11.5	112.2	R223 S224 E225 R229 Q230 R231	R223-R227 WeakPolarHBondContact O-CG 3.37Å; R223-R227 PolarHBondContact O-N 2.74Å; S224-R227 PolarHBondContact O-N 3.18Å; E225-R227 VanDerWaalsContact C-N 3.35Å; E225-R227 PolarHBondContact O-N 2.76Å; R227-R229 VanDerWaalsContact C-N 3.33Å; R227-R229 PolarHBondContact O-N 3.24Å; R227-Q230 PolarHBondContact O-N 3.49Å; R227-R231 WeakPolarHBondContact O-CG 3.37Å; R227-R231 PolarHBondContact O-N 3.01Å
228	N	93.7	Very high	85.4	Confident	71 Å²	71	108.2 Å²	108.2	38%	0.38	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-40.9	178.1	-72.3	-18.2	0	0	0	111.4	S224 E225 R231 K232	S224-N228 VanDerWaalsContact O-CG 3.25Å; S224-N228 PolarHBondContact O-N 2.98Å; S224-N228 PolarHBondContact O-ND2 2.95Å; E225-N228 PolarHBondContact O-N 2.94Å; N228-R231 PolarHBondContact O-N 3.36Å; N228-K232 WeakPolarHBondContact O-CG 3.36Å; N228-K232 PolarHBondContact O-N 3.39Å; N228-K232 VanDerWaalsContact O-N 3.15Å
229	R	93.1	Very high	85.3	Confident	155 Å²	155	111.9 Å²	111.9	59%	0.585	55%	0.545	S	S	*	.	H	α-helix	trans	-66.6	-43.7	175.7	-71.2	-179.7	-177.4	-108.4	-7.6	112.6	E225 A226 R227 R231 K232 L233	E225-R229 WeakPolarHBondContact O-CG 3.45Å; E225-R229 PolarHBondContact O-N 3.41Å; E225-R229 IonicContact OE1-CZ 2.71Å; E225-R229 VanDerWaalsContact OE1-CZ 3.22Å; E225-R229 IonicContact OE1-NE 2.85Å; E225-R229 PolarHBondContact OE1-NE 3.15Å; E225-R229 IonicContact OE1-NH2 3.89Å; E225-R229 PolarHBondContact OE1-NH2 3.23Å; A226-R229 PolarHBondContact O-N 2.97Å; R227-R229 VanDerWaalsContact C-N 3.33Å; R227-R229 PolarHBondContact O-N 3.24Å; R229-R231 VanDerWaalsContact C-N 3.31Å; R229-R231 PolarHBondContact O-N 3.41Å; R229-K232 PolarHBondContact O-N 2.96Å; R229-L233 PolarHBondContact O-N 3.32Å
230	Q	92.4	Very high	85.1	Confident	136 Å²	136	111.4 Å²	111.4	64%	0.636	55%	0.549	S	S	*	.	H	α-helix	trans	-58.3	-43.6	175.6	-76.9	176.6	-22.8	0	0	112	A226 R227 L233 G234	A226-Q230 WeakPolarHBondContact O-CG 3.41Å; A226-Q230 PolarHBondContact O-N 3.22Å; R227-Q230 PolarHBondContact O-N 3.49Å; Q230-L233 PolarHBondContact O-N 3.48Å; Q230-G234 PolarHBondContact O-N 3.48Å
231	R	90.9	Very high	84.8	Confident	179 Å²	179	115.1 Å²	115.1	68%	0.675	56%	0.564	S	S	*	*	H	α-helix	trans	-59.2	-48.5	175.6	-73.6	173	177.8	-179.1	-3.7	111.7	R227 N228 R229 L233 G234 T235	R227-R231 WeakPolarHBondContact O-CG 3.37Å; R227-R231 PolarHBondContact O-N 3.01Å; N228-R231 PolarHBondContact O-N 3.36Å; R229-R231 VanDerWaalsContact C-N 3.31Å; R229-R231 PolarHBondContact O-N 3.41Å; R231-L233 VanDerWaalsContact C-N 3.32Å; R231-L233 PolarHBondContact O-N 3Å; R231-G234 PolarHBondContact O-N 3.15Å; R231-T235 PolarHBondContact O-N 3.48Å; R231-T235 VanDerWaalsContact O-N 3.1Å; R231-T235 PolarHBondContact O-OG1 3.1Å
232	K	89.5	Confident	84.3	Confident	150 Å²	150	117.9 Å²	117.9	65%	0.652	57%	0.574	S	S	*	*	H	α-helix	trans	-62.9	-33.9	178.6	-71.9	178.8	-179.9	-179.6	0	113.4	N228 R229 K236	N228-K232 WeakPolarHBondContact O-CG 3.36Å; N228-K232 PolarHBondContact O-N 3.39Å; N228-K232 VanDerWaalsContact O-N 3.15Å; R229-K232 PolarHBondContact O-N 2.96Å; K232-K236 WeakPolarHBondContact O-CG 3.49Å; K232-K236 PolarHBondContact O-N 3.41Å
233	L	86.4	Confident	83.9	Confident	110 Å²	110	119.3 Å²	119.3	58%	0.576	57%	0.572	S	S	*	*	H	α-helix	trans	-69	-44.4	174.6	-82.8	152	0	0	0	111.4	R229 Q230 R231 T235 K236 L237	R229-L233 PolarHBondContact O-N 3.32Å; Q230-L233 PolarHBondContact O-N 3.48Å; R231-L233 VanDerWaalsContact C-N 3.32Å; R231-L233 PolarHBondContact O-N 3Å; L233-T235 VanDerWaalsContact C-N 3.3Å; L233-T235 PolarHBondContact O-N 2.74Å; L233-K236 PolarHBondContact O-N 3.38Å; L233-K236 VanDerWaalsContact O-N 3.15Å; L233-L237 PolarHBondContact O-N 3.49Å
234	G	78.2	Confident	83.3	Confident	39 Å²	39	119.9 Å²	119.9	40%	0.402	58%	0.583	S	S	.	*	H	α-helix	trans	-62.2	-34.1	177	0	0	0	0	0	113.5	Q230 R231 K236	Q230-G234 PolarHBondContact O-N 3.48Å; R231-G234 PolarHBondContact O-N 3.15Å; G234-K236 VanDerWaalsContact C-N 3.32Å; G234-K236 PolarHBondContact O-N 3.25Å
235	T	71.3	Confident	82.5	Confident	95 Å²	95	124.5 Å²	124.5	58%	0.583	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-17.7	176.3	-5.7	0	0	0	0	113.9	R231 L233	R231-T235 PolarHBondContact O-N 3.48Å; R231-T235 VanDerWaalsContact O-N 3.1Å; R231-T235 PolarHBondContact O-OG1 3.1Å; L233-T235 VanDerWaalsContact C-N 3.3Å; L233-T235 PolarHBondContact O-N 2.74Å
236	K	66.4	Low	81.6	Confident	181 Å²	181	128.2 Å²	128.2	79%	0.787	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-11.5	177.5	-77.1	-174	176.5	-168.6	0	113.7	K232 L233 G234	K232-K236 WeakPolarHBondContact O-CG 3.49Å; K232-K236 PolarHBondContact O-N 3.41Å; L233-K236 PolarHBondContact O-N 3.38Å; L233-K236 VanDerWaalsContact O-N 3.15Å; G234-K236 VanDerWaalsContact C-N 3.32Å; G234-K236 PolarHBondContact O-N 3.25Å
237	L	59.8	Low	80.6	Confident	154 Å²	154	134.8 Å²	134.8	81%	0.806	63%	0.633	S	S	*	*			trans	-100.5	2.9	-178.8	-74.3	162.1	0	0	0	112.6	L233	L233-L237 PolarHBondContact O-N 3.49Å
238	Q	52	Low	79.4	Confident	224 Å²	224	135.8 Å²	135.8	100%	1.047	65%	0.648	S	S	*	*			trans	-107.6	0	170	-71.3	-176.2	-40.6	0	0	109

Retrieved 238 of 238 residues in 1027.9 ms (Link to these results)

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