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14-3-3-like protein GF14 mu

Is associated with a DNA binding complex that binds to the G box, a well-characterized cis-acting DNA regulatory element found in plant genes.

AlphaFold DB , UniProt , Accession Q96299, Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene GRF9, Length 263 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	47.6	Very low	84.7	Confident	220 Å²	220	86.3 Å²	86.3	100%	1.084	47%	0.473	S	S	*	.				0	-22	0	-67.9	-165.9	-148.7	0	0	113.7
2	G	61.3	Low	85.8	Confident	46 Å²	46	91 Å²	91	47%	0.474	48%	0.48	S	S	.	.	H	α-helix	trans	-72.8	-49.9	179.1	0	0	0	0	0	114.8	G4 K5 E6	G2-G4 VanDerWaalsContact C-N 3.31Å; G2-G4 PolarHBondContact O-N 3.21Å; G2-K5 PolarHBondContact O-N 3.06Å; G2-K5 VanDerWaalsContact O-N 3.14Å; G2-E6 PolarHBondContact O-N 3.23Å; G2-E6 VanDerWaalsContact O-N 3.14Å
3	S	74.5	Confident	86.8	Confident	77 Å²	77	89.5 Å²	89.5	54%	0.538	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-34.9	-173.9	57.9	0	0	0	0	114.8	E6 R7	S3-E6 PolarHBondContact O-N 2.72Å; S3-R7 WeakPolarHBondContact O-CB 3.22Å; S3-R7 PolarHBondContact O-N 3.3Å
4	G	80.9	Confident	87.6	Confident	33 Å²	33	83.1 Å²	83.1	34%	0.34	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-45.7	176.8	0	0	0	0	0	112.5	G2 E6 R7 D8	G2-G4 VanDerWaalsContact C-N 3.31Å; G2-G4 PolarHBondContact O-N 3.21Å; G4-E6 VanDerWaalsContact C-N 3.3Å; G4-E6 PolarHBondContact O-N 2.68Å; G4-R7 PolarHBondContact O-N 3.1Å; G4-D8 PolarHBondContact O-N 3.24Å
5	K	88.1	Confident	88.3	Confident	155 Å²	155	81.3 Å²	81.3	67%	0.674	43%	0.425	S	S	*	.	H	α-helix	trans	-66.5	-34.2	177.6	-67.3	-171.5	178.9	-174.3	0	112.2	G2 T9	G2-K5 PolarHBondContact O-N 3.06Å; G2-K5 VanDerWaalsContact O-N 3.14Å; K5-T9 WeakPolarHBondContact O-CB 3.17Å; K5-T9 PolarHBondContact O-N 2.62Å; K5-T9 PolarHBondContact O-OG1 3.01Å
6	E	91.7	Very high	89	Confident	107 Å²	107	80.6 Å²	80.6	50%	0.5	42%	0.422	S	S	.	.	H	α-helix	trans	-66.6	-47.3	174.5	-71.6	173.1	163	0	0	111	G2 S3 G4 D8 T9 F10	G2-E6 PolarHBondContact O-N 3.23Å; G2-E6 VanDerWaalsContact O-N 3.14Å; S3-E6 PolarHBondContact O-N 2.72Å; G4-E6 VanDerWaalsContact C-N 3.3Å; G4-E6 PolarHBondContact O-N 2.68Å; E6-D8 PolarHBondContact O-N 3.31Å; E6-T9 WeakPolarHBondContact O-CB 3.47Å; E6-T9 PolarHBondContact O-N 2.99Å; E6-T9 VanDerWaalsContact O-N 3.15Å; E6-F10 HydrophobicContact CB-CE2 4.17Å; E6-F10 WeakPolarHBondContact O-CD2 3.07Å; E6-F10 PolarHBondContact O-N 2.93Å
7	R	96.6	Very high	89.5	Confident	51 Å²	51	76.8 Å²	76.8	19%	0.192	40%	0.404	C	S	.	.	H	α-helix	trans	-53.5	-52.4	173.8	-173.2	176.4	-177.8	165.2	5	111.3	S3 G4 T9 F10 V11 V33 L36 D39 E44	S3-R7 WeakPolarHBondContact O-CB 3.22Å; S3-R7 PolarHBondContact O-N 3.3Å; G4-R7 PolarHBondContact O-N 3.1Å; R7-T9 VanDerWaalsContact C-N 3.25Å; R7-T9 PolarHBondContact O-N 2.87Å; R7-F10 PolarHBondContact O-N 3.2Å; R7-V11 HydrophobicContact CG-CG2 4.46Å; R7-V11 WeakPolarHBondContact O-CG2 3.4Å; R7-V11 PolarHBondContact O-N 2.69Å; R7-V33 HydrophobicContact CG-CG1 4.21Å; R7-L36 HydrophobicContact CB-CD1 3.6Å; R7-L36 HydrophobicContact CG-CD1 4.07Å; R7-D39 PolarHBondContact NH2-O 3.27Å; R7-E44 IonicContact CZ-OE1 2.64Å; R7-E44 IonicContact CZ-OE2 3.69Å; R7-E44 IonicContact NE-OE1 3.5Å; R7-E44 PolarHBondContact NE-OE1 3.39Å; R7-E44 IonicContact NE-OE2 2.89Å; R7-E44 IonicContact NH2-OE1 2.8Å; R7-E44 PolarHBondContact NH2-OE1 3.24Å; R7-E44 IonicContact NH2-OE2 3.06Å; R7-E44 PolarHBondContact NH2-OE2 3.37Å
8	D	96.9	Very high	90	Very high	109 Å²	109	76.6 Å²	76.6	58%	0.583	40%	0.4	S	S	*	.	H	α-helix	trans	-59.3	-38.2	179.9	-64	-19.1	0	0	0	111.8	G4 E6 Y12	G4-D8 PolarHBondContact O-N 3.24Å; E6-D8 PolarHBondContact O-N 3.31Å; D8-Y12 VanDerWaalsContact O-CB 3.31Å; D8-Y12 WeakPolarHBondContact O-CB 3.32Å; D8-Y12 PolarHBondContact O-N 2.91Å
9	T	97.4	Very high	90.4	Very high	77 Å²	77	80.8 Å²	80.8	47%	0.472	42%	0.418	S	S	.	.	H	α-helix	trans	-65.7	-47.7	177.3	-58.6	0	0	0	0	111.2	K5 E6 R7 Y12 L13	K5-T9 WeakPolarHBondContact O-CB 3.17Å; K5-T9 PolarHBondContact O-N 2.62Å; K5-T9 PolarHBondContact O-OG1 3.01Å; E6-T9 WeakPolarHBondContact O-CB 3.47Å; E6-T9 PolarHBondContact O-N 2.99Å; E6-T9 VanDerWaalsContact O-N 3.15Å; R7-T9 VanDerWaalsContact C-N 3.25Å; R7-T9 PolarHBondContact O-N 2.87Å; T9-Y12 PolarHBondContact O-N 2.91Å; T9-L13 HydrophobicContact CG2-CD1 4.22Å; T9-L13 VanDerWaalsContact O-CG 3.31Å; T9-L13 WeakPolarHBondContact O-CG 3.45Å; T9-L13 PolarHBondContact O-N 3.46Å
10	F	98	Very high	90.7	Very high	61 Å²	61	79.9 Å²	79.9	27%	0.268	42%	0.423	S	S	.	.	H	α-helix	trans	-65.9	-40	179.2	-66.5	-54	0	0	0	112.4	E6 R7 Y12 L13 A14 V33	E6-F10 HydrophobicContact CB-CE2 4.17Å; E6-F10 WeakPolarHBondContact O-CD2 3.07Å; E6-F10 PolarHBondContact O-N 2.93Å; R7-F10 PolarHBondContact O-N 3.2Å; F10-Y12 VanDerWaalsContact C-N 3.35Å; F10-L13 PolarHBondContact O-N 3.42Å; F10-A14 PolarHBondContact O-N 3.18Å; F10-V33 HydrophobicContact CB-CG2 3.51Å; F10-V33 HydrophobicContact CG-CG2 4.49Å
11	V	98.3	Very high	91.1	Very high	13 Å²	13	83.1 Å²	83.1	8%	0.079	44%	0.435	C	S	.	.	H	α-helix	trans	-62.9	-42.8	175	172.5	0	0	0	0	111	R7 L13 A14 K15 V33 E44 L47	R7-V11 HydrophobicContact CG-CG2 4.46Å; R7-V11 WeakPolarHBondContact O-CG2 3.4Å; R7-V11 PolarHBondContact O-N 2.69Å; V11-L13 PolarHBondContact O-N 3.3Å; V11-A14 PolarHBondContact O-N 3.25Å; V11-K15 HydrophobicContact CG1-CD 4.46Å; V11-K15 WeakPolarHBondContact O-CG 3.47Å; V11-K15 PolarHBondContact O-N 3.04Å; V11-V33 HydrophobicContact CG2-CG2 3.88Å; V11-E44 HydrophobicContact CG2-CG 3.81Å; V11-L47 HydrophobicContact CG1-CD1 4.02Å
12	Y	98.3	Very high	93.5	Very high	143 Å²	143	79.2 Å²	79.2	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-61.4	-43.3	174.9	177.1	-106.9	0	0	0	112.3	D8 T9 F10 K15 L16	D8-Y12 VanDerWaalsContact O-CB 3.31Å; D8-Y12 WeakPolarHBondContact O-CB 3.32Å; D8-Y12 PolarHBondContact O-N 2.91Å; T9-Y12 PolarHBondContact O-N 2.91Å; F10-Y12 VanDerWaalsContact C-N 3.35Å; Y12-K15 PolarHBondContact O-N 3.45Å; Y12-L16 HydrophobicContact CD1-CD1 4.05Å; Y12-L16 HydrophobicContact CE1-CD1 3.43Å; Y12-L16 VanDerWaalsContact CE1-CD1 3.43Å; Y12-L16 HydrophobicContact CE1-CG 4.07Å; Y12-L16 HydrophobicContact CE2-CD2 4.44Å; Y12-L16 HydrophobicContact CE2-CG 4.36Å; Y12-L16 PolarHBondContact O-N 2.89Å
13	L	98.5	Very high	95.2	Very high	71 Å²	71	79.6 Å²	79.6	37%	0.372	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-39.2	175.8	-69.6	173.5	0	0	0	112.2	T9 F10 V11 K15 L16 S17	T9-L13 HydrophobicContact CG2-CD1 4.22Å; T9-L13 VanDerWaalsContact O-CG 3.31Å; T9-L13 WeakPolarHBondContact O-CG 3.45Å; T9-L13 PolarHBondContact O-N 3.46Å; F10-L13 PolarHBondContact O-N 3.42Å; V11-L13 PolarHBondContact O-N 3.3Å; L13-K15 VanDerWaalsContact C-N 3.35Å; L13-K15 PolarHBondContact O-N 3.49Å; L13-L16 PolarHBondContact O-N 3.34Å; L13-S17 WeakPolarHBondContact O-CB 3.36Å; L13-S17 PolarHBondContact O-N 3.01Å; L13-S17 PolarHBondContact O-OG 2.59Å; L13-S17 VanDerWaalsContact O-OG 3.06Å
14	A	98.6	Very high	96.3	Very high	0 Å²	0	80 Å²	80	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-60.6	-43.5	175	0	0	0	0	0	111.7	F10 V11 S17 E18 M26 M30 L47	F10-A14 PolarHBondContact O-N 3.18Å; V11-A14 PolarHBondContact O-N 3.25Å; A14-S17 WeakPolarHBondContact O-CB 3.34Å; A14-S17 PolarHBondContact O-N 3.01Å; A14-E18 PolarHBondContact O-N 3.48Å; A14-M26 HydrophobicContact CB-CG 4.18Å; A14-M30 HydrophobicContact CB-CG 3.84Å; A14-M30 HydrophobicContact CB-SD 3.57Å; A14-M30 VanDerWaalsContact CB-SD 3.57Å; A14-L47 HydrophobicContact CB-CD1 4.43Å
15	K	98.5	Very high	97.1	Very high	56 Å²	56	81.8 Å²	81.8	24%	0.243	39%	0.389	C	S	.	.	H	α-helix	trans	-64.2	-38.5	175.8	-68.6	175.6	-175	-174	0	113	V11 Y12 L13 Q19 E43 L47	V11-K15 HydrophobicContact CG1-CD 4.46Å; V11-K15 WeakPolarHBondContact O-CG 3.47Å; V11-K15 PolarHBondContact O-N 3.04Å; Y12-K15 PolarHBondContact O-N 3.45Å; L13-K15 VanDerWaalsContact C-N 3.35Å; L13-K15 PolarHBondContact O-N 3.49Å; K15-Q19 WeakPolarHBondContact O-CG 3.46Å; K15-Q19 PolarHBondContact O-N 3.32Å; K15-Q19 VanDerWaalsContact O-N 3.15Å; K15-E43 WeakPolarHBondContact CE-OE1 3.48Å; K15-E43 IonicContact NZ-OE1 3.67Å; K15-E43 PolarHBondContact NZ-OE1 3.01Å; K15-E43 IonicContact NZ-OE2 3.41Å; K15-E43 PolarHBondContact NZ-OE2 2.8Å; K15-L47 HydrophobicContact CG-CD1 3.97Å; K15-L47 HydrophobicContact CG-CD2 4.04Å
16	L	98.5	Very high	97.6	Very high	71 Å²	71	74.4 Å²	74.4	37%	0.372	36%	0.357	S	S	.	.	H	α-helix	trans	-65.6	-41.9	174	-72.2	-178.6	0	0	0	111.5	Y12 L13 Q19 A20	Y12-L16 HydrophobicContact CD1-CD1 4.05Å; Y12-L16 HydrophobicContact CE1-CD1 3.43Å; Y12-L16 VanDerWaalsContact CE1-CD1 3.43Å; Y12-L16 HydrophobicContact CE1-CG 4.07Å; Y12-L16 HydrophobicContact CE2-CD2 4.44Å; Y12-L16 HydrophobicContact CE2-CG 4.36Å; Y12-L16 PolarHBondContact O-N 2.89Å; L13-L16 PolarHBondContact O-N 3.34Å; L16-Q19 PolarHBondContact O-N 3.33Å; L16-A20 WeakPolarHBondContact O-CB 3.45Å; L16-A20 PolarHBondContact O-N 3.14Å; L16-A20 VanDerWaalsContact O-N 3.16Å
17	S	98.5	Very high	97.9	Very high	16 Å²	16	69.5 Å²	69.5	11%	0.112	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-40.8	177.1	-65.9	0	0	0	0	111.8	L13 A14 A20 E21 R22	L13-S17 WeakPolarHBondContact O-CB 3.36Å; L13-S17 PolarHBondContact O-N 3.01Å; L13-S17 PolarHBondContact O-OG 2.59Å; L13-S17 VanDerWaalsContact O-OG 3.06Å; A14-S17 WeakPolarHBondContact O-CB 3.34Å; A14-S17 PolarHBondContact O-N 3.01Å; S17-A20 CarbonylContact O-C 3.44Å; S17-A20 PolarHBondContact O-N 3.13Å; S17-E21 PolarHBondContact O-N 3.35Å; S17-R22 WeakPolarHBondContact CB-O 3.22Å; S17-R22 PolarHBondContact O-N 2.8Å
18	E	97.6	Very high	98	Very high	72 Å²	72	71.9 Å²	71.9	34%	0.336	35%	0.348	S	S	.	.	H	α-helix	trans	-57.6	-51.8	173.4	-176.2	-179.5	-149.6	0	0	111.9	A14 A20 E21 M26 L47	A14-E18 PolarHBondContact O-N 3.48Å; E18-A20 PolarHBondContact O-N 3.06Å; E18-A20 VanDerWaalsContact O-N 3.14Å; E18-E21 PolarHBondContact O-N 3.44Å; E18-M26 HydrophobicContact CB-CE 3.83Å; E18-M26 HydrophobicContact CB-SD 4.03Å; E18-M26 HydrophobicContact CG-CE 4.08Å; E18-M26 HydrophobicContact CG-SD 4.48Å; E18-L47 WeakPolarHBondContact OE2-CD2 3.41Å
19	Q	97.4	Very high	98.1	Very high	158 Å²	158	67.3 Å²	67.3	74%	0.738	32%	0.324	S	S	*	.	H	α-helix	trans	-61.6	-23.8	178.5	-71.1	173.8	43.5	0	0	113.5	K15 L16	K15-Q19 WeakPolarHBondContact O-CG 3.46Å; K15-Q19 PolarHBondContact O-N 3.32Å; K15-Q19 VanDerWaalsContact O-N 3.15Å; L16-Q19 PolarHBondContact O-N 3.33Å
20	A	97.8	Very high	98.1	Very high	62 Å²	62	63.7 Å²	63.7	51%	0.512	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	5.8	177.4	0	0	0	0	0	113.2	L16 S17 E18 R22	L16-A20 WeakPolarHBondContact O-CB 3.45Å; L16-A20 PolarHBondContact O-N 3.14Å; L16-A20 VanDerWaalsContact O-N 3.16Å; S17-A20 CarbonylContact O-C 3.44Å; S17-A20 PolarHBondContact O-N 3.13Å; E18-A20 PolarHBondContact O-N 3.06Å; E18-A20 VanDerWaalsContact O-N 3.14Å; A20-R22 HydrophobicContact CB-CG 4.09Å; A20-R22 PolarHBondContact O-N 2.74Å; A20-R22 VanDerWaalsContact O-N 3.16Å
21	E	97.1	Very high	98.1	Very high	148 Å²	148	61.7 Å²	61.7	69%	0.692	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	30.4	-175.7	-56.5	-176.1	155.4	0	0	113.6	S17 E18 Y23	S17-E21 PolarHBondContact O-N 3.35Å; E18-E21 PolarHBondContact O-N 3.44Å; E21-Y23 HydrophobicContact CB-CE2 3.9Å; E21-Y23 WeakPolarHBondContact O-CD2 3.46Å; E21-Y23 PolarHBondContact O-N 3.28Å
22	R	98	Very high	98.1	Very high	138 Å²	138	62.7 Å²	62.7	52%	0.521	30%	0.301	S	S	.	.			trans	-94.6	65	179.7	-74	-161.5	73.9	158.9	6.6	111.1	S17 A20 E24 E25 M26	S17-R22 WeakPolarHBondContact CB-O 3.22Å; S17-R22 PolarHBondContact O-N 2.8Å; A20-R22 HydrophobicContact CB-CG 4.09Å; A20-R22 PolarHBondContact O-N 2.74Å; A20-R22 VanDerWaalsContact O-N 3.16Å; R22-E24 VanDerWaalsContact C-N 3.32Å; R22-E24 PolarHBondContact O-N 3.31Å; R22-E25 HydrophobicContact CB-CB 4.46Å; R22-E25 WeakPolarHBondContact CB-OE2 3.21Å; R22-E25 IonicContact CZ-OE1 2.7Å; R22-E25 IonicContact CZ-OE2 3.7Å; R22-E25 VanDerWaalsContact NE-CD 3.31Å; R22-E25 IonicContact NE-OE1 3.1Å; R22-E25 IonicContact NE-OE2 2.87Å; R22-E25 PolarHBondContact NE-OE2 3.35Å; R22-E25 VanDerWaalsContact NH2-CD 3.27Å; R22-E25 IonicContact NH2-OE1 2.83Å; R22-E25 PolarHBondContact NH2-OE1 2.97Å; R22-E25 IonicContact NH2-OE2 2.75Å; R22-E25 PolarHBondContact O-N 3.5Å; R22-M26 PolarHBondContact O-N 3.07Å
23	Y	97.8	Very high	98.1	Very high	54 Å²	54	55.9 Å²	55.9	21%	0.212	27%	0.274	C	S	.	.	H	α-helix	trans	-66.5	-28.2	-169	-57.3	-69.1	0	0	0	114.6	E21 M26 V27 V50 N54	E21-Y23 HydrophobicContact CB-CE2 3.9Å; E21-Y23 WeakPolarHBondContact O-CD2 3.46Å; E21-Y23 PolarHBondContact O-N 3.28Å; Y23-M26 HydrophobicContact CD1-SD 4.04Å; Y23-M26 WeakPolarHBondContact O-CB 3.34Å; Y23-M26 PolarHBondContact O-N 3.48Å; Y23-V27 WeakPolarHBondContact O-CG2 3.4Å; Y23-V27 PolarHBondContact O-N 3.31Å; Y23-V50 HydrophobicContact CE1-CG1 4.2Å; Y23-N54 HydrophobicContact CD1-CB 3.57Å; Y23-N54 HydrophobicContact CD2-CB 3.39Å; Y23-N54 HydrophobicContact CE1-CB 3.86Å; Y23-N54 VanDerWaalsContact CE1-CG 3.49Å; Y23-N54 VanDerWaalsContact CE1-ND2 3.35Å; Y23-N54 WeakPolarHBondContact CE1-ND2 3.37Å; Y23-N54 HydrophobicContact CE2-CB 3.67Å; Y23-N54 HydrophobicContact CG-CB 3.31Å
24	E	97.6	Very high	98.1	Very high	84 Å²	84	52.5 Å²	52.5	39%	0.393	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-44.7	174.1	-59.7	-73.3	-177.8	0	0	110.6	R22 M26 V27 E28 V55 R59	R22-E24 VanDerWaalsContact C-N 3.32Å; R22-E24 PolarHBondContact O-N 3.31Å; E24-M26 VanDerWaalsContact C-N 3.33Å; E24-M26 PolarHBondContact O-N 2.98Å; E24-V27 PolarHBondContact O-N 3.42Å; E24-E28 PolarHBondContact O-N 3.14Å; E24-E28 VanDerWaalsContact O-N 3.07Å; E24-V55 HydrophobicContact CG-CG2 4.19Å; E24-V55 WeakPolarHBondContact OE1-CG1 3.46Å; E24-R59 IonicContact OE1-CZ 3.48Å; E24-R59 IonicContact OE1-NH1 3.36Å; E24-R59 PolarHBondContact OE1-NH1 3.04Å; E24-R59 VanDerWaalsContact OE1-NH1 3.1Å; E24-R59 IonicContact OE1-NH2 3.71Å; E24-R59 PolarHBondContact OE1-NH2 3.3Å
25	E	98.2	Very high	98	Very high	72 Å²	72	57.9 Å²	57.9	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-69.3	-31	174.9	-70	79.8	-173.2	0	0	113	R22 E28 S29	R22-E25 HydrophobicContact CB-CB 4.46Å; R22-E25 WeakPolarHBondContact CB-OE2 3.21Å; R22-E25 IonicContact CZ-OE1 2.7Å; R22-E25 IonicContact CZ-OE2 3.7Å; R22-E25 VanDerWaalsContact NE-CD 3.31Å; R22-E25 IonicContact NE-OE1 3.1Å; R22-E25 IonicContact NE-OE2 2.87Å; R22-E25 PolarHBondContact NE-OE2 3.35Å; R22-E25 VanDerWaalsContact NH2-CD 3.27Å; R22-E25 IonicContact NH2-OE1 2.83Å; R22-E25 PolarHBondContact NH2-OE1 2.97Å; R22-E25 IonicContact NH2-OE2 2.75Å; R22-E25 PolarHBondContact O-N 3.5Å; E25-E28 PolarHBondContact O-N 3.21Å; E25-S29 WeakPolarHBondContact O-CB 3.31Å; E25-S29 PolarHBondContact O-N 3.14Å; E25-S29 PolarHBondContact O-OG 3.22Å
26	M	98.1	Very high	97.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-46.9	171.6	-170.6	-175.1	-170.8	0	0	110.7	A14 E18 R22 Y23 E24 S29 M30 L47 V50 G51	A14-M26 HydrophobicContact CB-CG 4.18Å; E18-M26 HydrophobicContact CB-CE 3.83Å; E18-M26 HydrophobicContact CB-SD 4.03Å; E18-M26 HydrophobicContact CG-CE 4.08Å; E18-M26 HydrophobicContact CG-SD 4.48Å; R22-M26 PolarHBondContact O-N 3.07Å; Y23-M26 HydrophobicContact CD1-SD 4.04Å; Y23-M26 WeakPolarHBondContact O-CB 3.34Å; Y23-M26 PolarHBondContact O-N 3.48Å; E24-M26 VanDerWaalsContact C-N 3.33Å; E24-M26 PolarHBondContact O-N 2.98Å; M26-S29 PolarHBondContact O-N 3.44Å; M26-M30 WeakPolarHBondContact O-CG 3.39Å; M26-M30 PolarHBondContact O-N 3.16Å; M26-L47 HydrophobicContact CE-CB 3.83Å; M26-L47 HydrophobicContact CE-CD2 3.38Å; M26-L47 HydrophobicContact CE-CG 4.22Å; M26-L47 WeakPolarHBondContact CE-O 3.4Å; M26-V50 HydrophobicContact CE-CB 4.04Å; M26-V50 HydrophobicContact CE-CG1 4.01Å; M26-V50 HydrophobicContact SD-CG1 4.15Å; M26-G51 VanDerWaalsContact SD-CA 3.54Å
27	V	98.4	Very high	97.8	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.024	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-48.5	175.8	164.2	0	0	0	0	111	Y23 E24 S29 M30 K31 G51 Y52 V55	Y23-V27 WeakPolarHBondContact O-CG2 3.4Å; Y23-V27 PolarHBondContact O-N 3.31Å; E24-V27 PolarHBondContact O-N 3.42Å; V27-S29 VanDerWaalsContact C-N 3.31Å; V27-S29 PolarHBondContact O-N 3.43Å; V27-M30 PolarHBondContact O-N 3.44Å; V27-M30 VanDerWaalsContact O-N 3.15Å; V27-K31 HydrophobicContact CG1-CD 3.6Å; V27-K31 HydrophobicContact CG1-CG 4.21Å; V27-K31 WeakPolarHBondContact O-CB 3.35Å; V27-K31 VanDerWaalsContact O-CG 3.24Å; V27-K31 WeakPolarHBondContact O-CG 3.37Å; V27-K31 PolarHBondContact O-N 3.14Å; V27-G51 VanDerWaalsContact CG2-C 3.46Å; V27-Y52 HydrophobicContact CB-CE2 4.45Å; V27-Y52 HydrophobicContact CG1-CD1 4.25Å; V27-Y52 HydrophobicContact CG1-CD2 4.23Å; V27-Y52 HydrophobicContact CG1-CE1 3.7Å; V27-Y52 HydrophobicContact CG1-CE2 3.67Å; V27-Y52 HydrophobicContact CG1-CG 4.49Å; V27-Y52 HydrophobicContact CG2-CD1 4.07Å; V27-Y52 HydrophobicContact CG2-CD2 3.88Å; V27-Y52 HydrophobicContact CG2-CE1 4.36Å; V27-Y52 HydrophobicContact CG2-CE2 4.19Å; V27-Y52 HydrophobicContact CG2-CG 3.83Å; V27-V55 HydrophobicContact CG2-CG2 4.19Å
28	E	98.4	Very high	97.6	Very high	101 Å²	101	59.9 Å²	59.9	47%	0.472	29%	0.293	S	S	.	.	H	α-helix	trans	-61.9	-37.7	179.5	-70.7	-58.1	122.1	0	0	113.1	E24 E25 K31 S32	E24-E28 PolarHBondContact O-N 3.14Å; E24-E28 VanDerWaalsContact O-N 3.07Å; E25-E28 PolarHBondContact O-N 3.21Å; E28-K31 WeakPolarHBondContact OE1-CD 3.43Å; E28-K31 IonicContact OE1-NZ 2.62Å; E28-K31 PolarHBondContact OE1-NZ 3.03Å; E28-S32 PolarHBondContact O-N 2.73Å; E28-S32 PolarHBondContact O-OG 3.07Å
29	S	98.4	Very high	97.6	Very high	13 Å²	13	59 Å²	59	9%	0.091	29%	0.291	C	S	.	.	H	α-helix	trans	-64.3	-46.9	173.7	-57.3	0	0	0	0	111	E25 M26 V27 K31 S32 V33	E25-S29 WeakPolarHBondContact O-CB 3.31Å; E25-S29 PolarHBondContact O-N 3.14Å; E25-S29 PolarHBondContact O-OG 3.22Å; M26-S29 PolarHBondContact O-N 3.44Å; V27-S29 VanDerWaalsContact C-N 3.31Å; V27-S29 PolarHBondContact O-N 3.43Å; S29-K31 PolarHBondContact O-N 3.15Å; S29-S32 VanDerWaalsContact O-CB 3.3Å; S29-S32 WeakPolarHBondContact O-CB 3.44Å; S29-S32 PolarHBondContact O-N 3.06Å; S29-S32 VanDerWaalsContact O-N 3.1Å; S29-V33 PolarHBondContact O-N 2.9Å; S29-V33 VanDerWaalsContact O-N 3.15Å
30	M	98.4	Very high	97.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-71.3	-29.4	-179.1	-68.1	-51.6	-52.9	0	0	113.6	A14 M26 V27 S32 V33 A34 E44 L47 L48	A14-M30 HydrophobicContact CB-CG 3.84Å; A14-M30 HydrophobicContact CB-SD 3.57Å; A14-M30 VanDerWaalsContact CB-SD 3.57Å; M26-M30 WeakPolarHBondContact O-CG 3.39Å; M26-M30 PolarHBondContact O-N 3.16Å; V27-M30 PolarHBondContact O-N 3.44Å; V27-M30 VanDerWaalsContact O-N 3.15Å; M30-S32 VanDerWaalsContact C-N 3.27Å; M30-S32 PolarHBondContact O-N 3.41Å; M30-V33 HydrophobicContact CE-CB 4.14Å; M30-V33 HydrophobicContact CE-CG1 4.31Å; M30-V33 HydrophobicContact CE-CG2 4.26Å; M30-V33 WeakPolarHBondContact O-CB 3.39Å; M30-V33 PolarHBondContact O-N 3.33Å; M30-V33 HydrophobicContact SD-CG2 4.27Å; M30-A34 PolarHBondContact O-N 2.86Å; M30-E44 HydrophobicContact CE-CB 3.98Å; M30-E44 HydrophobicContact CE-CG 4.5Å; M30-E44 WeakPolarHBondContact CE-O 3.39Å; M30-L47 HydrophobicContact CE-CB 4.25Å; M30-L47 HydrophobicContact CG-CB 4.16Å; M30-L47 HydrophobicContact SD-CB 3.81Å; M30-L47 HydrophobicContact SD-CD1 4.28Å; M30-L48 HydrophobicContact CB-CB 4.24Å; M30-L48 HydrophobicContact CB-CD1 3.66Å; M30-L48 HydrophobicContact CE-CB 4.23Å; M30-L48 HydrophobicContact CG-CB 4.48Å
31	K	98.4	Very high	97.5	Very high	19 Å²	19	52 Å²	52	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-37.1	168.2	-73.2	166.1	74.1	170.7	0	111.6	V27 E28 S29 V33 A34 K35 Y52 D102 V106	V27-K31 HydrophobicContact CG1-CD 3.6Å; V27-K31 HydrophobicContact CG1-CG 4.21Å; V27-K31 WeakPolarHBondContact O-CB 3.35Å; V27-K31 VanDerWaalsContact O-CG 3.24Å; V27-K31 WeakPolarHBondContact O-CG 3.37Å; V27-K31 PolarHBondContact O-N 3.14Å; E28-K31 WeakPolarHBondContact OE1-CD 3.43Å; E28-K31 IonicContact OE1-NZ 2.62Å; E28-K31 PolarHBondContact OE1-NZ 3.03Å; S29-K31 PolarHBondContact O-N 3.15Å; K31-V33 VanDerWaalsContact C-N 3.33Å; K31-A34 PolarHBondContact O-N 2.87Å; K31-K35 WeakPolarHBondContact O-CB 3.45Å; K31-K35 VanDerWaalsContact O-CG 3.25Å; K31-K35 WeakPolarHBondContact O-CG 3.31Å; K31-K35 PolarHBondContact O-N 2.93Å; K31-Y52 WeakPolarHBondContact CD-OH 3.33Å; K31-Y52 HydrophobicContact CG-CE2 4.47Å; K31-Y52 WeakPolarHBondContact CG-OH 3.11Å; K31-D102 WeakPolarHBondContact CE-OD1 3.37Å; K31-D102 WeakPolarHBondContact CE-OD2 3.38Å; K31-D102 IonicContact NZ-OD1 2.74Å; K31-D102 PolarHBondContact NZ-OD1 3.29Å; K31-D102 IonicContact NZ-OD2 2.74Å; K31-D102 PolarHBondContact NZ-OD2 2.96Å; K31-V106 HydrophobicContact CG-CG2 3.93Å
32	S	98.2	Very high	97.3	Very high	35 Å²	35	48.8 Å²	48.8	25%	0.245	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-36.4	176.3	-56.1	0	0	0	0	111.4	E28 S29 M30	E28-S32 PolarHBondContact O-N 2.73Å; E28-S32 PolarHBondContact O-OG 3.07Å; S29-S32 VanDerWaalsContact O-CB 3.3Å; S29-S32 WeakPolarHBondContact O-CB 3.44Å; S29-S32 PolarHBondContact O-N 3.06Å; S29-S32 VanDerWaalsContact O-N 3.1Å; M30-S32 VanDerWaalsContact C-N 3.27Å; M30-S32 PolarHBondContact O-N 3.41Å
33	V	98.1	Very high	97.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-47.5	170.3	179.9	0	0	0	0	111.4	R7 F10 V11 S29 M30 K31 K35 L36 L40	R7-V33 HydrophobicContact CG-CG1 4.21Å; F10-V33 HydrophobicContact CB-CG2 3.51Å; F10-V33 HydrophobicContact CG-CG2 4.49Å; V11-V33 HydrophobicContact CG2-CG2 3.88Å; S29-V33 PolarHBondContact O-N 2.9Å; S29-V33 VanDerWaalsContact O-N 3.15Å; M30-V33 HydrophobicContact CE-CB 4.14Å; M30-V33 HydrophobicContact CE-CG1 4.31Å; M30-V33 HydrophobicContact CE-CG2 4.26Å; M30-V33 WeakPolarHBondContact O-CB 3.39Å; M30-V33 PolarHBondContact O-N 3.33Å; M30-V33 HydrophobicContact SD-CG2 4.27Å; K31-V33 VanDerWaalsContact C-N 3.33Å; V33-K35 VanDerWaalsContact C-N 3.31Å; V33-K35 PolarHBondContact O-N 3.07Å; V33-L36 VanDerWaalsContact O-CB 3.28Å; V33-L36 WeakPolarHBondContact O-CB 3.47Å; V33-L36 WeakPolarHBondContact O-CG 3.43Å; V33-L36 PolarHBondContact O-N 3.14Å; V33-L40 HydrophobicContact CG1-CD2 3.65Å
34	A	97.7	Very high	97.2	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-43.9	179.9	0	0	0	0	0	112	M30 K31 L36 N37 V106 H110 L111	M30-A34 PolarHBondContact O-N 2.86Å; K31-A34 PolarHBondContact O-N 2.87Å; A34-L36 PolarHBondContact O-N 3.31Å; A34-N37 PolarHBondContact O-N 2.74Å; A34-V106 HydrophobicContact CB-CG1 3.58Å; A34-H110 HydrophobicContact CB-CB 4.43Å; A34-H110 WeakPolarHBondContact O-CB 3.31Å; A34-L111 HydrophobicContact CB-CD1 4.24Å; A34-L111 HydrophobicContact CB-CD2 3.59Å; A34-L111 HydrophobicContact CB-CG 3.91Å
35	K	97.2	Very high	97.2	Very high	112 Å²	112	41.7 Å²	41.7	49%	0.487	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-11.2	178.4	-74.9	169	-177.2	178.3	0	114.8	K31 V33 N37	K31-K35 WeakPolarHBondContact O-CB 3.45Å; K31-K35 VanDerWaalsContact O-CG 3.25Å; K31-K35 WeakPolarHBondContact O-CG 3.31Å; K31-K35 PolarHBondContact O-N 2.93Å; V33-K35 VanDerWaalsContact C-N 3.31Å; V33-K35 PolarHBondContact O-N 3.07Å; K35-N37 PolarHBondContact O-N 2.71Å; K35-N37 PolarHBondContact O-ND2 2.83Å
36	L	96.9	Very high	97.1	Very high	51 Å²	51	42.2 Å²	42.2	27%	0.267	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-7.3	172.2	-58.1	177.9	0	0	0	112.8	R7 V33 A34 V38	R7-L36 HydrophobicContact CB-CD1 3.6Å; R7-L36 HydrophobicContact CG-CD1 4.07Å; V33-L36 VanDerWaalsContact O-CB 3.28Å; V33-L36 WeakPolarHBondContact O-CB 3.47Å; V33-L36 WeakPolarHBondContact O-CG 3.43Å; V33-L36 PolarHBondContact O-N 3.14Å; A34-L36 PolarHBondContact O-N 3.31Å; L36-V38 VanDerWaalsContact C-N 3.32Å; L36-V38 HydrophobicContact CB-CG2 4.07Å; L36-V38 PolarHBondContact O-N 2.83Å
37	N	96.1	Very high	97.1	Very high	86 Å²	86	42.6 Å²	42.6	46%	0.46	22%	0.224	S	C	.	.			trans	52.4	49.6	178.8	-56.6	-63.3	0	0	0	112.2	A34 K35 H110 S114	A34-N37 PolarHBondContact O-N 2.74Å; K35-N37 PolarHBondContact O-N 2.71Å; K35-N37 PolarHBondContact O-ND2 2.83Å; N37-H110 PolarHBondContact OD1-ND1 2.71Å; N37-S114 VanDerWaalsContact CA-OG 3.23Å; N37-S114 WeakPolarHBondContact CA-OG 3.45Å; N37-S114 PolarHBondContact O-OG 2.86Å
38	V	94.7	Very high	97.1	Very high	48 Å²	48	42.4 Å²	42.4	29%	0.291	22%	0.223	S	C	.	.			trans	-123.2	148.5	177.6	-67.3	0	0	0	0	108.9	L36 L40	L36-V38 VanDerWaalsContact C-N 3.32Å; L36-V38 HydrophobicContact CB-CG2 4.07Å; L36-V38 PolarHBondContact O-N 2.83Å; V38-L40 PolarHBondContact O-N 3.31Å
39	D	96	Very high	97.1	Very high	55 Å²	55	39.3 Å²	39.3	29%	0.294	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-61.7	130.5	170.2	-165.9	19.7	0	0	0	109.6	R7 S114 S116 S120	R7-D39 PolarHBondContact NH2-O 3.27Å; D39-S114 WeakPolarHBondContact CB-O 3.21Å; D39-S116 WeakPolarHBondContact OD2-CB 3.34Å; D39-S116 PolarHBondContact OD2-N 3Å; D39-S116 PolarHBondContact OD2-OG 3.22Å; D39-S120 VanDerWaalsContact OD1-CB 3.28Å; D39-S120 WeakPolarHBondContact OD1-CB 3.44Å; D39-S120 PolarHBondContact OD1-OG 3.36Å
40	L	97.1	Very high	97	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-80.5	143.4	-178.4	-63.1	-165.8	0	0	0	110	V33 V38 E44 R45 L48 L111 F124	V33-L40 HydrophobicContact CG1-CD2 3.65Å; V38-L40 PolarHBondContact O-N 3.31Å; L40-E44 WeakPolarHBondContact CA-OE2 3.46Å; L40-E44 HydrophobicContact CB-CB 4.02Å; L40-E44 HydrophobicContact CD1-CB 4.39Å; L40-E44 HydrophobicContact CD2-CB 4.43Å; L40-R45 HydrophobicContact CB-CG 3.6Å; L40-R45 HydrophobicContact CD1-CG 4.33Å; L40-R45 PolarHBondContact O-NH1 2.91Å; L40-L48 HydrophobicContact CD1-CD2 4.29Å; L40-L111 HydrophobicContact CD1-CD2 3.62Å; L40-L111 HydrophobicContact CD2-CD2 4.26Å; L40-L111 HydrophobicContact CG-CD2 3.77Å; L40-F124 HydrophobicContact CB-CZ 4.2Å; L40-F124 HydrophobicContact CD1-CE1 4.31Å; L40-F124 HydrophobicContact CD1-CZ 3.98Å; L40-F124 HydrophobicContact CG-CZ 4.08Å
41	T	96.1	Very high	97	Very high	68 Å²	68	40.8 Å²	40.8	42%	0.417	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-70.1	166.6	169.8	70.6	0	0	0	0	110.5	E43 E44 R45	T41-E43 VanDerWaalsContact C-N 3.28Å; T41-E43 PolarHBondContact O-N 3.36Å; T41-E44 PolarHBondContact N-OE2 3.38Å; T41-E44 PolarHBondContact O-N 3.02Å; T41-E44 WeakPolarHBondContact OG1-CG 3.36Å; T41-E44 PolarHBondContact OG1-N 3.4Å; T41-E44 PolarHBondContact OG1-OE2 2.97Å; T41-R45 WeakPolarHBondContact O-CG 3.47Å; T41-R45 PolarHBondContact O-N 2.96Å
42	V	94.2	Very high	97	Very high	81 Å²	81	40 Å²	40	49%	0.491	22%	0.217	S	C	.	.	H	α-helix	trans	-54.1	-46.7	174.7	178.5	0	0	0	0	111	E44 R45 N46	V42-E44 PolarHBondContact O-N 3.17Å; V42-R45 PolarHBondContact O-N 3.21Å; V42-N46 WeakPolarHBondContact O-CB 3.48Å; V42-N46 PolarHBondContact O-N 2.68Å; V42-N46 PolarHBondContact O-OD1 3.48Å
43	E	96.3	Very high	96.9	Very high	101 Å²	101	40.9 Å²	40.9	47%	0.472	22%	0.217	S	C	.	.	H	α-helix	trans	-60.4	-44.1	179.1	-175	178.3	-140.3	0	0	111.9	K15 T41 N46 L47	K15-E43 WeakPolarHBondContact CE-OE1 3.48Å; K15-E43 IonicContact NZ-OE1 3.67Å; K15-E43 PolarHBondContact NZ-OE1 3.01Å; K15-E43 IonicContact NZ-OE2 3.41Å; K15-E43 PolarHBondContact NZ-OE2 2.8Å; T41-E43 VanDerWaalsContact C-N 3.28Å; T41-E43 PolarHBondContact O-N 3.36Å; E43-N46 PolarHBondContact O-N 2.54Å; E43-L47 HydrophobicContact CG-CD1 4.32Å; E43-L47 WeakPolarHBondContact O-CG 3.44Å; E43-L47 PolarHBondContact O-N 3.32Å
44	E	97.7	Very high	96.8	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.056	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-38.3	-179.9	-69.8	167.8	161.7	0	0	112.8	R7 V11 M30 L40 T41 V42 N46 L47 L48	R7-E44 IonicContact CZ-OE1 2.64Å; R7-E44 IonicContact CZ-OE2 3.69Å; R7-E44 IonicContact NE-OE1 3.5Å; R7-E44 PolarHBondContact NE-OE1 3.39Å; R7-E44 IonicContact NE-OE2 2.89Å; R7-E44 IonicContact NH2-OE1 2.8Å; R7-E44 PolarHBondContact NH2-OE1 3.24Å; R7-E44 IonicContact NH2-OE2 3.06Å; R7-E44 PolarHBondContact NH2-OE2 3.37Å; V11-E44 HydrophobicContact CG2-CG 3.81Å; M30-E44 HydrophobicContact CE-CB 3.98Å; M30-E44 HydrophobicContact CE-CG 4.5Å; M30-E44 WeakPolarHBondContact CE-O 3.39Å; L40-E44 WeakPolarHBondContact CA-OE2 3.46Å; L40-E44 HydrophobicContact CB-CB 4.02Å; L40-E44 HydrophobicContact CD1-CB 4.39Å; L40-E44 HydrophobicContact CD2-CB 4.43Å; T41-E44 PolarHBondContact N-OE2 3.38Å; T41-E44 PolarHBondContact O-N 3.02Å; T41-E44 WeakPolarHBondContact OG1-CG 3.36Å; T41-E44 PolarHBondContact OG1-N 3.4Å; T41-E44 PolarHBondContact OG1-OE2 2.97Å; V42-E44 PolarHBondContact O-N 3.17Å; E44-N46 VanDerWaalsContact C-N 3.28Å; E44-N46 PolarHBondContact O-N 2.76Å; E44-L47 PolarHBondContact O-N 3.45Å; E44-L48 WeakPolarHBondContact O-CB 3.34Å; E44-L48 PolarHBondContact O-N 3.43Å
45	R	97.4	Very high	96.7	Very high	13 Å²	13	44 Å²	44	5%	0.049	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-42.5	172.6	-71.6	-167.6	-57.3	-103.8	14.5	110.8	L40 T41 V42 L48 S49 E119 S120 F123 F124	L40-R45 HydrophobicContact CB-CG 3.6Å; L40-R45 HydrophobicContact CD1-CG 4.33Å; L40-R45 PolarHBondContact O-NH1 2.91Å; T41-R45 WeakPolarHBondContact O-CG 3.47Å; T41-R45 PolarHBondContact O-N 2.96Å; V42-R45 PolarHBondContact O-N 3.21Å; R45-L48 PolarHBondContact O-N 3.16Å; R45-S49 WeakPolarHBondContact O-CB 3.13Å; R45-S49 PolarHBondContact O-N 3.17Å; R45-E119 IonicContact NH2-OE2 3.01Å; R45-E119 PolarHBondContact NH2-OE2 3.11Å; R45-S120 PolarHBondContact NH1-OG 2.69Å; R45-F123 HydrophobicContact CB-CD1 4.14Å; R45-F123 HydrophobicContact CB-CE1 3.74Å; R45-F123 HydrophobicContact CB-CE2 4.31Å; R45-F123 HydrophobicContact CB-CZ 3.81Å; R45-F123 HydrophobicContact CG-CD1 4.29Å; R45-F123 HydrophobicContact CG-CE1 4.3Å; R45-F123 WeakPolarHBondContact O-CZ 3.28Å; R45-F124 HydrophobicContact CG-CE1 4.06Å; R45-F124 HydrophobicContact CG-CZ 3.78Å
46	N	95.8	Very high	96.7	Very high	83 Å²	83	38.7 Å²	38.7	44%	0.444	21%	0.211	S	C	.	.	H	α-helix	trans	-64.1	-46.6	177.3	-69.6	-5.9	0	0	0	111.3	V42 E43 E44 L48 S49 V50	V42-N46 WeakPolarHBondContact O-CB 3.48Å; V42-N46 PolarHBondContact O-N 2.68Å; V42-N46 PolarHBondContact O-OD1 3.48Å; E43-N46 PolarHBondContact O-N 2.54Å; E44-N46 VanDerWaalsContact C-N 3.28Å; E44-N46 PolarHBondContact O-N 2.76Å; N46-L48 PolarHBondContact O-N 3.38Å; N46-S49 PolarHBondContact O-N 3.43Å; N46-S49 VanDerWaalsContact O-N 3.17Å; N46-V50 WeakPolarHBondContact O-CB 3.41Å; N46-V50 WeakPolarHBondContact O-CG2 3.35Å; N46-V50 PolarHBondContact O-N 2.99Å
47	L	98.3	Very high	96.6	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-47	175.9	-71.3	169.4	0	0	0	112	V11 A14 K15 E18 M26 M30 E43 E44 S49 V50 G51	V11-L47 HydrophobicContact CG1-CD1 4.02Å; A14-L47 HydrophobicContact CB-CD1 4.43Å; K15-L47 HydrophobicContact CG-CD1 3.97Å; K15-L47 HydrophobicContact CG-CD2 4.04Å; E18-L47 WeakPolarHBondContact OE2-CD2 3.41Å; M26-L47 HydrophobicContact CE-CB 3.83Å; M26-L47 HydrophobicContact CE-CD2 3.38Å; M26-L47 HydrophobicContact CE-CG 4.22Å; M26-L47 WeakPolarHBondContact CE-O 3.4Å; M30-L47 HydrophobicContact CE-CB 4.25Å; M30-L47 HydrophobicContact CG-CB 4.16Å; M30-L47 HydrophobicContact SD-CB 3.81Å; M30-L47 HydrophobicContact SD-CD1 4.28Å; E43-L47 HydrophobicContact CG-CD1 4.32Å; E43-L47 WeakPolarHBondContact O-CG 3.44Å; E43-L47 PolarHBondContact O-N 3.32Å; E44-L47 PolarHBondContact O-N 3.45Å; L47-S49 VanDerWaalsContact C-N 3.31Å; L47-S49 PolarHBondContact O-N 2.97Å; L47-V50 PolarHBondContact O-N 3.36Å; L47-G51 PolarHBondContact O-N 2.92Å
48	L	98.3	Very high	96.5	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-46.6	176.2	179.7	75.1	0	0	0	111	M30 L40 E44 R45 N46 Y52 L111 F124	M30-L48 HydrophobicContact CB-CB 4.24Å; M30-L48 HydrophobicContact CB-CD1 3.66Å; M30-L48 HydrophobicContact CE-CB 4.23Å; M30-L48 HydrophobicContact CG-CB 4.48Å; L40-L48 HydrophobicContact CD1-CD2 4.29Å; E44-L48 WeakPolarHBondContact O-CB 3.34Å; E44-L48 PolarHBondContact O-N 3.43Å; R45-L48 PolarHBondContact O-N 3.16Å; N46-L48 PolarHBondContact O-N 3.38Å; L48-Y52 HydrophobicContact CD1-CD2 3.77Å; L48-Y52 HydrophobicContact CD1-CE2 3.65Å; L48-Y52 HydrophobicContact CG-CD2 4.21Å; L48-Y52 PolarHBondContact O-N 3.2Å; L48-Y52 VanDerWaalsContact O-N 3.16Å; L48-L111 HydrophobicContact CD2-CD1 3.34Å; L48-F124 HydrophobicContact CD2-CE1 4.23Å
49	S	97.3	Very high	96.6	Very high	36 Å²	36	37 Å²	37	25%	0.252	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-47.6	179.9	-169.4	0	0	0	0	112.2	R45 N46 L47 G51 Y52 K53	R45-S49 WeakPolarHBondContact O-CB 3.13Å; R45-S49 PolarHBondContact O-N 3.17Å; N46-S49 PolarHBondContact O-N 3.43Å; N46-S49 VanDerWaalsContact O-N 3.17Å; L47-S49 VanDerWaalsContact C-N 3.31Å; L47-S49 PolarHBondContact O-N 2.97Å; S49-G51 VanDerWaalsContact C-N 3.34Å; S49-G51 PolarHBondContact O-N 2.85Å; S49-Y52 PolarHBondContact O-N 3.34Å; S49-K53 WeakPolarHBondContact O-CB 3.21Å; S49-K53 PolarHBondContact O-N 3.41Å
50	V	97	Very high	96.6	Very high	42 Å²	42	35 Å²	35	26%	0.255	20%	0.195	S	C	.	.	H	α-helix	trans	-59.9	-44.4	179.3	168.4	0	0	0	0	111.1	Y23 M26 N46 L47 N54	Y23-V50 HydrophobicContact CE1-CG1 4.2Å; M26-V50 HydrophobicContact CE-CB 4.04Å; M26-V50 HydrophobicContact CE-CG1 4.01Å; M26-V50 HydrophobicContact SD-CG1 4.15Å; N46-V50 WeakPolarHBondContact O-CB 3.41Å; N46-V50 WeakPolarHBondContact O-CG2 3.35Å; N46-V50 PolarHBondContact O-N 2.99Å; L47-V50 PolarHBondContact O-N 3.36Å; V50-N54 PolarHBondContact O-N 2.83Å; V50-N54 VanDerWaalsContact O-N 3.08Å; V50-N54 PolarHBondContact O-ND2 3.43Å
51	G	98.2	Very high	96.6	Very high	1 Å²	1	37 Å²	37	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-58.7	-58.1	178	0	0	0	0	0	111.9	M26 V27 L47 S49 K53 N54 V55	M26-G51 VanDerWaalsContact SD-CA 3.54Å; V27-G51 VanDerWaalsContact CG2-C 3.46Å; L47-G51 PolarHBondContact O-N 2.92Å; S49-G51 VanDerWaalsContact C-N 3.34Å; S49-G51 PolarHBondContact O-N 2.85Å; G51-K53 VanDerWaalsContact C-N 3.34Å; G51-K53 PolarHBondContact O-N 3.03Å; G51-N54 PolarHBondContact O-N 3.17Å; G51-V55 WeakPolarHBondContact O-CG2 3.33Å; G51-V55 PolarHBondContact O-N 2.86Å; G51-V55 VanDerWaalsContact O-N 3.14Å
52	Y	98.3	Very high	96.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-33.3	-178.1	-87.2	-75	0	0	0	113.1	V27 K31 L48 S49 I56 I99 D102 I103 Y131	V27-Y52 HydrophobicContact CB-CE2 4.45Å; V27-Y52 HydrophobicContact CG1-CD1 4.25Å; V27-Y52 HydrophobicContact CG1-CD2 4.23Å; V27-Y52 HydrophobicContact CG1-CE1 3.7Å; V27-Y52 HydrophobicContact CG1-CE2 3.67Å; V27-Y52 HydrophobicContact CG1-CG 4.49Å; V27-Y52 HydrophobicContact CG2-CD1 4.07Å; V27-Y52 HydrophobicContact CG2-CD2 3.88Å; V27-Y52 HydrophobicContact CG2-CE1 4.36Å; V27-Y52 HydrophobicContact CG2-CE2 4.19Å; V27-Y52 HydrophobicContact CG2-CG 3.83Å; K31-Y52 WeakPolarHBondContact CD-OH 3.33Å; K31-Y52 HydrophobicContact CG-CE2 4.47Å; K31-Y52 WeakPolarHBondContact CG-OH 3.11Å; L48-Y52 HydrophobicContact CD1-CD2 3.77Å; L48-Y52 HydrophobicContact CD1-CE2 3.65Å; L48-Y52 HydrophobicContact CG-CD2 4.21Å; L48-Y52 PolarHBondContact O-N 3.2Å; L48-Y52 VanDerWaalsContact O-N 3.16Å; S49-Y52 PolarHBondContact O-N 3.34Å; Y52-I56 WeakPolarHBondContact O-CB 3.34Å; Y52-I56 VanDerWaalsContact O-CG2 3.27Å; Y52-I56 WeakPolarHBondContact O-CG2 3.08Å; Y52-I56 PolarHBondContact O-N 2.62Å; Y52-I99 HydrophobicContact CD1-CG2 4.23Å; Y52-D102 WeakPolarHBondContact CE1-OD2 3.5Å; Y52-D102 PolarHBondContact OH-OD2 3.41Å; Y52-I103 HydrophobicContact CD1-CB 3.9Å; Y52-I103 HydrophobicContact CD1-CG2 4.49Å; Y52-I103 HydrophobicContact CD2-CD1 3.8Å; Y52-I103 HydrophobicContact CD2-CG1 4.42Å; Y52-I103 HydrophobicContact CE1-CB 3.66Å; Y52-I103 HydrophobicContact CE1-CG2 4.48Å; Y52-I103 HydrophobicContact CE2-CB 4.29Å; Y52-I103 HydrophobicContact CE2-CD1 3.62Å; Y52-I103 HydrophobicContact CE2-CG1 4.41Å; Y52-I103 HydrophobicContact CG-CB 4.32Å; Y52-I103 HydrophobicContact CG-CD1 4.33Å; Y52-I103 HydrophobicContact CG-CG1 4.46Å; Y52-Y131 VanDerWaalsContact CB-OH 3.24Å; Y52-Y131 WeakPolarHBondContact CB-OH 3.24Å; Y52-Y131 PolarHBondContact O-OH 3.36Å
53	K	96.1	Very high	96.7	Very high	54 Å²	54	34 Å²	34	24%	0.235	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-46.5	176.4	176.3	178	172.4	172.5	0	111.6	S49 G51 G57 Y131 D260	S49-K53 WeakPolarHBondContact O-CB 3.21Å; S49-K53 PolarHBondContact O-N 3.41Å; G51-K53 VanDerWaalsContact C-N 3.34Å; G51-K53 PolarHBondContact O-N 3.03Å; K53-G57 WeakPolarHBondContact O-CA 3.48Å; K53-G57 PolarHBondContact O-N 2.92Å; K53-Y131 PolarHBondContact N-OH 3.39Å; K53-D260 WeakPolarHBondContact CE-O 3.37Å; K53-D260 VanDerWaalsContact NZ-C 3.33Å; K53-D260 PolarHBondContact NZ-O 3.13Å
54	N	95.8	Very high	96.6	Very high	60 Å²	60	33.5 Å²	33.5	32%	0.321	19%	0.186	S	C	.	.	H	α-helix	trans	-69	-42.1	178.9	-82.7	-79.3	0	0	0	112.4	Y23 V50 G51 I56 S58	Y23-N54 HydrophobicContact CD1-CB 3.57Å; Y23-N54 HydrophobicContact CD2-CB 3.39Å; Y23-N54 HydrophobicContact CE1-CB 3.86Å; Y23-N54 VanDerWaalsContact CE1-CG 3.49Å; Y23-N54 VanDerWaalsContact CE1-ND2 3.35Å; Y23-N54 WeakPolarHBondContact CE1-ND2 3.37Å; Y23-N54 HydrophobicContact CE2-CB 3.67Å; Y23-N54 HydrophobicContact CG-CB 3.31Å; V50-N54 PolarHBondContact O-N 2.83Å; V50-N54 VanDerWaalsContact O-N 3.08Å; V50-N54 PolarHBondContact O-ND2 3.43Å; G51-N54 PolarHBondContact O-N 3.17Å; N54-I56 PolarHBondContact O-N 2.93Å; N54-S58 PolarHBondContact O-N 3.19Å; N54-S58 PolarHBondContact O-OG 2.96Å
55	V	96.3	Very high	96.6	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.036	21%	0.207	C	C	.	.	H	α-helix	trans	-59.8	-48.4	177.3	169.5	0	0	0	0	110.8	E24 V27 G51 S58 R59 I99	E24-V55 HydrophobicContact CG-CG2 4.19Å; E24-V55 WeakPolarHBondContact OE1-CG1 3.46Å; V27-V55 HydrophobicContact CG2-CG2 4.19Å; G51-V55 WeakPolarHBondContact O-CG2 3.33Å; G51-V55 PolarHBondContact O-N 2.86Å; G51-V55 VanDerWaalsContact O-N 3.14Å; V55-S58 PolarHBondContact O-OG 3.16Å; V55-R59 WeakPolarHBondContact O-CD 3.35Å; V55-R59 PolarHBondContact O-NH1 2.97Å; V55-I99 HydrophobicContact CG1-CD1 3.68Å; V55-I99 HydrophobicContact CG1-CG1 3.88Å; V55-I99 HydrophobicContact CG1-CG2 4.22Å
56	I	97.3	Very high	96.6	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-77.4	-35.1	-178.6	-159.2	164	0	0	0	113.5	Y52 N54 S58 R59 R60 L96 I99 C100 Y131 Y134	Y52-I56 WeakPolarHBondContact O-CB 3.34Å; Y52-I56 VanDerWaalsContact O-CG2 3.27Å; Y52-I56 WeakPolarHBondContact O-CG2 3.08Å; Y52-I56 PolarHBondContact O-N 2.62Å; N54-I56 PolarHBondContact O-N 2.93Å; I56-S58 VanDerWaalsContact C-N 3.34Å; I56-S58 PolarHBondContact O-N 2.91Å; I56-R59 PolarHBondContact O-N 2.81Å; I56-R59 VanDerWaalsContact O-N 3.17Å; I56-R60 HydrophobicContact CG1-CG 4.15Å; I56-R60 PolarHBondContact O-N 2.89Å; I56-L96 HydrophobicContact CD1-CD2 4.33Å; I56-L96 HydrophobicContact CG1-CD2 3.7Å; I56-I99 HydrophobicContact CB-CG2 3.96Å; I56-I99 HydrophobicContact CD1-CG2 4.13Å; I56-I99 HydrophobicContact CG1-CG2 4.2Å; I56-C100 VanDerWaalsContact CD1-SG 3.59Å; I56-Y131 HydrophobicContact CB-CE1 4.07Å; I56-Y131 HydrophobicContact CD1-CD1 3.49Å; I56-Y131 VanDerWaalsContact CD1-CD1 3.49Å; I56-Y131 HydrophobicContact CD1-CE1 3.35Å; I56-Y131 HydrophobicContact CG1-CE1 4.3Å; I56-Y131 HydrophobicContact CG2-CE1 3.95Å; I56-Y134 HydrophobicContact CD1-CD2 3.62Å; I56-Y134 HydrophobicContact CD1-CE2 4.48Å; I56-Y134 HydrophobicContact CD1-CG 4.25Å; I56-Y134 HydrophobicContact CG2-CE2 4.39Å
57	G	95.5	Very high	96.5	Very high	28 Å²	28	36.2 Å²	36.2	29%	0.289	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-43.9	-176.5	0	0	0	0	0	112.4	K53 R59 R60 A61	K53-G57 WeakPolarHBondContact O-CA 3.48Å; K53-G57 PolarHBondContact O-N 2.92Å; G57-R59 VanDerWaalsContact C-N 3.34Å; G57-R59 PolarHBondContact O-N 3.29Å; G57-R60 PolarHBondContact O-N 2.89Å; G57-A61 WeakPolarHBondContact O-CB 3.44Å; G57-A61 PolarHBondContact O-N 3.29Å
58	S	93.4	Very high	96.4	Very high	57 Å²	57	38 Å²	38	40%	0.399	21%	0.214	S	C	.	.	H	α-helix	trans	-60.4	-40.1	176.6	60.5	0	0	0	0	113.2	N54 V55 I56 S62	N54-S58 PolarHBondContact O-N 3.19Å; N54-S58 PolarHBondContact O-OG 2.96Å; V55-S58 PolarHBondContact O-OG 3.16Å; I56-S58 VanDerWaalsContact C-N 3.34Å; I56-S58 PolarHBondContact O-N 2.91Å; S58-S62 PolarHBondContact O-N 3.41Å; S58-S62 VanDerWaalsContact O-N 3.1Å; S58-S62 PolarHBondContact O-OG 3.15Å
59	R	96.9	Very high	96.4	Very high	64 Å²	64	41 Å²	41	24%	0.242	23%	0.23	C	C	.	.	H	α-helix	trans	-73.2	-40.2	177.9	-83.3	62.4	174.2	-146.6	-2.6	111.4	E24 V55 I56 G57 A61 S62 W63 V92 E95 L96 I99	E24-R59 IonicContact OE1-CZ 3.48Å; E24-R59 IonicContact OE1-NH1 3.36Å; E24-R59 PolarHBondContact OE1-NH1 3.04Å; E24-R59 VanDerWaalsContact OE1-NH1 3.1Å; E24-R59 IonicContact OE1-NH2 3.71Å; E24-R59 PolarHBondContact OE1-NH2 3.3Å; V55-R59 WeakPolarHBondContact O-CD 3.35Å; V55-R59 PolarHBondContact O-NH1 2.97Å; I56-R59 PolarHBondContact O-N 2.81Å; I56-R59 VanDerWaalsContact O-N 3.17Å; G57-R59 VanDerWaalsContact C-N 3.34Å; G57-R59 PolarHBondContact O-N 3.29Å; R59-A61 PolarHBondContact O-N 3.06Å; R59-S62 WeakPolarHBondContact O-CB 3.45Å; R59-S62 PolarHBondContact O-N 2.92Å; R59-W63 PolarHBondContact O-N 2.96Å; R59-V92 HydrophobicContact CB-CG1 4.36Å; R59-V92 WeakPolarHBondContact O-CG1 3.44Å; R59-E95 HydrophobicContact CG-CB 4.09Å; R59-E95 WeakPolarHBondContact CG-OE2 3.49Å; R59-E95 IonicContact NE-OE2 2.8Å; R59-E95 PolarHBondContact NE-OE2 3.14Å; R59-L96 HydrophobicContact CB-CD2 3.49Å; R59-L96 VanDerWaalsContact CB-CD2 3.49Å; R59-L96 HydrophobicContact CB-CG 3.88Å; R59-I99 HydrophobicContact CG-CD1 4.28Å
60	R	96.5	Very high	96.4	Very high	13 Å²	13	41.1 Å²	41.1	5%	0.049	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-42.6	175.4	-74.7	179.9	63.8	-135.8	17.7	111.7	I56 G57 S62 W63 R64 L96 Y134 E137 D260	I56-R60 HydrophobicContact CG1-CG 4.15Å; I56-R60 PolarHBondContact O-N 2.89Å; G57-R60 PolarHBondContact O-N 2.89Å; R60-S62 VanDerWaalsContact C-N 3.34Å; R60-S62 PolarHBondContact O-N 3.26Å; R60-W63 PolarHBondContact O-N 2.93Å; R60-R64 WeakPolarHBondContact O-CG 3.35Å; R60-R64 PolarHBondContact O-N 2.87Å; R60-L96 HydrophobicContact CG-CD2 3.61Å; R60-Y134 VanDerWaalsContact NH2-CE1 3.27Å; R60-E137 IonicContact CZ-OE1 3.17Å; R60-E137 IonicContact CZ-OE2 3.99Å; R60-E137 IonicContact NE-OE1 2.78Å; R60-E137 IonicContact NE-OE2 3.82Å; R60-E137 PolarHBondContact NE-OE2 2.99Å; R60-E137 IonicContact NH2-OE1 3.54Å; R60-E137 PolarHBondContact NH2-OE1 2.83Å; R60-E137 IonicContact NH2-OE2 3.07Å; R60-E137 PolarHBondContact NH2-OE2 3.44Å; R60-D260 IonicContact CZ-OD2 3.34Å; R60-D260 IonicContact NH1-OD2 3.53Å; R60-D260 PolarHBondContact NH1-OD2 3.32Å; R60-D260 IonicContact NH2-OD2 2.59Å
61	A	95.4	Very high	96.4	Very high	46 Å²	46	44.6 Å²	44.6	38%	0.38	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-45.8	174.1	0	0	0	0	0	111.4	G57 R59 W63 R64 I65	G57-A61 WeakPolarHBondContact O-CB 3.44Å; G57-A61 PolarHBondContact O-N 3.29Å; R59-A61 PolarHBondContact O-N 3.06Å; A61-W63 PolarHBondContact O-N 3.25Å; A61-R64 PolarHBondContact O-N 3.45Å; A61-I65 VanDerWaalsContact O-CG1 3.29Å; A61-I65 WeakPolarHBondContact O-CG1 3.43Å; A61-I65 PolarHBondContact O-N 3.27Å
62	S	96.1	Very high	96.4	Very high	49 Å²	49	50.4 Å²	50.4	34%	0.343	26%	0.264	S	S	.	.	H	α-helix	trans	-58.7	-47.1	176.1	-59.3	0	0	0	0	111.7	S58 R59 R60 I65 F66	S58-S62 PolarHBondContact O-N 3.41Å; S58-S62 VanDerWaalsContact O-N 3.1Å; S58-S62 PolarHBondContact O-OG 3.15Å; R59-S62 WeakPolarHBondContact O-CB 3.45Å; R59-S62 PolarHBondContact O-N 2.92Å; R60-S62 VanDerWaalsContact C-N 3.34Å; R60-S62 PolarHBondContact O-N 3.26Å; S62-I65 PolarHBondContact O-N 3.33Å; S62-F66 WeakPolarHBondContact O-CD2 3.48Å; S62-F66 WeakPolarHBondContact O-CG 3.45Å; S62-F66 PolarHBondContact O-N 3.05Å
63	W	96.9	Very high	96.3	Very high	38 Å²	38	51.4 Å²	51.4	14%	0.144	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-46.4	178.8	-175.9	84.6	0	0	0	112.3	R59 R60 A61 I65 F66 S67 M89 V92 E93 L96 F138	R59-W63 PolarHBondContact O-N 2.96Å; R60-W63 PolarHBondContact O-N 2.93Å; A61-W63 PolarHBondContact O-N 3.25Å; W63-I65 VanDerWaalsContact C-N 3.35Å; W63-I65 PolarHBondContact O-N 2.92Å; W63-F66 PolarHBondContact O-N 3.05Å; W63-S67 PolarHBondContact O-N 3.13Å; W63-M89 HydrophobicContact CZ2-CE 4.36Å; W63-V92 HydrophobicContact CB-CG1 3.85Å; W63-E93 PolarHBondContact NE1-OE1 3.41Å; W63-L96 HydrophobicContact CB-CD1 4Å; W63-L96 HydrophobicContact CG-CD1 4.22Å; W63-F138 HydrophobicContact CD2-CB 4.15Å; W63-F138 VanDerWaalsContact CE2-CB 3.41Å; W63-F138 HydrophobicContact CH2-CB 4.01Å; W63-F138 HydrophobicContact CZ2-CB 3.34Å
64	R	95.2	Very high	96.4	Very high	89 Å²	89	51.3 Å²	51.3	34%	0.336	28%	0.278	S	S	.	.	H	α-helix	trans	-59.8	-43	176.2	-73.9	-177.4	175.5	109.8	4.5	112.5	R60 A61 S67 S68 E137	R60-R64 WeakPolarHBondContact O-CG 3.35Å; R60-R64 PolarHBondContact O-N 2.87Å; A61-R64 PolarHBondContact O-N 3.45Å; R64-S67 PolarHBondContact O-N 2.77Å; R64-S68 PolarHBondContact O-N 2.82Å; R64-E137 IonicContact CZ-OE2 2.72Å; R64-E137 IonicContact NH2-OE1 3.83Å; R64-E137 IonicContact NH2-OE2 2.77Å; R64-E137 PolarHBondContact NH2-OE2 3.46Å
65	I	96.2	Very high	96.5	Very high	100 Å²	100	54.7 Å²	54.7	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-47.7	176.8	-70.9	166.4	0	0	0	110.1	A61 S62 W63 S67 S68 I69	A61-I65 VanDerWaalsContact O-CG1 3.29Å; A61-I65 WeakPolarHBondContact O-CG1 3.43Å; A61-I65 PolarHBondContact O-N 3.27Å; S62-I65 PolarHBondContact O-N 3.33Å; W63-I65 VanDerWaalsContact C-N 3.35Å; W63-I65 PolarHBondContact O-N 2.92Å; I65-S67 PolarHBondContact O-N 3.45Å; I65-S68 WeakPolarHBondContact O-CB 3.3Å; I65-S68 PolarHBondContact O-N 2.86Å; I65-I69 HydrophobicContact CG2-CD1 3.67Å; I65-I69 HydrophobicContact CG2-CG1 4.35Å; I65-I69 VanDerWaalsContact O-CG1 3.31Å; I65-I69 WeakPolarHBondContact O-CG1 3.37Å; I65-I69 PolarHBondContact O-N 3.34Å
66	F	97.2	Very high	96.5	Very high	39 Å²	39	60.8 Å²	60.8	17%	0.171	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-41.7	178.8	-69.9	-46.1	0	0	0	112.5	S62 W63 S68 I69 E70 I85 Y88 M89 V92	S62-F66 WeakPolarHBondContact O-CD2 3.48Å; S62-F66 WeakPolarHBondContact O-CG 3.45Å; S62-F66 PolarHBondContact O-N 3.05Å; W63-F66 PolarHBondContact O-N 3.05Å; F66-S68 VanDerWaalsContact C-N 3.31Å; F66-S68 PolarHBondContact O-N 2.88Å; F66-I69 PolarHBondContact O-N 3.45Å; F66-I69 VanDerWaalsContact O-N 3.17Å; F66-E70 WeakPolarHBondContact O-CB 3.14Å; F66-E70 PolarHBondContact O-N 2.9Å; F66-I85 HydrophobicContact CB-CG2 4.21Å; F66-Y88 AromaticContact CE1-CD1 3.88Å; F66-Y88 HydrophobicContact CE1-CD1 3.88Å; F66-Y88 AromaticContact CE1-CE1 3.93Å; F66-Y88 HydrophobicContact CE1-CE1 3.93Å; F66-Y88 HydrophobicContact CE2-CD1 4.04Å; F66-Y88 AromaticContact CE2-CE1 3.94Å; F66-Y88 HydrophobicContact CE2-CE1 3.94Å; F66-Y88 HydrophobicContact CE2-CE2 4.46Å; F66-Y88 HydrophobicContact CE2-CG 4.36Å; F66-Y88 AromaticContact CZ-CD1 3.54Å; F66-Y88 HydrophobicContact CZ-CD1 3.54Å; F66-Y88 AromaticContact CZ-CE1 3.28Å; F66-Y88 HydrophobicContact CZ-CE1 3.28Å; F66-Y88 HydrophobicContact CZ-CG 4.3Å; F66-Y88 AromaticContact CZ-CZ 3.83Å; F66-M89 HydrophobicContact CB-CG 3.48Å; F66-M89 VanDerWaalsContact CB-CG 3.48Å; F66-M89 HydrophobicContact CB-SD 3.92Å; F66-M89 HydrophobicContact CD2-CG 4.5Å; F66-M89 HydrophobicContact CG-CG 4.29Å; F66-V92 HydrophobicContact CD2-CG2 4.06Å; F66-V92 HydrophobicContact CE2-CG2 3.89Å
67	S	95.4	Very high	96.5	Very high	26 Å²	26	63 Å²	63	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-42.5	174	-174.2	0	0	0	0	111.8	W63 R64 I65 E70 Q71	W63-S67 PolarHBondContact O-N 3.13Å; R64-S67 PolarHBondContact O-N 2.77Å; I65-S67 PolarHBondContact O-N 3.45Å; S67-E70 WeakPolarHBondContact O-CB 3.31Å; S67-E70 PolarHBondContact O-N 3.03Å; S67-Q71 WeakPolarHBondContact O-CG 3.31Å; S67-Q71 PolarHBondContact O-N 3.25Å; S67-Q71 VanDerWaalsContact O-N 3.09Å
68	S	96.2	Very high	96.6	Very high	46 Å²	46	64.6 Å²	64.6	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-40.4	175.1	-173.8	0	0	0	0	112.9	R64 I65 F66 K72	R64-S68 PolarHBondContact O-N 2.82Å; I65-S68 WeakPolarHBondContact O-CB 3.3Å; I65-S68 PolarHBondContact O-N 2.86Å; F66-S68 VanDerWaalsContact C-N 3.31Å; F66-S68 PolarHBondContact O-N 2.88Å; S68-K72 WeakPolarHBondContact O-CG 3.4Å; S68-K72 PolarHBondContact O-N 3.31Å; S68-K72 VanDerWaalsContact O-N 3.16Å; S68-K72 PolarHBondContact OG-NZ 2.99Å
69	I	97.6	Very high	96.7	Very high	65 Å²	65	67.7 Å²	67.7	33%	0.333	36%	0.364	S	S	.	.	H	α-helix	trans	-68.5	-41.6	177.7	-63.8	168.1	0	0	0	110.3	I65 F66 Q71 K72 E73 I85	I65-I69 HydrophobicContact CG2-CD1 3.67Å; I65-I69 HydrophobicContact CG2-CG1 4.35Å; I65-I69 VanDerWaalsContact O-CG1 3.31Å; I65-I69 WeakPolarHBondContact O-CG1 3.37Å; I65-I69 PolarHBondContact O-N 3.34Å; F66-I69 PolarHBondContact O-N 3.45Å; F66-I69 VanDerWaalsContact O-N 3.17Å; I69-Q71 VanDerWaalsContact C-N 3.34Å; I69-Q71 PolarHBondContact O-N 2.97Å; I69-K72 PolarHBondContact O-N 2.96Å; I69-E73 HydrophobicContact CG2-CG 4.26Å; I69-E73 WeakPolarHBondContact O-CG 3.3Å; I69-E73 PolarHBondContact O-N 3.17Å; I69-I85 HydrophobicContact CG2-CD1 3.73Å
70	E	97.3	Very high	96.8	Very high	38 Å²	38	69.2 Å²	69.2	18%	0.178	38%	0.38	C	S	.	.	H	α-helix	trans	-54.5	-51	175.5	-169.7	-153.4	162.4	0	0	110.8	F66 S67 K72 E73 A74 V82 I85 K86 M89	F66-E70 WeakPolarHBondContact O-CB 3.14Å; F66-E70 PolarHBondContact O-N 2.9Å; S67-E70 WeakPolarHBondContact O-CB 3.31Å; S67-E70 PolarHBondContact O-N 3.03Å; E70-K72 VanDerWaalsContact C-N 3.33Å; E70-K72 PolarHBondContact O-N 3.41Å; E70-E73 PolarHBondContact O-N 3.04Å; E70-A74 WeakPolarHBondContact O-CB 3.38Å; E70-A74 PolarHBondContact O-N 3.5Å; E70-V82 HydrophobicContact CG-CG1 4.07Å; E70-I85 HydrophobicContact CB-CG2 3.78Å; E70-I85 HydrophobicContact CG-CG2 4.3Å; E70-K86 HydrophobicContact CG-CG 4.5Å; E70-K86 WeakPolarHBondContact OE1-CE 3.44Å; E70-K86 IonicContact OE1-NZ 3.6Å; E70-M89 HydrophobicContact CB-SD 4.47Å
71	Q	96.4	Very high	96.9	Very high	114 Å²	114	71.3 Å²	71.3	53%	0.533	39%	0.392	S	S	.	.	H	α-helix	trans	-58.5	-44.2	177.5	-70.9	174.9	3.5	0	0	111.8	S67 I69 E73 A74 V75	S67-Q71 WeakPolarHBondContact O-CG 3.31Å; S67-Q71 PolarHBondContact O-N 3.25Å; S67-Q71 VanDerWaalsContact O-N 3.09Å; I69-Q71 VanDerWaalsContact C-N 3.34Å; I69-Q71 PolarHBondContact O-N 2.97Å; Q71-E73 PolarHBondContact O-N 3.39Å; Q71-A74 PolarHBondContact O-N 3.38Å; Q71-V75 WeakPolarHBondContact O-CG2 3.45Å; Q71-V75 PolarHBondContact O-N 3.43Å
72	K	97.6	Very high	97	Very high	123 Å²	123	69.9 Å²	69.9	54%	0.535	38%	0.379	S	S	.	.	H	α-helix	trans	-64.6	-38.9	178.3	-72.7	168.4	-176.1	165.7	0	112.6	S68 I69 E70 K76	S68-K72 WeakPolarHBondContact O-CG 3.4Å; S68-K72 PolarHBondContact O-N 3.31Å; S68-K72 VanDerWaalsContact O-N 3.16Å; S68-K72 PolarHBondContact OG-NZ 2.99Å; I69-K72 PolarHBondContact O-N 2.96Å; E70-K72 VanDerWaalsContact C-N 3.33Å; E70-K72 PolarHBondContact O-N 3.41Å; K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 2.9Å
73	E	98	Very high	97.1	Very high	24 Å²	24	74 Å²	74	11%	0.112	39%	0.39	C	S	.	.	H	α-helix	trans	-73.2	-35	177.3	-69.9	-60.6	115.4	0	0	111.9	I69 E70 Q71 K76 G77 N78 N81 V82 I85	I69-E73 HydrophobicContact CG2-CG 4.26Å; I69-E73 WeakPolarHBondContact O-CG 3.3Å; I69-E73 PolarHBondContact O-N 3.17Å; E70-E73 PolarHBondContact O-N 3.04Å; Q71-E73 PolarHBondContact O-N 3.39Å; E73-K76 PolarHBondContact O-N 3.26Å; E73-K76 IonicContact OE1-NZ 3.73Å; E73-K76 PolarHBondContact OE1-NZ 3.24Å; E73-G77 PolarHBondContact O-N 2.86Å; E73-N78 HydrophobicContact CB-CB 4.32Å; E73-N78 PolarHBondContact O-N 3.34Å; E73-N78 WeakPolarHBondContact OE2-CB 3.27Å; E73-N78 PolarHBondContact OE2-ND2 2.93Å; E73-N81 HydrophobicContact CB-CB 4.4Å; E73-N81 HydrophobicContact CG-CB 4.26Å; E73-N81 PolarHBondContact OE2-ND2 3.1Å; E73-V82 HydrophobicContact CB-CG2 3.97Å; E73-I85 HydrophobicContact CB-CD1 4.16Å; E73-I85 HydrophobicContact CG-CD1 3.84Å
74	A	97	Very high	97.2	Very high	51 Å²	51	79.5 Å²	79.5	42%	0.421	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-42.6	173.9	0	0	0	0	0	111.8	E70 Q71 K76 G77 V82	E70-A74 WeakPolarHBondContact O-CB 3.38Å; E70-A74 PolarHBondContact O-N 3.5Å; Q71-A74 PolarHBondContact O-N 3.38Å; A74-K76 PolarHBondContact O-N 3.39Å; A74-G77 PolarHBondContact O-N 2.71Å; A74-V82 HydrophobicContact CB-CG2 3.91Å
75	V	97.2	Very high	97.3	Very high	132 Å²	132	76.3 Å²	76.3	80%	0.8	40%	0.401	S	S	*	.	H	α-helix	trans	-61.7	-30.2	175.5	170	0	0	0	0	112.3	Q71 G77	Q71-V75 WeakPolarHBondContact O-CG2 3.45Å; Q71-V75 PolarHBondContact O-N 3.43Å; V75-G77 VanDerWaalsContact C-N 3.31Å
76	K	97.1	Very high	97.4	Very high	133 Å²	133	76.5 Å²	76.5	58%	0.578	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.8	175.5	-65.1	171.7	-165	166.9	0	113.7	K72 E73 A74 N78	K72-K76 WeakPolarHBondContact O-CG 3.48Å; K72-K76 PolarHBondContact O-N 2.9Å; E73-K76 PolarHBondContact O-N 3.26Å; E73-K76 IonicContact OE1-NZ 3.73Å; E73-K76 PolarHBondContact OE1-NZ 3.24Å; A74-K76 PolarHBondContact O-N 3.39Å; K76-N78 VanDerWaalsContact C-N 3.31Å
77	G	96.7	Very high	97.4	Very high	47 Å²	47	79.1 Å²	79.1	49%	0.485	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	21.6	-173.5	0	0	0	0	0	113.9	E73 A74 V75 D79	E73-G77 PolarHBondContact O-N 2.86Å; A74-G77 PolarHBondContact O-N 2.71Å; V75-G77 VanDerWaalsContact C-N 3.31Å; G77-D79 VanDerWaalsContact C-N 3.25Å; G77-D79 PolarHBondContact O-N 3.07Å
78	N	97.5	Very high	97.4	Very high	63 Å²	63	83.7 Å²	83.7	34%	0.337	43%	0.425	S	S	.	.			trans	-84.2	62.7	-178.8	-70.8	-22.1	0	0	0	111.4	E73 K76 V80 N81 V82	E73-N78 HydrophobicContact CB-CB 4.32Å; E73-N78 PolarHBondContact O-N 3.34Å; E73-N78 WeakPolarHBondContact OE2-CB 3.27Å; E73-N78 PolarHBondContact OE2-ND2 2.93Å; K76-N78 VanDerWaalsContact C-N 3.31Å; N78-V80 PolarHBondContact O-N 2.84Å; N78-V80 VanDerWaalsContact O-N 3.1Å; N78-N81 HydrophobicContact CB-CB 4.15Å; N78-N81 PolarHBondContact O-N 2.81Å; N78-V82 PolarHBondContact O-N 2.96Å
79	D	97.3	Very high	97.5	Very high	122 Å²	122	82 Å²	82	65%	0.652	41%	0.412	S	S	*	.	H	α-helix	trans	-54.4	-35.5	-172	-65.1	-34.4	0	0	0	114	G77 V82 K83	G77-D79 VanDerWaalsContact C-N 3.25Å; G77-D79 PolarHBondContact O-N 3.07Å; D79-V82 PolarHBondContact O-N 3.38Å; D79-K83 PolarHBondContact O-N 3.37Å
80	V	98.2	Very high	97.4	Very high	95 Å²	95	85 Å²	85	58%	0.576	42%	0.424	S	S	*	.	H	α-helix	trans	-65	-40.3	176.7	179.1	0	0	0	0	111.5	N78 R84	N78-V80 PolarHBondContact O-N 2.84Å; N78-V80 VanDerWaalsContact O-N 3.1Å; V80-R84 WeakPolarHBondContact O-CG 3.36Å; V80-R84 PolarHBondContact O-N 2.89Å
81	N	98.1	Very high	97.5	Very high	58 Å²	58	89.5 Å²	89.5	31%	0.31	44%	0.443	S	S	.	.	H	α-helix	trans	-72.9	-40.8	177.1	-71.2	-17.3	0	0	0	111	E73 N78 K83 R84 I85	E73-N81 HydrophobicContact CB-CB 4.4Å; E73-N81 HydrophobicContact CG-CB 4.26Å; E73-N81 PolarHBondContact OE2-ND2 3.1Å; N78-N81 HydrophobicContact CB-CB 4.15Å; N78-N81 PolarHBondContact O-N 2.81Å; N81-K83 VanDerWaalsContact C-N 3.27Å; N81-K83 PolarHBondContact O-N 3.38Å; N81-R84 PolarHBondContact O-N 3.46Å; N81-R84 VanDerWaalsContact O-N 3.13Å; N81-R84 PolarHBondContact OD1-NH1 2.99Å; N81-I85 WeakPolarHBondContact O-CD1 3.43Å; N81-I85 VanDerWaalsContact O-CG1 3.25Å; N81-I85 WeakPolarHBondContact O-CG1 3.3Å; N81-I85 PolarHBondContact O-N 3.39Å
82	V	98.3	Very high	97.5	Very high	16 Å²	16	84.3 Å²	84.3	10%	0.097	42%	0.419	C	S	.	.	H	α-helix	trans	-54.1	-47.1	174	173.3	0	0	0	0	110.3	E70 E73 A74 N78 D79 R84 I85 K86	E70-V82 HydrophobicContact CG-CG1 4.07Å; E73-V82 HydrophobicContact CB-CG2 3.97Å; A74-V82 HydrophobicContact CB-CG2 3.91Å; N78-V82 PolarHBondContact O-N 2.96Å; D79-V82 PolarHBondContact O-N 3.38Å; V82-R84 PolarHBondContact O-N 2.84Å; V82-I85 PolarHBondContact O-N 2.9Å; V82-K86 HydrophobicContact CG1-CD 4.4Å; V82-K86 WeakPolarHBondContact O-CG 3.35Å; V82-K86 PolarHBondContact O-N 2.87Å
83	K	98.1	Very high	97.6	Very high	134 Å²	134	80.7 Å²	80.7	58%	0.583	41%	0.405	S	S	*	.	H	α-helix	trans	-59.6	-46.1	176.7	-175.5	176.6	175.2	-178.7	0	112.6	D79 N81 I85 K86 E87	D79-K83 PolarHBondContact O-N 3.37Å; N81-K83 VanDerWaalsContact C-N 3.27Å; N81-K83 PolarHBondContact O-N 3.38Å; K83-I85 VanDerWaalsContact C-N 3.31Å; K83-I85 PolarHBondContact O-N 2.72Å; K83-K86 PolarHBondContact O-N 3.42Å; K83-E87 WeakPolarHBondContact CE-OE1 3.44Å; K83-E87 WeakPolarHBondContact O-CG 3.41Å; K83-E87 PolarHBondContact O-N 3.41Å
84	R	98.2	Very high	97.6	Very high	154 Å²	154	84.7 Å²	84.7	58%	0.581	43%	0.426	S	S	*	.	H	α-helix	trans	-61.6	-38.7	177.5	-71.1	169.2	177.8	166.5	-3.2	112.6	V80 N81 V82 Y88	V80-R84 WeakPolarHBondContact O-CG 3.36Å; V80-R84 PolarHBondContact O-N 2.89Å; N81-R84 PolarHBondContact O-N 3.46Å; N81-R84 VanDerWaalsContact O-N 3.13Å; N81-R84 PolarHBondContact OD1-NH1 2.99Å; V82-R84 PolarHBondContact O-N 2.84Å; R84-Y88 PolarHBondContact O-N 3.46Å; R84-Y88 VanDerWaalsContact O-N 3.15Å
85	I	98	Very high	97.6	Very high	22 Å²	22	86 Å²	86	11%	0.113	42%	0.424	C	S	.	.	H	α-helix	trans	-67.3	-44.5	178.7	-65.6	158.1	0	0	0	109.8	F66 I69 E70 E73 N81 V82 K83 E87 Y88 M89	F66-I85 HydrophobicContact CB-CG2 4.21Å; I69-I85 HydrophobicContact CG2-CD1 3.73Å; E70-I85 HydrophobicContact CB-CG2 3.78Å; E70-I85 HydrophobicContact CG-CG2 4.3Å; E73-I85 HydrophobicContact CB-CD1 4.16Å; E73-I85 HydrophobicContact CG-CD1 3.84Å; N81-I85 WeakPolarHBondContact O-CD1 3.43Å; N81-I85 VanDerWaalsContact O-CG1 3.25Å; N81-I85 WeakPolarHBondContact O-CG1 3.3Å; N81-I85 PolarHBondContact O-N 3.39Å; V82-I85 PolarHBondContact O-N 2.9Å; K83-I85 VanDerWaalsContact C-N 3.31Å; K83-I85 PolarHBondContact O-N 2.72Å; I85-E87 PolarHBondContact O-N 2.94Å; I85-Y88 CarbonylContact O-C 3.59Å; I85-Y88 PolarHBondContact O-N 3.4Å; I85-Y88 VanDerWaalsContact O-N 3.08Å; I85-M89 HydrophobicContact CG2-CG 4.29Å; I85-M89 HydrophobicContact CG2-SD 3.99Å; I85-M89 WeakPolarHBondContact O-CG 3.44Å; I85-M89 PolarHBondContact O-N 2.65Å
86	K	97.4	Very high	97.7	Very high	104 Å²	104	79.9 Å²	79.9	45%	0.452	39%	0.386	S	S	.	.	H	α-helix	trans	-57.4	-47.9	175	-73	-177.7	176.8	-173.1	0	112.6	E70 V82 K83 Y88 M89 E90	E70-K86 HydrophobicContact CG-CG 4.5Å; E70-K86 WeakPolarHBondContact OE1-CE 3.44Å; E70-K86 IonicContact OE1-NZ 3.6Å; V82-K86 HydrophobicContact CG1-CD 4.4Å; V82-K86 WeakPolarHBondContact O-CG 3.35Å; V82-K86 PolarHBondContact O-N 2.87Å; K83-K86 PolarHBondContact O-N 3.42Å; K86-Y88 PolarHBondContact O-N 2.85Å; K86-M89 WeakPolarHBondContact O-CB 3.48Å; K86-M89 PolarHBondContact O-N 3.5Å; K86-M89 VanDerWaalsContact O-N 3.1Å; K86-E90 WeakPolarHBondContact O-CG 3.22Å; K86-E90 PolarHBondContact O-N 3.36Å
87	E	97.2	Very high	97.7	Very high	94 Å²	94	74 Å²	74	44%	0.439	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-31.5	176.5	-71.8	171	-176.1	0	0	112.4	K83 I85	K83-E87 WeakPolarHBondContact CE-OE1 3.44Å; K83-E87 WeakPolarHBondContact O-CG 3.41Å; K83-E87 PolarHBondContact O-N 3.41Å; I85-E87 PolarHBondContact O-N 2.94Å
88	Y	96.8	Very high	97.8	Very high	123 Å²	123	76.1 Å²	76.1	48%	0.482	36%	0.362	S	S	.	.	H	α-helix	trans	-78.5	-40	174.5	-162.6	-176.8	0	0	0	111.8	F66 R84 I85 K86 E90 K91 V92	F66-Y88 AromaticContact CE1-CD1 3.88Å; F66-Y88 HydrophobicContact CE1-CD1 3.88Å; F66-Y88 AromaticContact CE1-CE1 3.93Å; F66-Y88 HydrophobicContact CE1-CE1 3.93Å; F66-Y88 HydrophobicContact CE2-CD1 4.04Å; F66-Y88 AromaticContact CE2-CE1 3.94Å; F66-Y88 HydrophobicContact CE2-CE1 3.94Å; F66-Y88 HydrophobicContact CE2-CE2 4.46Å; F66-Y88 HydrophobicContact CE2-CG 4.36Å; F66-Y88 AromaticContact CZ-CD1 3.54Å; F66-Y88 HydrophobicContact CZ-CD1 3.54Å; F66-Y88 AromaticContact CZ-CE1 3.28Å; F66-Y88 HydrophobicContact CZ-CE1 3.28Å; F66-Y88 HydrophobicContact CZ-CG 4.3Å; F66-Y88 AromaticContact CZ-CZ 3.83Å; R84-Y88 PolarHBondContact O-N 3.46Å; R84-Y88 VanDerWaalsContact O-N 3.15Å; I85-Y88 CarbonylContact O-C 3.59Å; I85-Y88 PolarHBondContact O-N 3.4Å; I85-Y88 VanDerWaalsContact O-N 3.08Å; K86-Y88 PolarHBondContact O-N 2.85Å; Y88-E90 VanDerWaalsContact C-N 3.28Å; Y88-E90 PolarHBondContact O-N 2.87Å; Y88-K91 HydrophobicContact CD2-CB 4.38Å; Y88-K91 HydrophobicContact CD2-CD 4.19Å; Y88-K91 WeakPolarHBondContact O-CB 3.16Å; Y88-K91 PolarHBondContact O-N 3.37Å; Y88-V92 HydrophobicContact CE2-CG2 4.49Å; Y88-V92 PolarHBondContact O-N 2.98Å
89	M	96.8	Very high	97.8	Very high	11 Å²	11	74 Å²	74	5%	0.054	35%	0.351	C	S	.	.	H	α-helix	trans	-57.7	-40.7	174.6	-73.7	177.2	64.9	0	0	111.7	W63 F66 E70 I85 K86 K91 V92 E93	W63-M89 HydrophobicContact CZ2-CE 4.36Å; F66-M89 HydrophobicContact CB-CG 3.48Å; F66-M89 VanDerWaalsContact CB-CG 3.48Å; F66-M89 HydrophobicContact CB-SD 3.92Å; F66-M89 HydrophobicContact CD2-CG 4.5Å; F66-M89 HydrophobicContact CG-CG 4.29Å; E70-M89 HydrophobicContact CB-SD 4.47Å; I85-M89 HydrophobicContact CG2-CG 4.29Å; I85-M89 HydrophobicContact CG2-SD 3.99Å; I85-M89 WeakPolarHBondContact O-CG 3.44Å; I85-M89 PolarHBondContact O-N 2.65Å; K86-M89 WeakPolarHBondContact O-CB 3.48Å; K86-M89 PolarHBondContact O-N 3.5Å; K86-M89 VanDerWaalsContact O-N 3.1Å; M89-K91 PolarHBondContact O-N 3.45Å; M89-V92 CarbonylContact O-C 3.59Å; M89-V92 PolarHBondContact O-N 3.16Å; M89-E93 WeakPolarHBondContact O-CB 3.11Å; M89-E93 VanDerWaalsContact O-CG 3.29Å; M89-E93 WeakPolarHBondContact O-CG 3.35Å; M89-E93 PolarHBondContact O-N 3.01Å
90	E	97.2	Very high	97.9	Very high	127 Å²	127	68.3 Å²	68.3	59%	0.593	32%	0.32	S	S	*	.	H	α-helix	trans	-54.7	-35.5	175	-73.7	173.2	-177	0	0	112.7	K86 Y88 L94	K86-E90 WeakPolarHBondContact O-CG 3.22Å; K86-E90 PolarHBondContact O-N 3.36Å; Y88-E90 VanDerWaalsContact C-N 3.28Å; Y88-E90 PolarHBondContact O-N 2.87Å; E90-L94 WeakPolarHBondContact O-CB 2.76Å; E90-L94 PolarHBondContact O-N 3.33Å
91	K	97.7	Very high	97.9	Very high	132 Å²	132	68.8 Å²	68.8	57%	0.574	32%	0.319	S	S	*	.	H	α-helix	trans	-68.9	-45.1	175.1	-61.4	-179.8	-177.6	175.8	0	111.6	Y88 M89 E93 L94 E95	Y88-K91 HydrophobicContact CD2-CB 4.38Å; Y88-K91 HydrophobicContact CD2-CD 4.19Å; Y88-K91 WeakPolarHBondContact O-CB 3.16Å; Y88-K91 PolarHBondContact O-N 3.37Å; M89-K91 PolarHBondContact O-N 3.45Å; K91-E93 VanDerWaalsContact C-N 3.32Å; K91-E93 PolarHBondContact O-N 3.07Å; K91-L94 PolarHBondContact O-N 3.03Å; K91-E95 WeakPolarHBondContact O-CG 3.23Å; K91-E95 PolarHBondContact O-N 3.08Å
92	V	97.9	Very high	97.9	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.03	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-39.2	178.3	-177.8	0	0	0	0	110.7	R59 W63 F66 Y88 M89 L94 E95 L96	R59-V92 HydrophobicContact CB-CG1 4.36Å; R59-V92 WeakPolarHBondContact O-CG1 3.44Å; W63-V92 HydrophobicContact CB-CG1 3.85Å; F66-V92 HydrophobicContact CD2-CG2 4.06Å; F66-V92 HydrophobicContact CE2-CG2 3.89Å; Y88-V92 HydrophobicContact CE2-CG2 4.49Å; Y88-V92 PolarHBondContact O-N 2.98Å; M89-V92 CarbonylContact O-C 3.59Å; M89-V92 PolarHBondContact O-N 3.16Å; V92-L94 VanDerWaalsContact C-N 3.34Å; V92-E95 WeakPolarHBondContact O-CB 3.41Å; V92-E95 PolarHBondContact O-N 3.4Å; V92-L96 HydrophobicContact CG1-CD1 4.22Å; V92-L96 HydrophobicContact CG1-CG 4.46Å; V92-L96 WeakPolarHBondContact O-CB 3.17Å; V92-L96 WeakPolarHBondContact O-CG 3Å; V92-L96 PolarHBondContact O-N 3.15Å
93	E	98.2	Very high	97.9	Very high	48 Å²	48	67.6 Å²	67.6	22%	0.224	31%	0.312	C	S	.	.	H	α-helix	trans	-65.4	-36.4	176.1	-71	174.6	-176	0	0	112.2	W63 M89 K91 S97 F138	W63-E93 PolarHBondContact NE1-OE1 3.41Å; M89-E93 WeakPolarHBondContact O-CB 3.11Å; M89-E93 VanDerWaalsContact O-CG 3.29Å; M89-E93 WeakPolarHBondContact O-CG 3.35Å; M89-E93 PolarHBondContact O-N 3.01Å; K91-E93 VanDerWaalsContact C-N 3.32Å; K91-E93 PolarHBondContact O-N 3.07Å; E93-S97 VanDerWaalsContact O-CB 3.29Å; E93-S97 WeakPolarHBondContact O-CB 3.05Å; E93-S97 PolarHBondContact O-N 2.96Å; E93-S97 PolarHBondContact O-OG 3.22Å; E93-F138 HydrophobicContact CB-CD2 3.75Å; E93-F138 HydrophobicContact CB-CE2 3.93Å; E93-F138 HydrophobicContact CG-CB 4.13Å; E93-F138 HydrophobicContact CG-CD2 3.59Å; E93-F138 HydrophobicContact CG-CE2 4.26Å; E93-F138 HydrophobicContact CG-CG 4.06Å; E93-F138 WeakPolarHBondContact O-CE2 3.29Å
94	L	98.2	Very high	97.9	Very high	107 Å²	107	61.9 Å²	61.9	56%	0.56	29%	0.287	S	S	*	.	H	α-helix	trans	-65.4	-44.9	172	-179.3	62	0	0	0	111.4	E90 K91 V92 S97 N98	E90-L94 WeakPolarHBondContact O-CB 2.76Å; E90-L94 PolarHBondContact O-N 3.33Å; K91-L94 PolarHBondContact O-N 3.03Å; V92-L94 VanDerWaalsContact C-N 3.34Å; L94-S97 PolarHBondContact O-N 3.34Å; L94-N98 WeakPolarHBondContact O-CB 3.39Å; L94-N98 PolarHBondContact O-N 3.31Å; L94-N98 PolarHBondContact O-ND2 2.89Å
95	E	98.1	Very high	97.9	Very high	80 Å²	80	56.7 Å²	56.7	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-59	-48.2	174.4	-69.7	174	-154.3	0	0	111.4	R59 K91 V92 S97 N98 I99	R59-E95 HydrophobicContact CG-CB 4.09Å; R59-E95 WeakPolarHBondContact CG-OE2 3.49Å; R59-E95 IonicContact NE-OE2 2.8Å; R59-E95 PolarHBondContact NE-OE2 3.14Å; K91-E95 WeakPolarHBondContact O-CG 3.23Å; K91-E95 PolarHBondContact O-N 3.08Å; V92-E95 WeakPolarHBondContact O-CB 3.41Å; V92-E95 PolarHBondContact O-N 3.4Å; E95-S97 PolarHBondContact O-N 2.81Å; E95-N98 PolarHBondContact O-N 2.93Å; E95-I99 WeakPolarHBondContact O-CD1 3.24Å; E95-I99 VanDerWaalsContact O-CG1 3.28Å; E95-I99 WeakPolarHBondContact O-CG1 3.39Å; E95-I99 PolarHBondContact O-N 3.24Å
96	L	98.2	Very high	97.9	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-58.8	-45.7	175.9	-75.8	171.7	0	0	0	112.2	I56 R59 R60 W63 V92 N98 I99 C100 F138	I56-L96 HydrophobicContact CD1-CD2 4.33Å; I56-L96 HydrophobicContact CG1-CD2 3.7Å; R59-L96 HydrophobicContact CB-CD2 3.49Å; R59-L96 VanDerWaalsContact CB-CD2 3.49Å; R59-L96 HydrophobicContact CB-CG 3.88Å; R60-L96 HydrophobicContact CG-CD2 3.61Å; W63-L96 HydrophobicContact CB-CD1 4Å; W63-L96 HydrophobicContact CG-CD1 4.22Å; V92-L96 HydrophobicContact CG1-CD1 4.22Å; V92-L96 HydrophobicContact CG1-CG 4.46Å; V92-L96 WeakPolarHBondContact O-CB 3.17Å; V92-L96 WeakPolarHBondContact O-CG 3Å; V92-L96 PolarHBondContact O-N 3.15Å; L96-N98 VanDerWaalsContact C-N 3.33Å; L96-N98 PolarHBondContact O-N 3.34Å; L96-I99 PolarHBondContact O-N 3.15Å; L96-C100 PolarHBondContact O-N 3.19Å; L96-C100 PolarHBondContact O-SG 3.31Å; L96-F138 HydrophobicContact CB-CD1 4.44Å; L96-F138 HydrophobicContact CB-CE1 3.62Å; L96-F138 HydrophobicContact CB-CZ 3.65Å; L96-F138 HydrophobicContact CD1-CD1 3.94Å; L96-F138 HydrophobicContact CD1-CE1 3.95Å; L96-F138 HydrophobicContact CG-CE1 4.36Å
97	S	98.3	Very high	98	Very high	10 Å²	10	50.9 Å²	50.9	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-45.1	178.6	-61.2	0	0	0	0	110.9	E93 L94 E95 C100 I101 F138	E93-S97 VanDerWaalsContact O-CB 3.29Å; E93-S97 WeakPolarHBondContact O-CB 3.05Å; E93-S97 PolarHBondContact O-N 2.96Å; E93-S97 PolarHBondContact O-OG 3.22Å; L94-S97 PolarHBondContact O-N 3.34Å; E95-S97 PolarHBondContact O-N 2.81Å; S97-C100 PolarHBondContact O-N 3.48Å; S97-I101 WeakPolarHBondContact O-CB 3.28Å; S97-I101 WeakPolarHBondContact O-CD1 3.47Å; S97-I101 VanDerWaalsContact O-CG1 3.23Å; S97-I101 WeakPolarHBondContact O-CG1 3.39Å; S97-I101 PolarHBondContact O-N 3.2Å; S97-F138 WeakPolarHBondContact OG-CE2 3.38Å; S97-F138 WeakPolarHBondContact OG-CZ 3.48Å
98	N	98.4	Very high	98	Very high	91 Å²	91	49.6 Å²	49.6	49%	0.487	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-44.5	178.8	-69.7	-21.8	0	0	0	111.6	L94 E95 L96 I101 D102	L94-N98 WeakPolarHBondContact O-CB 3.39Å; L94-N98 PolarHBondContact O-N 3.31Å; L94-N98 PolarHBondContact O-ND2 2.89Å; E95-N98 PolarHBondContact O-N 2.93Å; L96-N98 VanDerWaalsContact C-N 3.33Å; L96-N98 PolarHBondContact O-N 3.34Å; N98-I101 PolarHBondContact O-N 3.31Å; N98-D102 VanDerWaalsContact O-CB 3.28Å; N98-D102 WeakPolarHBondContact O-CB 3.39Å; N98-D102 PolarHBondContact O-N 3Å
99	I	98.3	Very high	98.1	Very high	20 Å²	20	49.3 Å²	49.3	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-46.4	177.4	-63.4	157.5	0	0	0	110.3	Y52 V55 I56 R59 E95 L96 D102 I103 Y131	Y52-I99 HydrophobicContact CD1-CG2 4.23Å; V55-I99 HydrophobicContact CG1-CD1 3.68Å; V55-I99 HydrophobicContact CG1-CG1 3.88Å; V55-I99 HydrophobicContact CG1-CG2 4.22Å; I56-I99 HydrophobicContact CB-CG2 3.96Å; I56-I99 HydrophobicContact CD1-CG2 4.13Å; I56-I99 HydrophobicContact CG1-CG2 4.2Å; R59-I99 HydrophobicContact CG-CD1 4.28Å; E95-I99 WeakPolarHBondContact O-CD1 3.24Å; E95-I99 VanDerWaalsContact O-CG1 3.28Å; E95-I99 WeakPolarHBondContact O-CG1 3.39Å; E95-I99 PolarHBondContact O-N 3.24Å; L96-I99 PolarHBondContact O-N 3.15Å; I99-D102 PolarHBondContact O-N 3.45Å; I99-I103 WeakPolarHBondContact O-CG2 3.47Å; I99-I103 PolarHBondContact O-N 3.1Å; I99-I103 VanDerWaalsContact O-N 3.16Å; I99-Y131 HydrophobicContact CG2-CE1 4.23Å
100	C	98.4	Very high	98.2	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-48.6	178.9	-64.7	0	0	0	0	111.8	I56 L96 S97 D102 I103 M104 Y131	I56-C100 VanDerWaalsContact CD1-SG 3.59Å; L96-C100 PolarHBondContact O-N 3.19Å; L96-C100 PolarHBondContact O-SG 3.31Å; S97-C100 PolarHBondContact O-N 3.48Å; C100-D102 VanDerWaalsContact C-N 3.29Å; C100-D102 PolarHBondContact O-N 3.04Å; C100-I103 VanDerWaalsContact O-CG2 3.26Å; C100-I103 WeakPolarHBondContact O-CG2 3.3Å; C100-I103 PolarHBondContact O-N 3.49Å; C100-M104 WeakPolarHBondContact O-CB 3.25Å; C100-M104 VanDerWaalsContact O-CG 3.23Å; C100-M104 WeakPolarHBondContact O-CG 3.5Å; C100-M104 PolarHBondContact O-N 2.64Å; C100-Y131 HydrophobicContact CB-CD1 4.45Å
101	I	98.2	Very high	98.2	Very high	105 Å²	105	44.3 Å²	44.3	54%	0.538	22%	0.224	S	C	.	.	H	α-helix	trans	-61.3	-40.2	179.6	-69.4	165.1	0	0	0	110.9	S97 N98 M104 S105	S97-I101 WeakPolarHBondContact O-CB 3.28Å; S97-I101 WeakPolarHBondContact O-CD1 3.47Å; S97-I101 VanDerWaalsContact O-CG1 3.23Å; S97-I101 WeakPolarHBondContact O-CG1 3.39Å; S97-I101 PolarHBondContact O-N 3.2Å; N98-I101 PolarHBondContact O-N 3.31Å; I101-M104 PolarHBondContact O-N 3.49Å; I101-S105 PolarHBondContact O-N 3.34Å
102	D	98.4	Very high	98.2	Very high	49 Å²	49	40.2 Å²	40.2	26%	0.262	21%	0.208	S	C	.	.	H	α-helix	trans	-61.2	-51.9	179.4	-173.7	64.5	0	0	0	112	K31 Y52 N98 I99 C100 M104 S105 V106	K31-D102 WeakPolarHBondContact CE-OD1 3.37Å; K31-D102 WeakPolarHBondContact CE-OD2 3.38Å; K31-D102 IonicContact NZ-OD1 2.74Å; K31-D102 PolarHBondContact NZ-OD1 3.29Å; K31-D102 IonicContact NZ-OD2 2.74Å; K31-D102 PolarHBondContact NZ-OD2 2.96Å; Y52-D102 WeakPolarHBondContact CE1-OD2 3.5Å; Y52-D102 PolarHBondContact OH-OD2 3.41Å; N98-D102 VanDerWaalsContact O-CB 3.28Å; N98-D102 WeakPolarHBondContact O-CB 3.39Å; N98-D102 PolarHBondContact O-N 3Å; I99-D102 PolarHBondContact O-N 3.45Å; C100-D102 VanDerWaalsContact C-N 3.29Å; C100-D102 PolarHBondContact O-N 3.04Å; D102-M104 VanDerWaalsContact C-N 3.34Å; D102-M104 PolarHBondContact O-N 3.35Å; D102-S105 PolarHBondContact O-N 3.5Å; D102-V106 WeakPolarHBondContact O-CG2 3.43Å; D102-V106 PolarHBondContact O-N 3.07Å; D102-V106 VanDerWaalsContact O-N 3.12Å
103	I	98.3	Very high	98.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-35.4	176.7	-179.3	59.4	0	0	0	111.8	Y52 I99 C100 S105 V106 L107 M127 Y131	Y52-I103 HydrophobicContact CD1-CB 3.9Å; Y52-I103 HydrophobicContact CD1-CG2 4.49Å; Y52-I103 HydrophobicContact CD2-CD1 3.8Å; Y52-I103 HydrophobicContact CD2-CG1 4.42Å; Y52-I103 HydrophobicContact CE1-CB 3.66Å; Y52-I103 HydrophobicContact CE1-CG2 4.48Å; Y52-I103 HydrophobicContact CE2-CB 4.29Å; Y52-I103 HydrophobicContact CE2-CD1 3.62Å; Y52-I103 HydrophobicContact CE2-CG1 4.41Å; Y52-I103 HydrophobicContact CG-CB 4.32Å; Y52-I103 HydrophobicContact CG-CD1 4.33Å; Y52-I103 HydrophobicContact CG-CG1 4.46Å; I99-I103 WeakPolarHBondContact O-CG2 3.47Å; I99-I103 PolarHBondContact O-N 3.1Å; I99-I103 VanDerWaalsContact O-N 3.16Å; C100-I103 VanDerWaalsContact O-CG2 3.26Å; C100-I103 WeakPolarHBondContact O-CG2 3.3Å; C100-I103 PolarHBondContact O-N 3.49Å; I103-S105 VanDerWaalsContact C-N 3.34Å; I103-S105 PolarHBondContact O-N 2.94Å; I103-V106 HydrophobicContact CD1-CB 4.49Å; I103-V106 PolarHBondContact O-N 3.01Å; I103-L107 HydrophobicContact CD1-CD1 4.25Å; I103-L107 HydrophobicContact CD1-CD2 4.31Å; I103-L107 HydrophobicContact CD1-CG 3.88Å; I103-L107 HydrophobicContact CG1-CD1 3.88Å; I103-L107 HydrophobicContact CG1-CG 4.04Å; I103-L107 WeakPolarHBondContact O-CB 3.46Å; I103-L107 VanDerWaalsContact O-CG 3.26Å; I103-L107 WeakPolarHBondContact O-CG 3.3Å; I103-L107 PolarHBondContact O-N 2.67Å; I103-M127 HydrophobicContact CD1-SD 3.92Å; I103-M127 HydrophobicContact CG1-CG 4.49Å; I103-M127 HydrophobicContact CG1-SD 4.13Å; I103-Y131 HydrophobicContact CG1-CD2 4.49Å; I103-Y131 HydrophobicContact CG1-CE2 4.49Å; I103-Y131 HydrophobicContact CG2-CD1 3.31Å; I103-Y131 HydrophobicContact CG2-CD2 3.97Å; I103-Y131 HydrophobicContact CG2-CE1 3.64Å; I103-Y131 HydrophobicContact CG2-CE2 4.29Å; I103-Y131 HydrophobicContact CG2-CG 3.5Å; I103-Y131 VanDerWaalsContact CG2-CG 3.5Å
104	M	97.9	Very high	98.1	Very high	13 Å²	13	43.2 Å²	43.2	6%	0.064	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-43.8	176.8	-71.5	-47.1	88.7	0	0	111.3	C100 I101 D102 L107 D108 K128 Y131 Y132	C100-M104 WeakPolarHBondContact O-CB 3.25Å; C100-M104 VanDerWaalsContact O-CG 3.23Å; C100-M104 WeakPolarHBondContact O-CG 3.5Å; C100-M104 PolarHBondContact O-N 2.64Å; I101-M104 PolarHBondContact O-N 3.49Å; D102-M104 VanDerWaalsContact C-N 3.34Å; D102-M104 PolarHBondContact O-N 3.35Å; M104-L107 HydrophobicContact CE-CD1 3.66Å; M104-L107 PolarHBondContact O-N 3.01Å; M104-D108 WeakPolarHBondContact O-CB 3.48Å; M104-D108 PolarHBondContact O-N 3.49Å; M104-K128 HydrophobicContact SD-CB 4.39Å; M104-K128 HydrophobicContact SD-CG 3.64Å; M104-Y131 HydrophobicContact CE-CD2 4.39Å; M104-Y131 HydrophobicContact CE-CG 3.98Å; M104-Y132 HydrophobicContact CG-CE1 4.45Å; M104-Y132 HydrophobicContact CG-CE2 4.06Å; M104-Y132 HydrophobicContact SD-CD2 3.63Å; M104-Y132 HydrophobicContact SD-CE2 3.41Å; M104-Y132 WeakPolarHBondContact SD-CE2 3.4Å; M104-Y132 HydrophobicContact SD-CG 4.34Å
105	S	98.3	Very high	97.9	Very high	45 Å²	45	39 Å²	39	32%	0.315	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-45.8	175.4	166.6	0	0	0	0	111.3	I101 D102 I103 L107 D108 E109	I101-S105 PolarHBondContact O-N 3.34Å; D102-S105 PolarHBondContact O-N 3.5Å; I103-S105 VanDerWaalsContact C-N 3.34Å; I103-S105 PolarHBondContact O-N 2.94Å; S105-L107 PolarHBondContact O-N 3.46Å; S105-D108 PolarHBondContact O-N 2.98Å; S105-E109 VanDerWaalsContact O-CB 3.23Å; S105-E109 WeakPolarHBondContact O-CB 3.19Å; S105-E109 WeakPolarHBondContact O-CG 3.31Å; S105-E109 PolarHBondContact O-N 3.39Å; S105-E109 PolarHBondContact OG-OE1 3.24Å
106	V	98.5	Very high	97.6	Very high	5 Å²	5	38 Å²	38	3%	0.03	22%	0.215	C	C	.	.	H	α-helix	trans	-62.6	-41.4	178.1	176.3	0	0	0	0	112	K31 A34 D102 I103 H110 L111	K31-V106 HydrophobicContact CG-CG2 3.93Å; A34-V106 HydrophobicContact CB-CG1 3.58Å; D102-V106 WeakPolarHBondContact O-CG2 3.43Å; D102-V106 PolarHBondContact O-N 3.07Å; D102-V106 VanDerWaalsContact O-N 3.12Å; I103-V106 HydrophobicContact CD1-CB 4.49Å; I103-V106 PolarHBondContact O-N 3.01Å; V106-H110 WeakPolarHBondContact O-CB 3.44Å; V106-H110 PolarHBondContact O-N 3.04Å; V106-L111 HydrophobicContact CG1-CD1 3.78Å; V106-L111 HydrophobicContact CG1-CG 4.18Å; V106-L111 PolarHBondContact O-N 3.35Å
107	L	98.5	Very high	96.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.247	C	C	.	.	I	π-helix	trans	-64.4	-48.7	177.3	-70.8	171.5	0	0	0	111.4	I103 M104 S105 L111 I112 F124 M127 K128	I103-L107 HydrophobicContact CD1-CD1 4.25Å; I103-L107 HydrophobicContact CD1-CD2 4.31Å; I103-L107 HydrophobicContact CD1-CG 3.88Å; I103-L107 HydrophobicContact CG1-CD1 3.88Å; I103-L107 HydrophobicContact CG1-CG 4.04Å; I103-L107 WeakPolarHBondContact O-CB 3.46Å; I103-L107 VanDerWaalsContact O-CG 3.26Å; I103-L107 WeakPolarHBondContact O-CG 3.3Å; I103-L107 PolarHBondContact O-N 2.67Å; M104-L107 HydrophobicContact CE-CD1 3.66Å; M104-L107 PolarHBondContact O-N 3.01Å; S105-L107 PolarHBondContact O-N 3.46Å; L107-L111 HydrophobicContact CD2-CB 4.31Å; L107-L111 HydrophobicContact CD2-CD1 3.9Å; L107-L111 PolarHBondContact O-N 2.8Å; L107-I112 HydrophobicContact CB-CD1 4.11Å; L107-I112 HydrophobicContact CB-CG1 4.41Å; L107-I112 WeakPolarHBondContact O-CB 3.48Å; L107-I112 WeakPolarHBondContact O-CG1 3.35Å; L107-I112 PolarHBondContact O-N 3.38Å; L107-F124 HydrophobicContact CD2-CB 3.83Å; L107-F124 HydrophobicContact CD2-CD1 3.66Å; L107-F124 HydrophobicContact CD2-CG 4.03Å; L107-M127 HydrophobicContact CD1-CB 4.37Å; L107-M127 HydrophobicContact CD1-CG 4.16Å; L107-M127 HydrophobicContact CD1-SD 4.49Å; L107-M127 HydrophobicContact CD2-SD 4.18Å; L107-K128 HydrophobicContact CD1-CB 3.96Å
108	D	98.2	Very high	96.5	Very high	66 Å²	66	44.9 Å²	44.9	35%	0.353	25%	0.249	S	C	.	.	I	π-helix	trans	-76.2	-36.2	-172.5	-75.8	-12.4	0	0	0	113.4	M104 S105 P113 K128	M104-D108 WeakPolarHBondContact O-CB 3.48Å; M104-D108 PolarHBondContact O-N 3.49Å; S105-D108 PolarHBondContact O-N 2.98Å; D108-P113 WeakPolarHBondContact O-CD 3.35Å; D108-P113 WeakPolarHBondContact O-CG 3.27Å; D108-K128 WeakPolarHBondContact OD1-CE 3.22Å; D108-K128 IonicContact OD1-NZ 3.53Å; D108-K128 PolarHBondContact OD1-NZ 3.41Å; D108-K128 IonicContact OD2-NZ 3.46Å; D108-K128 PolarHBondContact OD2-NZ 2.92Å
109	E	98.2	Very high	96.3	Very high	117 Å²	117	44 Å²	44	55%	0.547	24%	0.242	S	C	.	.	I	π-helix	trans	-84.8	-29	-176.5	-65.8	174.5	-145.1	0	0	112.8	S105	S105-E109 VanDerWaalsContact O-CB 3.23Å; S105-E109 WeakPolarHBondContact O-CB 3.19Å; S105-E109 WeakPolarHBondContact O-CG 3.31Å; S105-E109 PolarHBondContact O-N 3.39Å; S105-E109 PolarHBondContact OG-OE1 3.24Å
110	H	98.1	Very high	96.2	Very high	31 Å²	31	43.1 Å²	43.1	14%	0.144	24%	0.237	C	C	.	.	I	π-helix	trans	-128.8	-53	-167.7	-58.9	-52.4	0	0	0	114.2	A34 N37 V106 S114	A34-H110 HydrophobicContact CB-CB 4.43Å; A34-H110 WeakPolarHBondContact O-CB 3.31Å; N37-H110 PolarHBondContact OD1-ND1 2.71Å; V106-H110 WeakPolarHBondContact O-CB 3.44Å; V106-H110 PolarHBondContact O-N 3.04Å; H110-S114 WeakPolarHBondContact O-CB 3.22Å; H110-S114 PolarHBondContact O-N 3.44Å; H110-S114 PolarHBondContact O-OG 3.49Å
111	L	98.2	Very high	96.1	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	25%	0.247	C	C	.	.	I	π-helix	trans	-81.9	-49.3	-166.1	-62.4	173.6	0	0	0	113.4	A34 L40 L48 V106 L107 S114 A115 F124	A34-L111 HydrophobicContact CB-CD1 4.24Å; A34-L111 HydrophobicContact CB-CD2 3.59Å; A34-L111 HydrophobicContact CB-CG 3.91Å; L40-L111 HydrophobicContact CD1-CD2 3.62Å; L40-L111 HydrophobicContact CD2-CD2 4.26Å; L40-L111 HydrophobicContact CG-CD2 3.77Å; L48-L111 HydrophobicContact CD2-CD1 3.34Å; V106-L111 HydrophobicContact CG1-CD1 3.78Å; V106-L111 HydrophobicContact CG1-CG 4.18Å; V106-L111 PolarHBondContact O-N 3.35Å; L107-L111 HydrophobicContact CD2-CB 4.31Å; L107-L111 HydrophobicContact CD2-CD1 3.9Å; L107-L111 PolarHBondContact O-N 2.8Å; L111-S114 CarbonylContact O-C 3.51Å; L111-S114 PolarHBondContact O-N 3.08Å; L111-A115 WeakPolarHBondContact O-CB 3.4Å; L111-A115 PolarHBondContact O-N 2.99Å; L111-F124 HydrophobicContact CB-CD1 4.13Å; L111-F124 HydrophobicContact CB-CD2 4.04Å; L111-F124 HydrophobicContact CB-CE1 4.09Å; L111-F124 HydrophobicContact CB-CE2 3.97Å; L111-F124 HydrophobicContact CB-CG 4.13Å; L111-F124 HydrophobicContact CB-CZ 4.01Å; L111-F124 HydrophobicContact CD1-CD1 4.15Å; L111-F124 HydrophobicContact CD1-CE1 3.84Å; L111-F124 HydrophobicContact CD1-CZ 4.33Å; L111-F124 HydrophobicContact CD2-CE1 4.4Å; L111-F124 HydrophobicContact CD2-CZ 4.08Å; L111-F124 HydrophobicContact CG-CE1 4.35Å; L111-F124 HydrophobicContact CG-CZ 4.38Å
112	I	97.8	Very high	96.1	Very high	46 Å²	46	39.7 Å²	39.7	24%	0.236	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-44.4	177.9	-66.6	171.9	0	0	0	111	L107 S114 A115 F124 K128	L107-I112 HydrophobicContact CB-CD1 4.11Å; L107-I112 HydrophobicContact CB-CG1 4.41Å; L107-I112 WeakPolarHBondContact O-CB 3.48Å; L107-I112 WeakPolarHBondContact O-CG1 3.35Å; L107-I112 PolarHBondContact O-N 3.38Å; I112-S114 VanDerWaalsContact C-N 3.25Å; I112-S114 PolarHBondContact O-N 3.39Å; I112-A115 PolarHBondContact O-N 2.67Å; I112-F124 HydrophobicContact CG1-CB 3.77Å; I112-K128 HydrophobicContact CD1-CD 3.97Å
113	P	97.2	Very high	96	Very high	89 Å²	89	38.5 Å²	38.5	58%	0.578	21%	0.214	S	C	*	.	H	α-helix	trans	-63.8	-27.4	175.7	-24.4	35.3	0	0	0	114.6	D108	D108-P113 WeakPolarHBondContact O-CD 3.35Å; D108-P113 WeakPolarHBondContact O-CG 3.27Å
114	S	96.3	Very high	96	Very high	27 Å²	27	38.6 Å²	38.6	19%	0.189	21%	0.214	C	C	.	.	H	α-helix	trans	-96.6	-7.9	-178.1	-51.9	0	0	0	0	113.5	N37 D39 H110 L111 I112	N37-S114 VanDerWaalsContact CA-OG 3.23Å; N37-S114 WeakPolarHBondContact CA-OG 3.45Å; N37-S114 PolarHBondContact O-OG 2.86Å; D39-S114 WeakPolarHBondContact CB-O 3.21Å; H110-S114 WeakPolarHBondContact O-CB 3.22Å; H110-S114 PolarHBondContact O-N 3.44Å; H110-S114 PolarHBondContact O-OG 3.49Å; L111-S114 CarbonylContact O-C 3.51Å; L111-S114 PolarHBondContact O-N 3.08Å; I112-S114 VanDerWaalsContact C-N 3.25Å; I112-S114 PolarHBondContact O-N 3.39Å
115	A	94.7	Very high	96.1	Very high	19 Å²	19	38.4 Å²	38.4	16%	0.157	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-67.4	133.6	-177	0	0	0	0	0	111	L111 I112 F124	L111-A115 WeakPolarHBondContact O-CB 3.4Å; L111-A115 PolarHBondContact O-N 2.99Å; I112-A115 PolarHBondContact O-N 2.67Å; A115-F124 HydrophobicContact CB-CD2 3.88Å; A115-F124 HydrophobicContact CB-CE2 4.11Å
116	S	90.5	Very high	96	Very high	58 Å²	58	37.9 Å²	37.9	41%	0.406	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-67.7	157.8	164.1	61	0	0	0	0	111	D39 T121	D39-S116 WeakPolarHBondContact OD2-CB 3.34Å; D39-S116 PolarHBondContact OD2-N 3Å; D39-S116 PolarHBondContact OD2-OG 3.22Å; S116-T121 PolarHBondContact O-OG1 3.29Å
117	E	85.2	Confident	96	Very high	147 Å²	147	38.2 Å²	38.2	69%	0.687	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	149.3	171.3	-68.4	-171.3	-172.4	0	0	111	K165	E117-K165 WeakPolarHBondContact OE2-CE 3.23Å; E117-K165 IonicContact OE2-NZ 3.32Å; E117-K165 PolarHBondContact OE2-NZ 3.43Å
118	G	89.5	Confident	96	Very high	10 Å²	10	39.5 Å²	39.5	10%	0.103	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	-127.9	179.2	0	0	0	0	0	111.9	S120 T121 V122	G118-S120 PolarHBondContact O-N 3.28Å; G118-T121 PolarHBondContact O-N 2.9Å; G118-V122 WeakPolarHBondContact O-CG2 3.4Å; G118-V122 PolarHBondContact O-N 2.89Å; G118-V122 VanDerWaalsContact O-N 3.1Å
119	E	93.7	Very high	96.1	Very high	74 Å²	74	36.4 Å²	36.4	35%	0.346	20%	0.196	S	C	.	.	H	α-helix	trans	-55.8	-49.5	-169	-71.9	179.4	-160.1	0	0	113.9	R45 T121 V122 F123 L166 H170 I172	R45-E119 IonicContact NH2-OE2 3.01Å; R45-E119 PolarHBondContact NH2-OE2 3.11Å; E119-T121 VanDerWaalsContact C-N 3.31Å; E119-T121 PolarHBondContact O-N 3.19Å; E119-V122 PolarHBondContact O-N 3.43Å; E119-F123 VanDerWaalsContact O-CB 3.22Å; E119-F123 WeakPolarHBondContact O-CB 3.46Å; E119-F123 PolarHBondContact O-N 3.32Å; E119-L166 HydrophobicContact CG-CD2 3.69Å; E119-H170 IonicContact OE1-NE2 2.62Å; E119-H170 PolarHBondContact OE1-NE2 3.48Å; E119-I172 HydrophobicContact CB-CD1 4.11Å; E119-I172 HydrophobicContact CG-CD1 4.28Å
120	S	95.9	Very high	96.1	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-43.7	-178.6	-66.9	0	0	0	0	111.5	D39 R45 G118 F123 F124	D39-S120 VanDerWaalsContact OD1-CB 3.28Å; D39-S120 WeakPolarHBondContact OD1-CB 3.44Å; D39-S120 PolarHBondContact OD1-OG 3.36Å; R45-S120 PolarHBondContact NH1-OG 2.69Å; G118-S120 PolarHBondContact O-N 3.28Å; S120-F123 PolarHBondContact O-N 3.33Å; S120-F124 WeakPolarHBondContact O-CD2 3.47Å; S120-F124 WeakPolarHBondContact O-CG 3.27Å; S120-F124 PolarHBondContact O-N 3.15Å
121	T	96.1	Very high	96.1	Very high	34 Å²	34	30 Å²	30	21%	0.209	17%	0.166	C	C	.	.	H	α-helix	trans	-62.7	-46.1	179	-63.6	0	0	0	0	111.3	S116 G118 E119 N125 A161	S116-T121 PolarHBondContact O-OG1 3.29Å; G118-T121 PolarHBondContact O-N 2.9Å; E119-T121 VanDerWaalsContact C-N 3.31Å; E119-T121 PolarHBondContact O-N 3.19Å; T121-N125 WeakPolarHBondContact O-CB 3.34Å; T121-N125 PolarHBondContact O-N 3.22Å; T121-N125 VanDerWaalsContact O-N 3.15Å; T121-N125 PolarHBondContact O-ND2 2.77Å; T121-A161 HydrophobicContact CG2-CB 4.16Å
122	V	98.1	Very high	96.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-45	178.2	-178.7	0	0	0	0	110.3	G118 E119 K126 A158 A161 A162 L166 I172 L176	G118-V122 WeakPolarHBondContact O-CG2 3.4Å; G118-V122 PolarHBondContact O-N 2.89Å; G118-V122 VanDerWaalsContact O-N 3.1Å; E119-V122 PolarHBondContact O-N 3.43Å; V122-K126 WeakPolarHBondContact O-CB 3.44Å; V122-K126 PolarHBondContact O-N 2.88Å; V122-A158 HydrophobicContact CG1-CB 4.46Å; V122-A161 HydrophobicContact CG2-CB 3.72Å; V122-A162 HydrophobicContact CG1-CB 3.86Å; V122-A162 HydrophobicContact CG2-CB 3.93Å; V122-L166 HydrophobicContact CB-CD1 4.11Å; V122-L166 HydrophobicContact CG1-CD1 4.14Å; V122-L166 HydrophobicContact CG2-CD1 3.89Å; V122-L166 HydrophobicContact CG2-CG 4.49Å; V122-I172 HydrophobicContact CB-CG2 4.07Å; V122-I172 HydrophobicContact CG1-CG2 3.59Å; V122-L176 HydrophobicContact CG1-CD2 4.05Å
123	F	97.5	Very high	96.1	Very high	25 Å²	25	29.8 Å²	29.8	11%	0.11	16%	0.162	C	C	.	.	H	α-helix	trans	-59.1	-52.2	-178.6	-173.5	-86.2	0	0	0	112.2	R45 E119 S120 K126 M127 I172	R45-F123 HydrophobicContact CB-CD1 4.14Å; R45-F123 HydrophobicContact CB-CE1 3.74Å; R45-F123 HydrophobicContact CB-CE2 4.31Å; R45-F123 HydrophobicContact CB-CZ 3.81Å; R45-F123 HydrophobicContact CG-CD1 4.29Å; R45-F123 HydrophobicContact CG-CE1 4.3Å; R45-F123 WeakPolarHBondContact O-CZ 3.28Å; E119-F123 VanDerWaalsContact O-CB 3.22Å; E119-F123 WeakPolarHBondContact O-CB 3.46Å; E119-F123 PolarHBondContact O-N 3.32Å; S120-F123 PolarHBondContact O-N 3.33Å; F123-K126 PolarHBondContact O-N 2.97Å; F123-M127 HydrophobicContact CE1-CE 3.67Å; F123-M127 HydrophobicContact CZ-CE 4.09Å; F123-M127 WeakPolarHBondContact O-CB 3.35Å; F123-M127 PolarHBondContact O-N 2.85Å; F123-I172 HydrophobicContact CB-CD1 4.44Å; F123-I172 HydrophobicContact CD2-CD1 4.11Å; F123-I172 HydrophobicContact CD2-CG1 4.43Å
124	F	98.3	Very high	96.2	Very high	1 Å²	1	25.7 Å²	25.7	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-71.6	-36.3	-177	-64.4	-45.5	0	0	0	112.9	L40 R45 L48 L107 L111 I112 A115 S120 M127 K128	L40-F124 HydrophobicContact CB-CZ 4.2Å; L40-F124 HydrophobicContact CD1-CE1 4.31Å; L40-F124 HydrophobicContact CD1-CZ 3.98Å; L40-F124 HydrophobicContact CG-CZ 4.08Å; R45-F124 HydrophobicContact CG-CE1 4.06Å; R45-F124 HydrophobicContact CG-CZ 3.78Å; L48-F124 HydrophobicContact CD2-CE1 4.23Å; L107-F124 HydrophobicContact CD2-CB 3.83Å; L107-F124 HydrophobicContact CD2-CD1 3.66Å; L107-F124 HydrophobicContact CD2-CG 4.03Å; L111-F124 HydrophobicContact CB-CD1 4.13Å; L111-F124 HydrophobicContact CB-CD2 4.04Å; L111-F124 HydrophobicContact CB-CE1 4.09Å; L111-F124 HydrophobicContact CB-CE2 3.97Å; L111-F124 HydrophobicContact CB-CG 4.13Å; L111-F124 HydrophobicContact CB-CZ 4.01Å; L111-F124 HydrophobicContact CD1-CD1 4.15Å; L111-F124 HydrophobicContact CD1-CE1 3.84Å; L111-F124 HydrophobicContact CD1-CZ 4.33Å; L111-F124 HydrophobicContact CD2-CE1 4.4Å; L111-F124 HydrophobicContact CD2-CZ 4.08Å; L111-F124 HydrophobicContact CG-CE1 4.35Å; L111-F124 HydrophobicContact CG-CZ 4.38Å; I112-F124 HydrophobicContact CG1-CB 3.77Å; A115-F124 HydrophobicContact CB-CD2 3.88Å; A115-F124 HydrophobicContact CB-CE2 4.11Å; S120-F124 WeakPolarHBondContact O-CD2 3.47Å; S120-F124 WeakPolarHBondContact O-CG 3.27Å; S120-F124 PolarHBondContact O-N 3.15Å; F124-M127 PolarHBondContact O-N 2.84Å; F124-K128 WeakPolarHBondContact O-CB 3.46Å; F124-K128 PolarHBondContact O-N 2.9Å
125	N	98.4	Very high	96.2	Very high	10 Å²	10	25.6 Å²	25.6	5%	0.053	13%	0.133	C	C	.	.	H	α-helix	trans	-71.6	-35.8	175.2	-77.4	-80.9	0	0	0	112.1	T121 K128 G129 I157 A158	T121-N125 WeakPolarHBondContact O-CB 3.34Å; T121-N125 PolarHBondContact O-N 3.22Å; T121-N125 VanDerWaalsContact O-N 3.15Å; T121-N125 PolarHBondContact O-ND2 2.77Å; N125-K128 WeakPolarHBondContact O-CB 3.26Å; N125-K128 PolarHBondContact O-N 2.89Å; N125-G129 PolarHBondContact O-N 2.82Å; N125-I157 HydrophobicContact CB-CG2 4.28Å; N125-A158 HydrophobicContact CB-CB 3.78Å
126	K	98.2	Very high	96.4	Very high	34 Å²	34	24.7 Å²	24.7	15%	0.148	13%	0.125	C	C	.	.	H	α-helix	trans	-58.2	-51.2	169.4	177.6	-168.4	172	-67.1	0	110.4	V122 F123 K128 G129 D130 A158 G175 L176 N179	V122-K126 WeakPolarHBondContact O-CB 3.44Å; V122-K126 PolarHBondContact O-N 2.88Å; F123-K126 PolarHBondContact O-N 2.97Å; K126-K128 VanDerWaalsContact C-N 3.29Å; K126-K128 PolarHBondContact O-N 3.37Å; K126-G129 WeakPolarHBondContact O-CA 3.45Å; K126-G129 PolarHBondContact O-N 3.18Å; K126-G129 VanDerWaalsContact O-N 3.08Å; K126-D130 IonicContact NZ-OD2 3.42Å; K126-D130 PolarHBondContact NZ-OD2 3.47Å; K126-D130 PolarHBondContact O-N 3Å; K126-A158 HydrophobicContact CB-CB 4.49Å; K126-G175 WeakPolarHBondContact CE-O 3.23Å; K126-L176 HydrophobicContact CB-CD1 4.07Å; K126-L176 HydrophobicContact CD-CB 4.08Å; K126-L176 HydrophobicContact CG-CB 4.3Å; K126-L176 HydrophobicContact CG-CD1 4.01Å; K126-N179 PolarHBondContact NZ-ND2 2.95Å
127	M	98.2	Very high	96.7	Very high	11 Å²	11	23 Å²	23	5%	0.054	11%	0.111	C	C	.	.	H	α-helix	trans	-58.3	-42.1	177.5	-174.3	177.5	-79.6	0	0	111.3	I103 L107 F123 F124 G129 D130 Y131	I103-M127 HydrophobicContact CD1-SD 3.92Å; I103-M127 HydrophobicContact CG1-CG 4.49Å; I103-M127 HydrophobicContact CG1-SD 4.13Å; L107-M127 HydrophobicContact CD1-CB 4.37Å; L107-M127 HydrophobicContact CD1-CG 4.16Å; L107-M127 HydrophobicContact CD1-SD 4.49Å; L107-M127 HydrophobicContact CD2-SD 4.18Å; F123-M127 HydrophobicContact CE1-CE 3.67Å; F123-M127 HydrophobicContact CZ-CE 4.09Å; F123-M127 WeakPolarHBondContact O-CB 3.35Å; F123-M127 PolarHBondContact O-N 2.85Å; F124-M127 PolarHBondContact O-N 2.84Å; M127-G129 VanDerWaalsContact C-N 3.34Å; M127-G129 PolarHBondContact O-N 3.08Å; M127-D130 WeakPolarHBondContact O-CB 3.27Å; M127-D130 PolarHBondContact O-N 3.32Å; M127-Y131 HydrophobicContact CG-CD2 3.96Å; M127-Y131 HydrophobicContact CG-CE2 3.9Å; M127-Y131 WeakPolarHBondContact O-CD2 3.43Å; M127-Y131 PolarHBondContact O-N 2.77Å; M127-Y131 VanDerWaalsContact O-N 3.11Å
128	K	98.6	Very high	97.2	Very high	28 Å²	28	16.9 Å²	16.9	12%	0.122	8%	0.082	C	C	.	.	H	α-helix	trans	-56.1	-48.2	173.1	-169.8	172.7	-175.3	168.3	0	111.8	M104 L107 D108 I112 F124 N125 K126 D130 Y131 Y132 A154	M104-K128 HydrophobicContact SD-CB 4.39Å; M104-K128 HydrophobicContact SD-CG 3.64Å; L107-K128 HydrophobicContact CD1-CB 3.96Å; D108-K128 WeakPolarHBondContact OD1-CE 3.22Å; D108-K128 IonicContact OD1-NZ 3.53Å; D108-K128 PolarHBondContact OD1-NZ 3.41Å; D108-K128 IonicContact OD2-NZ 3.46Å; D108-K128 PolarHBondContact OD2-NZ 2.92Å; I112-K128 HydrophobicContact CD1-CD 3.97Å; F124-K128 WeakPolarHBondContact O-CB 3.46Å; F124-K128 PolarHBondContact O-N 2.9Å; N125-K128 WeakPolarHBondContact O-CB 3.26Å; N125-K128 PolarHBondContact O-N 2.89Å; K126-K128 VanDerWaalsContact C-N 3.29Å; K126-K128 PolarHBondContact O-N 3.37Å; K128-D130 VanDerWaalsContact C-N 3.34Å; K128-D130 PolarHBondContact O-N 3.31Å; K128-Y131 PolarHBondContact O-N 3.32Å; K128-Y132 HydrophobicContact CD-CE2 4.36Å; K128-Y132 HydrophobicContact CG-CD2 3.93Å; K128-Y132 HydrophobicContact CG-CE2 3.83Å; K128-Y132 VanDerWaalsContact O-CD2 3.3Å; K128-Y132 WeakPolarHBondContact O-CD2 3.44Å; K128-Y132 PolarHBondContact O-N 2.86Å; K128-Y132 VanDerWaalsContact O-N 3.15Å; K128-A154 HydrophobicContact CB-CB 3.99Å; K128-A154 HydrophobicContact CD-CB 4.28Å; K128-A154 HydrophobicContact CG-CB 3.97Å
129	G	98.6	Very high	97.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58.4	-42.8	175.9	0	0	0	0	0	113.1	N125 K126 M127 R133 S151 Y155	N125-G129 PolarHBondContact O-N 2.82Å; K126-G129 WeakPolarHBondContact O-CA 3.45Å; K126-G129 PolarHBondContact O-N 3.18Å; K126-G129 VanDerWaalsContact O-N 3.08Å; M127-G129 VanDerWaalsContact C-N 3.34Å; M127-G129 PolarHBondContact O-N 3.08Å; G129-R133 WeakPolarHBondContact O-CB 3.32Å; G129-R133 PolarHBondContact O-N 2.93Å; G129-S151 PolarHBondContact O-OG 2.9Å; G129-Y155 VanDerWaalsContact C-CZ 3.44Å; G129-Y155 PolarHBondContact O-OH 3.17Å
130	D	98.5	Very high	97.6	Very high	6 Å²	6	19.8 Å²	19.8	3%	0.032	10%	0.102	C	C	.	.	H	α-helix	trans	-60.7	-48.8	179.3	-79.9	-44.8	0	0	0	112.7	K126 M127 K128 R133 Y134 Y155 N179	K126-D130 IonicContact NZ-OD2 3.42Å; K126-D130 PolarHBondContact NZ-OD2 3.47Å; K126-D130 PolarHBondContact O-N 3Å; M127-D130 WeakPolarHBondContact O-CB 3.27Å; M127-D130 PolarHBondContact O-N 3.32Å; K128-D130 VanDerWaalsContact C-N 3.34Å; K128-D130 PolarHBondContact O-N 3.31Å; D130-R133 WeakPolarHBondContact O-CA 3.5Å; D130-R133 VanDerWaalsContact O-CB 3.3Å; D130-R133 WeakPolarHBondContact O-CB 3.44Å; D130-R133 PolarHBondContact O-N 2.7Å; D130-R133 IonicContact OD1-CZ 2.78Å; D130-R133 IonicContact OD1-NE 3.63Å; D130-R133 IonicContact OD1-NH2 3.26Å; D130-R133 PolarHBondContact OD1-NH2 3.23Å; D130-Y134 HydrophobicContact CB-CE2 4.16Å; D130-Y134 WeakPolarHBondContact O-CD1 3.47Å; D130-Y134 WeakPolarHBondContact O-CD2 3.36Å; D130-Y134 PolarHBondContact O-N 3.11Å; D130-Y155 WeakPolarHBondContact CA-OH 3.47Å; D130-Y155 PolarHBondContact N-OH 3.05Å; D130-Y155 PolarHBondContact OD1-OH 2.75Å; D130-N179 VanDerWaalsContact OD1-CB 3.27Å; D130-N179 WeakPolarHBondContact OD1-CB 3.42Å; D130-N179 VanDerWaalsContact OD1-CG 3.31Å; D130-N179 PolarHBondContact OD1-ND2 3.45Å; D130-N179 PolarHBondContact OD2-ND2 3.34Å
131	Y	98.5	Very high	97.7	Very high	9 Å²	9	22.5 Å²	22.5	4%	0.035	13%	0.131	C	C	.	.	H	α-helix	trans	-75.3	-30.6	-177.6	-80.5	-95.9	0	0	0	113.5	Y52 K53 I56 I99 C100 I103 M104 M127 K128 R133 Y134 L135	Y52-Y131 VanDerWaalsContact CB-OH 3.24Å; Y52-Y131 WeakPolarHBondContact CB-OH 3.24Å; Y52-Y131 PolarHBondContact O-OH 3.36Å; K53-Y131 PolarHBondContact N-OH 3.39Å; I56-Y131 HydrophobicContact CB-CE1 4.07Å; I56-Y131 HydrophobicContact CD1-CD1 3.49Å; I56-Y131 VanDerWaalsContact CD1-CD1 3.49Å; I56-Y131 HydrophobicContact CD1-CE1 3.35Å; I56-Y131 HydrophobicContact CG1-CE1 4.3Å; I56-Y131 HydrophobicContact CG2-CE1 3.95Å; I99-Y131 HydrophobicContact CG2-CE1 4.23Å; C100-Y131 HydrophobicContact CB-CD1 4.45Å; I103-Y131 HydrophobicContact CG1-CD2 4.49Å; I103-Y131 HydrophobicContact CG1-CE2 4.49Å; I103-Y131 HydrophobicContact CG2-CD1 3.31Å; I103-Y131 HydrophobicContact CG2-CD2 3.97Å; I103-Y131 HydrophobicContact CG2-CE1 3.64Å; I103-Y131 HydrophobicContact CG2-CE2 4.29Å; I103-Y131 HydrophobicContact CG2-CG 3.5Å; I103-Y131 VanDerWaalsContact CG2-CG 3.5Å; M104-Y131 HydrophobicContact CE-CD2 4.39Å; M104-Y131 HydrophobicContact CE-CG 3.98Å; M127-Y131 HydrophobicContact CG-CD2 3.96Å; M127-Y131 HydrophobicContact CG-CE2 3.9Å; M127-Y131 WeakPolarHBondContact O-CD2 3.43Å; M127-Y131 PolarHBondContact O-N 2.77Å; M127-Y131 VanDerWaalsContact O-N 3.11Å; K128-Y131 PolarHBondContact O-N 3.32Å; Y131-R133 VanDerWaalsContact C-N 3.33Å; Y131-Y134 AromaticContact CD1-CD2 3.97Å; Y131-Y134 HydrophobicContact CD1-CD2 3.97Å; Y131-Y134 HydrophobicContact CD1-CE2 4.47Å; Y131-Y134 HydrophobicContact CD2-CD2 4.43Å; Y131-Y134 HydrophobicContact CD2-CE2 4.28Å; Y131-Y134 HydrophobicContact CE1-CD2 4.31Å; Y131-Y134 HydrophobicContact CE2-CE2 4.31Å; Y131-Y134 HydrophobicContact CG-CD2 4.03Å; Y131-Y134 HydrophobicContact CG-CE2 4.34Å; Y131-Y134 PolarHBondContact O-N 2.83Å; Y131-L135 PolarHBondContact O-N 2.81Å
132	Y	98.7	Very high	97.7	Very high	41 Å²	41	27.8 Å²	27.8	16%	0.161	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-36.1	166.5	-83.6	-62	0	0	0	112.3	M104 K128 Y134 L135 A136 Q150	M104-Y132 HydrophobicContact CG-CE1 4.45Å; M104-Y132 HydrophobicContact CG-CE2 4.06Å; M104-Y132 HydrophobicContact SD-CD2 3.63Å; M104-Y132 HydrophobicContact SD-CE2 3.41Å; M104-Y132 WeakPolarHBondContact SD-CE2 3.4Å; M104-Y132 HydrophobicContact SD-CG 4.34Å; K128-Y132 HydrophobicContact CD-CE2 4.36Å; K128-Y132 HydrophobicContact CG-CD2 3.93Å; K128-Y132 HydrophobicContact CG-CE2 3.83Å; K128-Y132 VanDerWaalsContact O-CD2 3.3Å; K128-Y132 WeakPolarHBondContact O-CD2 3.44Å; K128-Y132 PolarHBondContact O-N 2.86Å; K128-Y132 VanDerWaalsContact O-N 3.15Å; Y132-Y134 VanDerWaalsContact C-N 3.35Å; Y132-L135 HydrophobicContact CD1-CD2 4.36Å; Y132-L135 WeakPolarHBondContact O-CB 3.33Å; Y132-L135 PolarHBondContact O-N 3.32Å; Y132-A136 PolarHBondContact O-N 3.42Å; Y132-Q150 HydrophobicContact CD1-CB 3.69Å; Y132-Q150 HydrophobicContact CD1-CG 4.38Å; Y132-Q150 HydrophobicContact CD2-CB 3.67Å; Y132-Q150 HydrophobicContact CE1-CB 3.72Å; Y132-Q150 HydrophobicContact CE1-CG 3.98Å; Y132-Q150 HydrophobicContact CE2-CB 3.69Å; Y132-Q150 HydrophobicContact CE2-CG 4.37Å; Y132-Q150 HydrophobicContact CG-CB 3.67Å
133	R	98.3	Very high	97.7	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-46.1	171.5	167.7	172.7	69.4	86.8	1.5	110.5	G129 D130 Y131 L135 A136 E137 S151 Y155 F183 I187	G129-R133 WeakPolarHBondContact O-CB 3.32Å; G129-R133 PolarHBondContact O-N 2.93Å; D130-R133 WeakPolarHBondContact O-CA 3.5Å; D130-R133 VanDerWaalsContact O-CB 3.3Å; D130-R133 WeakPolarHBondContact O-CB 3.44Å; D130-R133 PolarHBondContact O-N 2.7Å; D130-R133 IonicContact OD1-CZ 2.78Å; D130-R133 IonicContact OD1-NE 3.63Å; D130-R133 IonicContact OD1-NH2 3.26Å; D130-R133 PolarHBondContact OD1-NH2 3.23Å; Y131-R133 VanDerWaalsContact C-N 3.33Å; R133-L135 VanDerWaalsContact C-N 3.3Å; R133-L135 PolarHBondContact O-N 3.18Å; R133-A136 WeakPolarHBondContact O-CB 3.44Å; R133-A136 PolarHBondContact O-N 2.87Å; R133-A136 VanDerWaalsContact O-N 3.07Å; R133-E137 IonicContact NH1-OE1 3.53Å; R133-E137 PolarHBondContact O-N 2.84Å; R133-E137 VanDerWaalsContact O-N 3.1Å; R133-S151 PolarHBondContact N-OG 3.46Å; R133-Y155 PolarHBondContact NE-OH 3.48Å; R133-F183 HydrophobicContact CB-CD2 4.19Å; R133-F183 HydrophobicContact CG-CD2 4.3Å; R133-I187 HydrophobicContact CG-CD1 4.36Å; R133-I187 HydrophobicContact CG-CG1 3.82Å
134	Y	97.9	Very high	97.8	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-40.6	175.6	-56.5	-27.1	0	0	0	112.3	I56 R60 D130 Y131 Y132 A136 E137 F138 D260	I56-Y134 HydrophobicContact CD1-CD2 3.62Å; I56-Y134 HydrophobicContact CD1-CE2 4.48Å; I56-Y134 HydrophobicContact CD1-CG 4.25Å; I56-Y134 HydrophobicContact CG2-CE2 4.39Å; R60-Y134 VanDerWaalsContact NH2-CE1 3.27Å; D130-Y134 HydrophobicContact CB-CE2 4.16Å; D130-Y134 WeakPolarHBondContact O-CD1 3.47Å; D130-Y134 WeakPolarHBondContact O-CD2 3.36Å; D130-Y134 PolarHBondContact O-N 3.11Å; Y131-Y134 AromaticContact CD1-CD2 3.97Å; Y131-Y134 HydrophobicContact CD1-CD2 3.97Å; Y131-Y134 HydrophobicContact CD1-CE2 4.47Å; Y131-Y134 HydrophobicContact CD2-CD2 4.43Å; Y131-Y134 HydrophobicContact CD2-CE2 4.28Å; Y131-Y134 HydrophobicContact CE1-CD2 4.31Å; Y131-Y134 HydrophobicContact CE2-CE2 4.31Å; Y131-Y134 HydrophobicContact CG-CD2 4.03Å; Y131-Y134 HydrophobicContact CG-CE2 4.34Å; Y131-Y134 PolarHBondContact O-N 2.83Å; Y132-Y134 VanDerWaalsContact C-N 3.35Å; Y134-A136 VanDerWaalsContact C-N 3.34Å; Y134-A136 PolarHBondContact O-N 3.23Å; Y134-E137 WeakPolarHBondContact CD1-OE1 3.35Å; Y134-E137 WeakPolarHBondContact O-CB 3.39Å; Y134-E137 PolarHBondContact O-N 2.99Å; Y134-F138 WeakPolarHBondContact O-CD1 3.41Å; Y134-F138 VanDerWaalsContact O-CE1 3.23Å; Y134-F138 WeakPolarHBondContact O-CE1 3.47Å; Y134-D260 PolarHBondContact OH-OD1 3.05Å; Y134-D260 PolarHBondContact OH-OD2 3.21Å
135	L	97.9	Very high	97.8	Very high	26 Å²	26	42.3 Å²	42.3	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-42.5	173.8	-169.7	63.5	0	0	0	111.4	Y131 Y132 R133 E137 F138 K139 A147	Y131-L135 PolarHBondContact O-N 2.81Å; Y132-L135 HydrophobicContact CD1-CD2 4.36Å; Y132-L135 WeakPolarHBondContact O-CB 3.33Å; Y132-L135 PolarHBondContact O-N 3.32Å; R133-L135 VanDerWaalsContact C-N 3.3Å; R133-L135 PolarHBondContact O-N 3.18Å; L135-E137 PolarHBondContact O-N 3.03Å; L135-F138 HydrophobicContact CD1-CE1 4.26Å; L135-F138 HydrophobicContact CD1-CE2 4.15Å; L135-F138 HydrophobicContact CD1-CZ 3.58Å; L135-K139 HydrophobicContact CD1-CD 4.25Å; L135-K139 HydrophobicContact CD1-CG 3.69Å; L135-K139 HydrophobicContact CG-CG 3.8Å; L135-K139 VanDerWaalsContact O-CB 3.28Å; L135-K139 WeakPolarHBondContact O-CB 3.47Å; L135-K139 WeakPolarHBondContact O-CG 3.49Å; L135-K139 PolarHBondContact O-N 3.36Å; L135-K139 VanDerWaalsContact O-N 3.09Å; L135-A147 HydrophobicContact CB-CB 4.09Å; L135-A147 HydrophobicContact CD2-CB 4.02Å; L135-A147 HydrophobicContact CG-CB 4.03Å
136	A	98.1	Very high	97.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-22	178.2	0	0	0	0	0	114	Y132 R133 Y134 F138 R144 A147 I187	Y132-A136 PolarHBondContact O-N 3.42Å; R133-A136 WeakPolarHBondContact O-CB 3.44Å; R133-A136 PolarHBondContact O-N 2.87Å; R133-A136 VanDerWaalsContact O-N 3.07Å; Y134-A136 VanDerWaalsContact C-N 3.34Å; Y134-A136 PolarHBondContact O-N 3.23Å; A136-F138 PolarHBondContact O-N 3.38Å; A136-R144 HydrophobicContact CB-CG 4.49Å; A136-R144 PolarHBondContact O-NH1 2.7Å; A136-A147 HydrophobicContact CB-CB 3.91Å; A136-I187 HydrophobicContact CB-CD1 4.17Å; A136-I187 HydrophobicContact CB-CG1 4.44Å; A136-I187 HydrophobicContact CB-CG2 3.79Å
137	E	96	Very high	97.8	Very high	23 Å²	23	46.3 Å²	46.3	11%	0.107	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-44.4	178.5	-71.1	173.6	-168	0	0	111.9	R60 R64 R133 Y134 L135 I187	R60-E137 IonicContact CZ-OE1 3.17Å; R60-E137 IonicContact CZ-OE2 3.99Å; R60-E137 IonicContact NE-OE1 2.78Å; R60-E137 IonicContact NE-OE2 3.82Å; R60-E137 PolarHBondContact NE-OE2 2.99Å; R60-E137 IonicContact NH2-OE1 3.54Å; R60-E137 PolarHBondContact NH2-OE1 2.83Å; R60-E137 IonicContact NH2-OE2 3.07Å; R60-E137 PolarHBondContact NH2-OE2 3.44Å; R64-E137 IonicContact CZ-OE2 2.72Å; R64-E137 IonicContact NH2-OE1 3.83Å; R64-E137 IonicContact NH2-OE2 2.77Å; R64-E137 PolarHBondContact NH2-OE2 3.46Å; R133-E137 IonicContact NH1-OE1 3.53Å; R133-E137 PolarHBondContact O-N 2.84Å; R133-E137 VanDerWaalsContact O-N 3.1Å; Y134-E137 WeakPolarHBondContact CD1-OE1 3.35Å; Y134-E137 WeakPolarHBondContact O-CB 3.39Å; Y134-E137 PolarHBondContact O-N 2.99Å; L135-E137 PolarHBondContact O-N 3.03Å; E137-I187 HydrophobicContact CG-CD1 4.01Å
138	F	95.2	Very high	97.8	Very high	18 Å²	18	46.2 Å²	46.2	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-112.8	-19.3	-172	65.5	-92.6	0	0	0	114.4	W63 E93 L96 S97 Y134 L135 A136	W63-F138 HydrophobicContact CD2-CB 4.15Å; W63-F138 VanDerWaalsContact CE2-CB 3.41Å; W63-F138 HydrophobicContact CH2-CB 4.01Å; W63-F138 HydrophobicContact CZ2-CB 3.34Å; E93-F138 HydrophobicContact CB-CD2 3.75Å; E93-F138 HydrophobicContact CB-CE2 3.93Å; E93-F138 HydrophobicContact CG-CB 4.13Å; E93-F138 HydrophobicContact CG-CD2 3.59Å; E93-F138 HydrophobicContact CG-CE2 4.26Å; E93-F138 HydrophobicContact CG-CG 4.06Å; E93-F138 WeakPolarHBondContact O-CE2 3.29Å; L96-F138 HydrophobicContact CB-CD1 4.44Å; L96-F138 HydrophobicContact CB-CE1 3.62Å; L96-F138 HydrophobicContact CB-CZ 3.65Å; L96-F138 HydrophobicContact CD1-CD1 3.94Å; L96-F138 HydrophobicContact CD1-CE1 3.95Å; L96-F138 HydrophobicContact CG-CE1 4.36Å; S97-F138 WeakPolarHBondContact OG-CE2 3.38Å; S97-F138 WeakPolarHBondContact OG-CZ 3.48Å; Y134-F138 WeakPolarHBondContact O-CD1 3.41Å; Y134-F138 VanDerWaalsContact O-CE1 3.23Å; Y134-F138 WeakPolarHBondContact O-CE1 3.47Å; L135-F138 HydrophobicContact CD1-CE1 4.26Å; L135-F138 HydrophobicContact CD1-CE2 4.15Å; L135-F138 HydrophobicContact CD1-CZ 3.58Å; A136-F138 PolarHBondContact O-N 3.38Å
139	K	97.3	Very high	97.8	Very high	51 Å²	51	48.8 Å²	48.8	22%	0.222	26%	0.255	C	S	.	.			trans	-67.3	160.5	174.1	-69.5	-55.5	-160.5	158.1	0	111.9	L135 E143 R144	L135-K139 HydrophobicContact CD1-CD 4.25Å; L135-K139 HydrophobicContact CD1-CG 3.69Å; L135-K139 HydrophobicContact CG-CG 3.8Å; L135-K139 VanDerWaalsContact O-CB 3.28Å; L135-K139 WeakPolarHBondContact O-CB 3.47Å; L135-K139 WeakPolarHBondContact O-CG 3.49Å; L135-K139 PolarHBondContact O-N 3.36Å; L135-K139 VanDerWaalsContact O-N 3.09Å; K139-E143 HydrophobicContact CB-CB 4.12Å; K139-E143 HydrophobicContact CD-CB 4.37Å; K139-E143 VanDerWaalsContact CD-OE2 3.27Å; K139-E143 WeakPolarHBondContact CD-OE2 3.3Å; K139-E143 WeakPolarHBondContact CE-OE2 3.05Å; K139-E143 HydrophobicContact CG-CB 4.33Å; K139-E143 IonicContact NZ-OE2 2.81Å; K139-E143 PolarHBondContact NZ-OE2 3.43Å; K139-R144 HydrophobicContact CB-CB 4.28Å; K139-R144 WeakPolarHBondContact O-CB 3.3Å
140	S	95.5	Very high	97.8	Very high	93 Å²	93	51.5 Å²	51.5	65%	0.65	27%	0.268	S	S	*	.			trans	-131.4	164.6	-179.8	65.8	0	0	0	0	112.3	N142 E143 R144	S140-N142 PolarHBondContact O-N 3.49Å; S140-E143 PolarHBondContact O-N 2.9Å; S140-R144 PolarHBondContact O-N 2.59Å
141	G	96.8	Very high	97.8	Very high	59 Å²	59	51.2 Å²	51.2	61%	0.608	27%	0.266	S	S	*	.	H	α-helix	trans	55.9	-132.3	176.1	0	0	0	0	0	113.6	E143 R144 K145	G141-E143 PolarHBondContact O-N 3.32Å; G141-R144 PolarHBondContact O-N 3.41Å; G141-K145 PolarHBondContact O-N 2.83Å
142	N	98	Very high	97.8	Very high	144 Å²	144	52.3 Å²	52.3	77%	0.77	27%	0.273	S	S	*	.	H	α-helix	trans	-65.8	-35.6	-178.1	-70.1	-13.9	0	0	0	112.8	S140 R144 K145 E146	S140-N142 PolarHBondContact O-N 3.49Å; N142-R144 VanDerWaalsContact C-N 3.33Å; N142-R144 PolarHBondContact O-N 3.23Å; N142-K145 PolarHBondContact O-N 3.1Å; N142-E146 WeakPolarHBondContact O-CB 3.42Å; N142-E146 PolarHBondContact O-N 3.26Å
143	E	97.7	Very high	97.8	Very high	107 Å²	107	55.9 Å²	55.9	50%	0.5	29%	0.289	S	S	.	.	H	α-helix	trans	-64	-40.3	178.9	-62.4	-171.9	162.1	0	0	111.1	K139 S140 G141 A147	K139-E143 HydrophobicContact CB-CB 4.12Å; K139-E143 HydrophobicContact CD-CB 4.37Å; K139-E143 VanDerWaalsContact CD-OE2 3.27Å; K139-E143 WeakPolarHBondContact CD-OE2 3.3Å; K139-E143 WeakPolarHBondContact CE-OE2 3.05Å; K139-E143 HydrophobicContact CG-CB 4.33Å; K139-E143 IonicContact NZ-OE2 2.81Å; K139-E143 PolarHBondContact NZ-OE2 3.43Å; S140-E143 PolarHBondContact O-N 2.9Å; G141-E143 PolarHBondContact O-N 3.32Å; E143-A147 WeakPolarHBondContact O-CB 3.41Å; E143-A147 PolarHBondContact O-N 2.89Å
144	R	98.1	Very high	97.8	Very high	89 Å²	89	56 Å²	56	34%	0.336	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-45.5	174.1	-173.9	179.9	173.3	106.7	-2.5	111.4	A136 K139 S140 G141 N142 A147 A148	A136-R144 HydrophobicContact CB-CG 4.49Å; A136-R144 PolarHBondContact O-NH1 2.7Å; K139-R144 HydrophobicContact CB-CB 4.28Å; K139-R144 WeakPolarHBondContact O-CB 3.3Å; S140-R144 PolarHBondContact O-N 2.59Å; G141-R144 PolarHBondContact O-N 3.41Å; N142-R144 VanDerWaalsContact C-N 3.33Å; N142-R144 PolarHBondContact O-N 3.23Å; R144-A147 PolarHBondContact O-N 2.87Å; R144-A148 WeakPolarHBondContact O-CB 3.37Å; R144-A148 PolarHBondContact O-N 2.96Å
145	K	98.4	Very high	97.9	Very high	135 Å²	135	55.9 Å²	55.9	59%	0.587	29%	0.29	S	S	*	.	H	α-helix	trans	-63	-47.2	-178.7	-174.9	-177.9	176.3	-176.3	0	111	G141 N142 A147 A148 D149	G141-K145 PolarHBondContact O-N 2.83Å; N142-K145 PolarHBondContact O-N 3.1Å; K145-A147 PolarHBondContact O-N 3.24Å; K145-A148 PolarHBondContact O-N 2.74Å; K145-D149 WeakPolarHBondContact O-CB 3.34Å; K145-D149 VanDerWaalsContact O-CG 3.27Å; K145-D149 PolarHBondContact O-N 3.15Å
146	E	98.4	Very high	97.9	Very high	125 Å²	125	58.9 Å²	58.9	58%	0.584	30%	0.303	S	S	*	.	H	α-helix	trans	-61.3	-44.2	177.5	-177.9	172.4	-169.6	0	0	111.7	N142 A148 D149 Q150	N142-E146 WeakPolarHBondContact O-CB 3.42Å; N142-E146 PolarHBondContact O-N 3.26Å; E146-A148 PolarHBondContact O-N 3.11Å; E146-D149 PolarHBondContact O-N 3.39Å; E146-Q150 WeakPolarHBondContact O-CG 3.36Å; E146-Q150 PolarHBondContact O-N 3.45Å
147	A	98.5	Very high	97.9	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.025	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-44.1	175	0	0	0	0	0	112	L135 A136 E143 R144 K145 Q150 S151	L135-A147 HydrophobicContact CB-CB 4.09Å; L135-A147 HydrophobicContact CD2-CB 4.02Å; L135-A147 HydrophobicContact CG-CB 4.03Å; A136-A147 HydrophobicContact CB-CB 3.91Å; E143-A147 WeakPolarHBondContact O-CB 3.41Å; E143-A147 PolarHBondContact O-N 2.89Å; R144-A147 PolarHBondContact O-N 2.87Å; K145-A147 PolarHBondContact O-N 3.24Å; A147-Q150 PolarHBondContact O-N 3.11Å; A147-S151 VanDerWaalsContact O-CB 3.31Å; A147-S151 WeakPolarHBondContact O-CB 3.15Å; A147-S151 PolarHBondContact O-N 3.34Å
148	A	98.7	Very high	98	Very high	9 Å²	9	61.3 Å²	61.3	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-43.4	176.5	0	0	0	0	0	112.3	R144 K145 E146 S151 L152 F183 I187 M188	R144-A148 WeakPolarHBondContact O-CB 3.37Å; R144-A148 PolarHBondContact O-N 2.96Å; K145-A148 PolarHBondContact O-N 2.74Å; E146-A148 PolarHBondContact O-N 3.11Å; A148-S151 PolarHBondContact O-N 3.16Å; A148-L152 WeakPolarHBondContact O-CB 3.11Å; A148-L152 PolarHBondContact O-N 3.13Å; A148-F183 HydrophobicContact CB-CE2 4.45Å; A148-F183 WeakPolarHBondContact O-CZ 3.48Å; A148-I187 HydrophobicContact CB-CG2 3.83Å; A148-M188 HydrophobicContact CB-SD 4.39Å
149	D	98.7	Very high	98.1	Very high	82 Å²	82	61.8 Å²	61.8	44%	0.439	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-41.9	178.5	-71.2	-19.7	0	0	0	111.3	K145 E146 K153	K145-D149 WeakPolarHBondContact O-CB 3.34Å; K145-D149 VanDerWaalsContact O-CG 3.27Å; K145-D149 PolarHBondContact O-N 3.15Å; E146-D149 PolarHBondContact O-N 3.39Å; D149-K153 WeakPolarHBondContact O-CB 3.22Å; D149-K153 PolarHBondContact O-N 3.33Å
150	Q	98.6	Very high	98.2	Very high	57 Å²	57	63.8 Å²	63.8	27%	0.266	34%	0.337	S	S	.	.	H	α-helix	trans	-68.7	-38.7	175.5	-67.1	-59.4	-31.6	0	0	112.4	Y132 E146 A147 K153 A154	Y132-Q150 HydrophobicContact CD1-CB 3.69Å; Y132-Q150 HydrophobicContact CD1-CG 4.38Å; Y132-Q150 HydrophobicContact CD2-CB 3.67Å; Y132-Q150 HydrophobicContact CE1-CB 3.72Å; Y132-Q150 HydrophobicContact CE1-CG 3.98Å; Y132-Q150 HydrophobicContact CE2-CB 3.69Å; Y132-Q150 HydrophobicContact CE2-CG 4.37Å; Y132-Q150 HydrophobicContact CG-CB 3.67Å; E146-Q150 WeakPolarHBondContact O-CG 3.36Å; E146-Q150 PolarHBondContact O-N 3.45Å; A147-Q150 PolarHBondContact O-N 3.11Å; Q150-K153 PolarHBondContact O-N 3.36Å; Q150-A154 WeakPolarHBondContact O-CB 3.41Å; Q150-A154 PolarHBondContact O-N 2.98Å
151	S	98.7	Very high	98.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-50.4	175.3	-173.6	0	0	0	0	110.9	G129 R133 A147 A148 K153 A154 Y155 F183	G129-S151 PolarHBondContact O-OG 2.9Å; R133-S151 PolarHBondContact N-OG 3.46Å; A147-S151 VanDerWaalsContact O-CB 3.31Å; A147-S151 WeakPolarHBondContact O-CB 3.15Å; A147-S151 PolarHBondContact O-N 3.34Å; A148-S151 PolarHBondContact O-N 3.16Å; S151-K153 PolarHBondContact O-N 3.19Å; S151-A154 PolarHBondContact O-N 2.86Å; S151-Y155 WeakPolarHBondContact O-CD2 3.34Å; S151-Y155 PolarHBondContact O-N 3.01Å; S151-Y155 WeakPolarHBondContact OG-CE2 3.18Å; S151-F183 WeakPolarHBondContact OG-CD2 3.3Å; S151-F183 WeakPolarHBondContact OG-CE2 3.11Å
152	L	98.7	Very high	98.3	Very high	33 Å²	33	57.6 Å²	57.6	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-56.5	-50	176.5	176.6	60.8	0	0	0	111.4	A148 A154 Y155 E156 F180 F183 Y184	A148-L152 WeakPolarHBondContact O-CB 3.11Å; A148-L152 PolarHBondContact O-N 3.13Å; L152-A154 VanDerWaalsContact C-N 3.32Å; L152-A154 PolarHBondContact O-N 3.2Å; L152-Y155 PolarHBondContact O-N 3.41Å; L152-E156 HydrophobicContact CD1-CG 4.09Å; L152-E156 HydrophobicContact CG-CG 4.47Å; L152-E156 WeakPolarHBondContact O-CG 3.4Å; L152-E156 PolarHBondContact O-N 3.43Å; L152-F180 HydrophobicContact CD1-CE2 3.77Å; L152-F180 HydrophobicContact CD1-CZ 3.73Å; L152-F183 HydrophobicContact CB-CE1 3.93Å; L152-F183 HydrophobicContact CB-CZ 3.92Å; L152-F183 HydrophobicContact CD1-CE1 4.1Å; L152-Y184 HydrophobicContact CD1-CE1 4.22Å; L152-Y184 WeakPolarHBondContact CD1-OH 3.44Å
153	K	98.7	Very high	98.2	Very high	116 Å²	116	56.1 Å²	56.1	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-57.5	-44.7	179.1	-177.7	-177	177.9	-175.1	0	112.1	D149 Q150 S151 E156 I157	D149-K153 WeakPolarHBondContact O-CB 3.22Å; D149-K153 PolarHBondContact O-N 3.33Å; Q150-K153 PolarHBondContact O-N 3.36Å; S151-K153 PolarHBondContact O-N 3.19Å; K153-E156 PolarHBondContact O-N 3.35Å; K153-I157 HydrophobicContact CG-CD1 4.13Å; K153-I157 VanDerWaalsContact O-CG1 3.3Å; K153-I157 WeakPolarHBondContact O-CG1 3.3Å; K153-I157 PolarHBondContact O-N 2.91Å; K153-I157 VanDerWaalsContact O-N 3.08Å
154	A	98.6	Very high	98.1	Very high	3 Å²	3	54.6 Å²	54.6	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-42.4	179.9	0	0	0	0	0	111.8	K128 Q150 S151 L152 I157 A158	K128-A154 HydrophobicContact CB-CB 3.99Å; K128-A154 HydrophobicContact CD-CB 4.28Å; K128-A154 HydrophobicContact CG-CB 3.97Å; Q150-A154 WeakPolarHBondContact O-CB 3.41Å; Q150-A154 PolarHBondContact O-N 2.98Å; S151-A154 PolarHBondContact O-N 2.86Å; L152-A154 VanDerWaalsContact C-N 3.32Å; L152-A154 PolarHBondContact O-N 3.2Å; A154-I157 PolarHBondContact O-N 2.55Å; A154-A158 WeakPolarHBondContact O-CB 3.34Å; A154-A158 PolarHBondContact O-N 3.42Å
155	Y	98.8	Very high	98	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-37.7	174.9	-71.6	-52.7	0	0	0	113.3	G129 D130 R133 S151 L152 A158 T159 L176 N179 F180 F183	G129-Y155 VanDerWaalsContact C-CZ 3.44Å; G129-Y155 PolarHBondContact O-OH 3.17Å; D130-Y155 WeakPolarHBondContact CA-OH 3.47Å; D130-Y155 PolarHBondContact N-OH 3.05Å; D130-Y155 PolarHBondContact OD1-OH 2.75Å; R133-Y155 PolarHBondContact NE-OH 3.48Å; S151-Y155 WeakPolarHBondContact O-CD2 3.34Å; S151-Y155 PolarHBondContact O-N 3.01Å; S151-Y155 WeakPolarHBondContact OG-CE2 3.18Å; L152-Y155 PolarHBondContact O-N 3.41Å; Y155-A158 PolarHBondContact O-N 3.31Å; Y155-T159 VanDerWaalsContact O-CB 3.3Å; Y155-T159 WeakPolarHBondContact O-CB 3.4Å; Y155-T159 PolarHBondContact O-N 3.25Å; Y155-T159 PolarHBondContact O-OG1 3.25Å; Y155-L176 HydrophobicContact CD1-CD1 3.6Å; Y155-L176 HydrophobicContact CE1-CD1 4.29Å; Y155-N179 HydrophobicContact CE1-CB 4.25Å; Y155-F180 HydrophobicContact CD1-CB 4.05Å; Y155-F180 HydrophobicContact CD1-CD2 4.42Å; Y155-F180 HydrophobicContact CD1-CG 4.25Å; Y155-F180 HydrophobicContact CD2-CB 4.41Å; Y155-F180 AromaticContact CD2-CD2 3.43Å; Y155-F180 HydrophobicContact CD2-CD2 3.43Å; Y155-F180 VanDerWaalsContact CD2-CD2 3.43Å; Y155-F180 AromaticContact CD2-CE2 3.81Å; Y155-F180 HydrophobicContact CD2-CE2 3.81Å; Y155-F180 HydrophobicContact CD2-CG 4.08Å; Y155-F180 HydrophobicContact CE1-CB 4.42Å; Y155-F180 HydrophobicContact CE2-CD2 4.19Å; Y155-F180 HydrophobicContact CG-CB 4.04Å; Y155-F180 HydrophobicContact CG-CD1 4.34Å; Y155-F180 AromaticContact CG-CD2 3.56Å; Y155-F180 HydrophobicContact CG-CD2 3.56Å; Y155-F180 AromaticContact CG-CE2 3.98Å; Y155-F180 HydrophobicContact CG-CE2 3.98Å; Y155-F180 AromaticContact CG-CG 3.76Å; Y155-F180 HydrophobicContact CG-CG 3.76Å; Y155-F183 HydrophobicContact CD2-CB 4.25Å; Y155-F183 HydrophobicContact CD2-CD1 4.26Å; Y155-F183 HydrophobicContact CD2-CG 4.13Å; Y155-F183 HydrophobicContact CE2-CB 3.66Å; Y155-F183 HydrophobicContact CE2-CD1 4.4Å; Y155-F183 HydrophobicContact CE2-CD2 4.16Å; Y155-F183 AromaticContact CE2-CG 3.81Å; Y155-F183 HydrophobicContact CE2-CG 3.81Å
156	E	98.5	Very high	97.9	Very high	89 Å²	89	49.8 Å²	49.8	42%	0.416	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-41.1	176.4	-73.9	177.6	162	0	0	111.8	L152 K153 T159 T160 F180	L152-E156 HydrophobicContact CD1-CG 4.09Å; L152-E156 HydrophobicContact CG-CG 4.47Å; L152-E156 WeakPolarHBondContact O-CG 3.4Å; L152-E156 PolarHBondContact O-N 3.43Å; K153-E156 PolarHBondContact O-N 3.35Å; E156-T159 PolarHBondContact O-N 3Å; E156-T160 WeakPolarHBondContact O-CB 3.3Å; E156-T160 PolarHBondContact O-N 2.98Å; E156-T160 PolarHBondContact O-OG1 3.08Å; E156-F180 HydrophobicContact CG-CZ 4.22Å
157	I	97.8	Very high	97.7	Very high	75 Å²	75	46.8 Å²	46.8	39%	0.385	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-47.9	173.1	-68.1	166.2	0	0	0	110.3	N125 K153 A154 T159 T160 A161	N125-I157 HydrophobicContact CB-CG2 4.28Å; K153-I157 HydrophobicContact CG-CD1 4.13Å; K153-I157 VanDerWaalsContact O-CG1 3.3Å; K153-I157 WeakPolarHBondContact O-CG1 3.3Å; K153-I157 PolarHBondContact O-N 2.91Å; K153-I157 VanDerWaalsContact O-N 3.08Å; A154-I157 PolarHBondContact O-N 2.55Å; I157-T159 VanDerWaalsContact C-N 3.32Å; I157-T159 PolarHBondContact O-N 3.43Å; I157-T160 PolarHBondContact O-N 3.44Å; I157-A161 WeakPolarHBondContact O-CB 3.36Å; I157-A161 PolarHBondContact O-N 3.16Å; I157-A161 VanDerWaalsContact O-N 3.08Å
158	A	98.2	Very high	97.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-40.9	178.3	0	0	0	0	0	111.8	V122 N125 K126 A154 Y155 A161 A162 L176	V122-A158 HydrophobicContact CG1-CB 4.46Å; N125-A158 HydrophobicContact CB-CB 3.78Å; K126-A158 HydrophobicContact CB-CB 4.49Å; A154-A158 WeakPolarHBondContact O-CB 3.34Å; A154-A158 PolarHBondContact O-N 3.42Å; Y155-A158 PolarHBondContact O-N 3.31Å; A158-A161 PolarHBondContact O-N 2.82Å; A158-A162 VanDerWaalsContact O-CB 3.27Å; A158-A162 WeakPolarHBondContact O-CB 3.32Å; A158-A162 PolarHBondContact O-N 3.19Å; A158-L176 VanDerWaalsContact C-CD2 3.43Å; A158-L176 HydrophobicContact CB-CD1 3.74Å; A158-L176 HydrophobicContact CB-CD2 3.69Å; A158-L176 HydrophobicContact CB-CG 4.38Å
159	T	98.4	Very high	97.6	Very high	28 Å²	28	47.2 Å²	47.2	17%	0.172	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-48.5	-178.5	-59.2	0	0	0	0	110.3	Y155 E156 I157 A161 A162 E163	Y155-T159 VanDerWaalsContact O-CB 3.3Å; Y155-T159 WeakPolarHBondContact O-CB 3.4Å; Y155-T159 PolarHBondContact O-N 3.25Å; Y155-T159 PolarHBondContact O-OG1 3.25Å; E156-T159 PolarHBondContact O-N 3Å; I157-T159 VanDerWaalsContact C-N 3.32Å; I157-T159 PolarHBondContact O-N 3.43Å; T159-A161 VanDerWaalsContact C-N 3.31Å; T159-A161 PolarHBondContact O-N 3.36Å; T159-A162 PolarHBondContact O-N 3.3Å; T159-A162 VanDerWaalsContact O-N 3.13Å; T159-E163 HydrophobicContact CG2-CG 4.4Å; T159-E163 WeakPolarHBondContact O-CG 3.36Å; T159-E163 PolarHBondContact O-N 3.47Å
160	T	97.6	Very high	97.4	Very high	93 Å²	93	44.9 Å²	44.9	57%	0.571	24%	0.241	S	C	*	.	H	α-helix	trans	-57.9	-44.5	177	-55.4	0	0	0	0	111.4	E156 I157 A164	E156-T160 WeakPolarHBondContact O-CB 3.3Å; E156-T160 PolarHBondContact O-N 2.98Å; E156-T160 PolarHBondContact O-OG1 3.08Å; I157-T160 PolarHBondContact O-N 3.44Å; T160-A164 WeakPolarHBondContact O-CB 3.49Å; T160-A164 PolarHBondContact O-N 3.48Å
161	A	97.1	Very high	97.2	Very high	19 Å²	19	43.5 Å²	43.5	16%	0.157	24%	0.237	C	C	.	.	H	α-helix	trans	-67.5	-38.4	177.9	0	0	0	0	0	112.3	T121 V122 I157 A158 T159 A164 K165	T121-A161 HydrophobicContact CG2-CB 4.16Å; V122-A161 HydrophobicContact CG2-CB 3.72Å; I157-A161 WeakPolarHBondContact O-CB 3.36Å; I157-A161 PolarHBondContact O-N 3.16Å; I157-A161 VanDerWaalsContact O-N 3.08Å; A158-A161 PolarHBondContact O-N 2.82Å; T159-A161 VanDerWaalsContact C-N 3.31Å; T159-A161 PolarHBondContact O-N 3.36Å; A161-A164 PolarHBondContact O-N 2.72Å; A161-K165 WeakPolarHBondContact O-CB 3.41Å; A161-K165 WeakPolarHBondContact O-CG 3.41Å; A161-K165 PolarHBondContact O-N 3.21Å; A161-K165 VanDerWaalsContact O-N 3.14Å
162	A	97.7	Very high	97.1	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	24%	0.244	C	C	.	.	H	α-helix	trans	-67.2	-45.9	179.4	0	0	0	0	0	111.8	V122 A158 T159 A164 K165 L166 R173 L176	V122-A162 HydrophobicContact CG1-CB 3.86Å; V122-A162 HydrophobicContact CG2-CB 3.93Å; A158-A162 VanDerWaalsContact O-CB 3.27Å; A158-A162 WeakPolarHBondContact O-CB 3.32Å; A158-A162 PolarHBondContact O-N 3.19Å; T159-A162 PolarHBondContact O-N 3.3Å; T159-A162 VanDerWaalsContact O-N 3.13Å; A162-A164 PolarHBondContact O-N 3.44Å; A162-K165 PolarHBondContact O-N 2.91Å; A162-L166 HydrophobicContact CB-CD1 4.32Å; A162-L166 WeakPolarHBondContact O-CA 3.47Å; A162-L166 WeakPolarHBondContact O-CB 3.37Å; A162-L166 PolarHBondContact O-N 3.15Å; A162-L166 VanDerWaalsContact O-O 3.08Å; A162-R173 HydrophobicContact CB-CB 4.26Å; A162-R173 HydrophobicContact CB-CG 4.05Å; A162-L176 HydrophobicContact CB-CD2 4.02Å
163	E	96.8	Very high	97	Very high	114 Å²	114	45.1 Å²	45.1	53%	0.533	24%	0.243	S	C	.	.	H	α-helix	trans	-60.8	-35.6	177.3	-72	174.2	171.6	0	0	112.2	T159	T159-E163 HydrophobicContact CG2-CG 4.4Å; T159-E163 WeakPolarHBondContact O-CG 3.36Å; T159-E163 PolarHBondContact O-N 3.47Å
164	A	96.2	Very high	97	Very high	75 Å²	75	39.7 Å²	39.7	62%	0.62	22%	0.22	S	C	*	.	H	α-helix	trans	-78.8	-26.2	-179.1	0	0	0	0	0	114.1	T160 A161 A162	T160-A164 WeakPolarHBondContact O-CB 3.49Å; T160-A164 PolarHBondContact O-N 3.48Å; A161-A164 PolarHBondContact O-N 2.72Å; A162-A164 PolarHBondContact O-N 3.44Å
165	K	95.7	Very high	96.9	Very high	112 Å²	112	39.9 Å²	39.9	49%	0.487	22%	0.222	S	C	.	.	H	α-helix	trans	-128.1	-19.4	-165	-57.8	-67.2	-172.8	162.4	0	115	E117 A161 A162	E117-K165 WeakPolarHBondContact OE2-CE 3.23Å; E117-K165 IonicContact OE2-NZ 3.32Å; E117-K165 PolarHBondContact OE2-NZ 3.43Å; A161-K165 WeakPolarHBondContact O-CB 3.41Å; A161-K165 WeakPolarHBondContact O-CG 3.41Å; A161-K165 PolarHBondContact O-N 3.21Å; A161-K165 VanDerWaalsContact O-N 3.14Å; A162-K165 PolarHBondContact O-N 2.91Å
166	L	95.3	Very high	96.9	Very high	11 Å²	11	40.1 Å²	40.1	6%	0.058	22%	0.223	C	C	.	.	S	Bend	trans	-120.7	135.2	-173.6	-54.7	-178.4	0	0	0	110.9	E119 V122 A162 H170 I172 R173	E119-L166 HydrophobicContact CG-CD2 3.69Å; V122-L166 HydrophobicContact CB-CD1 4.11Å; V122-L166 HydrophobicContact CG1-CD1 4.14Å; V122-L166 HydrophobicContact CG2-CD1 3.89Å; V122-L166 HydrophobicContact CG2-CG 4.49Å; A162-L166 HydrophobicContact CB-CD1 4.32Å; A162-L166 WeakPolarHBondContact O-CA 3.47Å; A162-L166 WeakPolarHBondContact O-CB 3.37Å; A162-L166 PolarHBondContact O-N 3.15Å; A162-L166 VanDerWaalsContact O-O 3.08Å; L166-H170 HydrophobicContact CB-CB 3.97Å; L166-I172 HydrophobicContact CD1-CB 4.31Å; L166-I172 HydrophobicContact CD1-CG2 4.35Å; L166-R173 HydrophobicContact CB-CB 4.29Å; L166-R173 HydrophobicContact CD1-CB 4.36Å; L166-R173 PolarHBondContact O-NH1 3.37Å
167	P	95.6	Very high	96.9	Very high	62 Å²	62	36.3 Å²	36.3	40%	0.403	21%	0.207	S	C	.	.			trans	-63.4	153.8	174.1	27.3	-33.4	0	0	0	110.8	T169 H170 R173	P167-T169 PolarHBondContact O-N 3.48Å; P167-T169 VanDerWaalsContact O-N 3.07Å; P167-H170 HydrophobicContact CG-CB 4.05Å; P167-H170 WeakPolarHBondContact O-CB 3.4Å; P167-H170 PolarHBondContact O-N 2.78Å; P167-R173 WeakPolarHBondContact O-CD 3.33Å
168	P	96.9	Very high	96.9	Very high	17 Å²	17	32.8 Å²	32.8	11%	0.11	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-29.4	178	-27.3	34.9	0	0	0	114.6	H170 E204 E208	P168-H170 VanDerWaalsContact C-N 3.32Å; P168-E204 HydrophobicContact CB-CB 3.81Å; P168-E204 HydrophobicContact CG-CB 4.29Å; P168-E208 WeakPolarHBondContact CD-OE2 3.42Å
169	T	96.2	Very high	96.9	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.018	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.4	179.1	49.5	0	0	0	0	114.2	P167 A205 E208 L212 S220	P167-T169 PolarHBondContact O-N 3.48Å; P167-T169 VanDerWaalsContact O-N 3.07Å; T169-A205 HydrophobicContact CG2-CB 4.35Å; T169-A205 WeakPolarHBondContact CG2-O 3.48Å; T169-E208 HydrophobicContact CG2-CB 3.74Å; T169-L212 HydrophobicContact CG2-CD1 4.39Å; T169-L212 HydrophobicContact CG2-CG 4.38Å; T169-S220 WeakPolarHBondContact O-CB 3.34Å; T169-S220 PolarHBondContact O-OG 3.3Å
170	H	94.9	Very high	96.9	Very high	33 Å²	33	31.9 Å²	31.9	15%	0.153	18%	0.182	C	C	.	.			trans	-69.5	129.5	-178	-166.7	-73.7	0	0	0	111.5	E119 L166 P167 P168 I172 R173 L174	E119-H170 IonicContact OE1-NE2 2.62Å; E119-H170 PolarHBondContact OE1-NE2 3.48Å; L166-H170 HydrophobicContact CB-CB 3.97Å; P167-H170 HydrophobicContact CG-CB 4.05Å; P167-H170 WeakPolarHBondContact O-CB 3.4Å; P167-H170 PolarHBondContact O-N 2.78Å; P168-H170 VanDerWaalsContact C-N 3.32Å; H170-I172 VanDerWaalsContact C-N 3.34Å; H170-I172 PolarHBondContact ND1-N 2.89Å; H170-I172 VanDerWaalsContact ND1-N 3.16Å; H170-I172 PolarHBondContact O-N 2.59Å; H170-R173 HydrophobicContact CB-CB 4.21Å; H170-R173 PolarHBondContact O-N 3.34Å; H170-L174 PolarHBondContact O-N 3.17Å
171	P	95.2	Very high	97	Very high	28 Å²	28	27.4 Å²	27.4	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-53.8	-43.9	-177.2	-28.3	33.5	0	0	0	114.1	R173 L174 G175 D219 S220 I223	P171-R173 VanDerWaalsContact C-N 3.35Å; P171-R173 PolarHBondContact O-N 3.07Å; P171-L174 PolarHBondContact O-N 2.98Å; P171-G175 PolarHBondContact O-N 2.72Å; P171-D219 HydrophobicContact CB-CB 4.21Å; P171-D219 HydrophobicContact CG-CB 3.96Å; P171-S220 WeakPolarHBondContact CG-OG 3.46Å; P171-I223 HydrophobicContact CB-CD1 4.01Å; P171-I223 WeakPolarHBondContact O-CD1 3.43Å
172	I	95.7	Very high	97	Very high	29 Å²	29	26.6 Å²	26.6	15%	0.149	15%	0.148	C	C	.	.	H	α-helix	trans	-60.6	-40	176.5	-60.2	176.1	0	0	0	112.4	E119 V122 F123 L166 H170 L176	E119-I172 HydrophobicContact CB-CD1 4.11Å; E119-I172 HydrophobicContact CG-CD1 4.28Å; V122-I172 HydrophobicContact CB-CG2 4.07Å; V122-I172 HydrophobicContact CG1-CG2 3.59Å; F123-I172 HydrophobicContact CB-CD1 4.44Å; F123-I172 HydrophobicContact CD2-CD1 4.11Å; F123-I172 HydrophobicContact CD2-CG1 4.43Å; L166-I172 HydrophobicContact CD1-CB 4.31Å; L166-I172 HydrophobicContact CD1-CG2 4.35Å; H170-I172 VanDerWaalsContact C-N 3.34Å; H170-I172 PolarHBondContact ND1-N 2.89Å; H170-I172 VanDerWaalsContact ND1-N 3.16Å; H170-I172 PolarHBondContact O-N 2.59Å; I172-L176 WeakPolarHBondContact O-CB 3.29Å; I172-L176 PolarHBondContact O-N 2.93Å
173	R	97.4	Very high	97.1	Very high	39 Å²	39	26.5 Å²	26.5	15%	0.147	15%	0.147	C	C	.	.	H	α-helix	trans	-69.6	-43.6	179.2	176.9	173	169.7	172.6	-4.2	110.9	A162 L166 P167 H170 P171 L176 A177 E204	A162-R173 HydrophobicContact CB-CB 4.26Å; A162-R173 HydrophobicContact CB-CG 4.05Å; L166-R173 HydrophobicContact CB-CB 4.29Å; L166-R173 HydrophobicContact CD1-CB 4.36Å; L166-R173 PolarHBondContact O-NH1 3.37Å; P167-R173 WeakPolarHBondContact O-CD 3.33Å; H170-R173 HydrophobicContact CB-CB 4.21Å; H170-R173 PolarHBondContact O-N 3.34Å; P171-R173 VanDerWaalsContact C-N 3.35Å; P171-R173 PolarHBondContact O-N 3.07Å; R173-L176 WeakPolarHBondContact O-CB 3.26Å; R173-L176 PolarHBondContact O-N 3.36Å; R173-A177 PolarHBondContact O-N 3.5Å; R173-E204 IonicContact CZ-OE2 3.88Å; R173-E204 IonicContact NH2-OE2 3.75Å; R173-E204 PolarHBondContact NH2-OE2 2.93Å
174	L	98	Very high	97.1	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-46.1	174.2	-75.5	171	0	0	0	111.7	H170 P171 L176 A177 L178 A205 I223 M224 L227	H170-L174 PolarHBondContact O-N 3.17Å; P171-L174 PolarHBondContact O-N 2.98Å; L174-L176 VanDerWaalsContact C-N 3.28Å; L174-L176 PolarHBondContact O-N 2.96Å; L174-A177 PolarHBondContact O-N 3.16Å; L174-A177 VanDerWaalsContact O-N 3.17Å; L174-L178 PolarHBondContact O-N 3.34Å; L174-A205 HydrophobicContact CD1-CB 4.42Å; L174-A205 HydrophobicContact CD2-CB 3.72Å; L174-A205 HydrophobicContact CG-CB 4.49Å; L174-I223 HydrophobicContact CB-CB 4.15Å; L174-I223 HydrophobicContact CB-CD1 4.35Å; L174-I223 HydrophobicContact CB-CG2 3.63Å; L174-M224 HydrophobicContact CD1-CG 4.01Å; L174-M224 HydrophobicContact CD2-CG 4.08Å; L174-L227 HydrophobicContact CD2-CD1 4.01Å
175	G	97.6	Very high	97.2	Very high	7 Å²	7	19 Å²	19	7%	0.072	10%	0.098	C	C	.	.	H	α-helix	trans	-64.6	-33.4	178.2	0	0	0	0	0	112.5	K126 P171 N179	K126-G175 WeakPolarHBondContact CE-O 3.23Å; P171-G175 PolarHBondContact O-N 2.72Å; G175-N179 PolarHBondContact O-N 2.89Å; G175-N179 VanDerWaalsContact O-N 3.07Å
176	L	98.5	Very high	97.2	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-63	-49.8	170.5	169.3	63.2	0	0	0	111.2	V122 K126 Y155 A158 A162 I172 R173 L174 L178 N179 F180	V122-L176 HydrophobicContact CG1-CD2 4.05Å; K126-L176 HydrophobicContact CB-CD1 4.07Å; K126-L176 HydrophobicContact CD-CB 4.08Å; K126-L176 HydrophobicContact CG-CB 4.3Å; K126-L176 HydrophobicContact CG-CD1 4.01Å; Y155-L176 HydrophobicContact CD1-CD1 3.6Å; Y155-L176 HydrophobicContact CE1-CD1 4.29Å; A158-L176 VanDerWaalsContact C-CD2 3.43Å; A158-L176 HydrophobicContact CB-CD1 3.74Å; A158-L176 HydrophobicContact CB-CD2 3.69Å; A158-L176 HydrophobicContact CB-CG 4.38Å; A162-L176 HydrophobicContact CB-CD2 4.02Å; I172-L176 WeakPolarHBondContact O-CB 3.29Å; I172-L176 PolarHBondContact O-N 2.93Å; R173-L176 WeakPolarHBondContact O-CB 3.26Å; R173-L176 PolarHBondContact O-N 3.36Å; L174-L176 VanDerWaalsContact C-N 3.28Å; L174-L176 PolarHBondContact O-N 2.96Å; L176-L178 VanDerWaalsContact C-N 3.3Å; L176-L178 PolarHBondContact O-N 2.95Å; L176-N179 PolarHBondContact O-N 3.34Å; L176-F180 VanDerWaalsContact O-CB 3.22Å; L176-F180 WeakPolarHBondContact O-CB 3.28Å; L176-F180 PolarHBondContact O-N 2.97Å
177	A	98.5	Very high	97.3	Very high	10 Å²	10	16.1 Å²	16.1	8%	0.083	9%	0.087	C	C	.	.	H	α-helix	trans	-60.5	-41.3	178.5	0	0	0	0	0	111.9	R173 L174 S181 A201	R173-A177 PolarHBondContact O-N 3.5Å; L174-A177 PolarHBondContact O-N 3.16Å; L174-A177 VanDerWaalsContact O-N 3.17Å; A177-S181 VanDerWaalsContact O-CB 3.27Å; A177-S181 WeakPolarHBondContact O-CB 3.43Å; A177-S181 PolarHBondContact O-N 3.44Å; A177-S181 PolarHBondContact O-OG 3.35Å; A177-A201 HydrophobicContact CB-CB 3.38Å
178	L	98.4	Very high	97.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-56.3	-56.2	174.6	179.5	63.9	0	0	0	111	L174 L176 F180 S181 V182 I223 L226 L227 N230 A257	L174-L178 PolarHBondContact O-N 3.34Å; L176-L178 VanDerWaalsContact C-N 3.3Å; L176-L178 PolarHBondContact O-N 2.95Å; L178-F180 PolarHBondContact O-N 3.16Å; L178-S181 PolarHBondContact O-N 3.46Å; L178-S181 PolarHBondContact O-OG 3.39Å; L178-V182 WeakPolarHBondContact O-CG2 3.39Å; L178-V182 PolarHBondContact O-N 2.95Å; L178-V182 VanDerWaalsContact O-N 3.11Å; L178-I223 HydrophobicContact CB-CG2 4.3Å; L178-I223 HydrophobicContact CD2-CG2 4.14Å; L178-L226 HydrophobicContact CD1-CB 3.99Å; L178-L226 HydrophobicContact CD2-CB 3.86Å; L178-L226 HydrophobicContact CD2-CD1 3.65Å; L178-L226 HydrophobicContact CD2-CG 4.43Å; L178-L227 HydrophobicContact CB-CD2 3.95Å; L178-L227 HydrophobicContact CB-CG 4.25Å; L178-L227 HydrophobicContact CD1-CD2 3.9Å; L178-L227 HydrophobicContact CD1-CG 4.08Å; L178-N230 VanDerWaalsContact CD1-ND2 3.3Å; L178-N230 WeakPolarHBondContact CD1-ND2 3.43Å; L178-A257 WeakPolarHBondContact CD1-O 3.42Å
179	N	98.1	Very high	97.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.9	-35.6	-175.8	-74.7	10	0	0	0	113.1	K126 D130 Y155 G175 L176 V182 F183 G259	K126-N179 PolarHBondContact NZ-ND2 2.95Å; D130-N179 VanDerWaalsContact OD1-CB 3.27Å; D130-N179 WeakPolarHBondContact OD1-CB 3.42Å; D130-N179 VanDerWaalsContact OD1-CG 3.31Å; D130-N179 PolarHBondContact OD1-ND2 3.45Å; D130-N179 PolarHBondContact OD2-ND2 3.34Å; Y155-N179 HydrophobicContact CE1-CB 4.25Å; G175-N179 PolarHBondContact O-N 2.89Å; G175-N179 VanDerWaalsContact O-N 3.07Å; L176-N179 PolarHBondContact O-N 3.34Å; N179-V182 PolarHBondContact O-N 2.96Å; N179-F183 PolarHBondContact O-N 3.36Å; N179-G259 WeakPolarHBondContact OD1-CA 3.42Å; N179-G259 PolarHBondContact OD1-N 3.46Å
180	F	98.7	Very high	97.4	Very high	9 Å²	9	23.7 Å²	23.7	4%	0.039	13%	0.125	C	C	.	.	H	α-helix	trans	-71.9	-32.4	177.8	-167.3	-168	0	0	0	111.8	L152 Y155 E156 L176 L178 F183 Y184 L197	L152-F180 HydrophobicContact CD1-CE2 3.77Å; L152-F180 HydrophobicContact CD1-CZ 3.73Å; Y155-F180 HydrophobicContact CD1-CB 4.05Å; Y155-F180 HydrophobicContact CD1-CD2 4.42Å; Y155-F180 HydrophobicContact CD1-CG 4.25Å; Y155-F180 HydrophobicContact CD2-CB 4.41Å; Y155-F180 AromaticContact CD2-CD2 3.43Å; Y155-F180 HydrophobicContact CD2-CD2 3.43Å; Y155-F180 VanDerWaalsContact CD2-CD2 3.43Å; Y155-F180 AromaticContact CD2-CE2 3.81Å; Y155-F180 HydrophobicContact CD2-CE2 3.81Å; Y155-F180 HydrophobicContact CD2-CG 4.08Å; Y155-F180 HydrophobicContact CE1-CB 4.42Å; Y155-F180 HydrophobicContact CE2-CD2 4.19Å; Y155-F180 HydrophobicContact CG-CB 4.04Å; Y155-F180 HydrophobicContact CG-CD1 4.34Å; Y155-F180 AromaticContact CG-CD2 3.56Å; Y155-F180 HydrophobicContact CG-CD2 3.56Å; Y155-F180 AromaticContact CG-CE2 3.98Å; Y155-F180 HydrophobicContact CG-CE2 3.98Å; Y155-F180 AromaticContact CG-CG 3.76Å; Y155-F180 HydrophobicContact CG-CG 3.76Å; E156-F180 HydrophobicContact CG-CZ 4.22Å; L176-F180 VanDerWaalsContact O-CB 3.22Å; L176-F180 WeakPolarHBondContact O-CB 3.28Å; L176-F180 PolarHBondContact O-N 2.97Å; L178-F180 PolarHBondContact O-N 3.16Å; F180-F183 HydrophobicContact CD2-CB 4.24Å; F180-F183 AromaticContact CD2-CD1 3.76Å; F180-F183 HydrophobicContact CD2-CD1 3.76Å; F180-F183 HydrophobicContact CD2-CG 4.37Å; F180-F183 AromaticContact CE2-CD1 3.71Å; F180-F183 HydrophobicContact CE2-CD1 3.71Å; F180-F183 HydrophobicContact CE2-CE1 4.15Å; F180-F183 WeakPolarHBondContact O-CB 3.28Å; F180-F183 PolarHBondContact O-N 3.26Å; F180-Y184 HydrophobicContact CD1-CE2 4.25Å; F180-Y184 HydrophobicContact CD2-CD2 4Å; F180-Y184 AromaticContact CD2-CE2 3.64Å; F180-Y184 HydrophobicContact CD2-CE2 3.64Å; F180-Y184 AromaticContact CE1-CE2 3.99Å; F180-Y184 HydrophobicContact CE1-CE2 3.99Å; F180-Y184 HydrophobicContact CE2-CD2 4.08Å; F180-Y184 HydrophobicContact CE2-CE1 4.2Å; F180-Y184 AromaticContact CE2-CE2 3.34Å; F180-Y184 HydrophobicContact CE2-CE2 3.34Å; F180-Y184 AromaticContact CE2-CZ 3.39Å; F180-Y184 WeakPolarHBondContact CE2-OH 3.44Å; F180-Y184 HydrophobicContact CG-CD2 4.49Å; F180-Y184 HydrophobicContact CG-CE2 4.1Å; F180-Y184 AromaticContact CZ-CE2 3.55Å; F180-Y184 HydrophobicContact CZ-CE2 3.55Å; F180-Y184 AromaticContact CZ-CZ 3.52Å; F180-Y184 WeakPolarHBondContact CZ-OH 3.4Å; F180-Y184 VanDerWaalsContact O-CD2 3.3Å; F180-Y184 WeakPolarHBondContact O-CD2 3.4Å; F180-Y184 PolarHBondContact O-N 3.42Å; F180-L197 HydrophobicContact CB-CD2 3.79Å; F180-L197 HydrophobicContact CD1-CD2 3.66Å; F180-L197 HydrophobicContact CE1-CD2 4.46Å; F180-L197 HydrophobicContact CG-CD2 3.73Å
181	S	98.4	Very high	97.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.5	-41.9	171.4	72.1	0	0	0	0	111.7	A177 L178 F183 Y184 Y185 A194 W234	A177-S181 VanDerWaalsContact O-CB 3.27Å; A177-S181 WeakPolarHBondContact O-CB 3.43Å; A177-S181 PolarHBondContact O-N 3.44Å; A177-S181 PolarHBondContact O-OG 3.35Å; L178-S181 PolarHBondContact O-N 3.46Å; L178-S181 PolarHBondContact O-OG 3.39Å; S181-F183 VanDerWaalsContact C-N 3.32Å; S181-F183 PolarHBondContact O-N 3.12Å; S181-Y184 PolarHBondContact O-N 3.33Å; S181-Y184 VanDerWaalsContact O-N 3.17Å; S181-Y185 PolarHBondContact O-N 3.47Å; S181-A194 VanDerWaalsContact O-CB 3.22Å; S181-A194 WeakPolarHBondContact O-CB 3.23Å; S181-W234 WeakPolarHBondContact OG-CH2 3.42Å
182	V	97.9	Very high	97.4	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-40.7	173.7	175.9	0	0	0	0	110.9	L178 N179 Y184 Y185 E186 W234	L178-V182 WeakPolarHBondContact O-CG2 3.39Å; L178-V182 PolarHBondContact O-N 2.95Å; L178-V182 VanDerWaalsContact O-N 3.11Å; N179-V182 PolarHBondContact O-N 2.96Å; V182-Y184 PolarHBondContact O-N 3.24Å; V182-Y185 PolarHBondContact O-N 3.5Å; V182-E186 VanDerWaalsContact CG1-CD 3.47Å; V182-E186 HydrophobicContact CG1-CG 3.99Å; V182-E186 WeakPolarHBondContact O-CB 3.33Å; V182-E186 PolarHBondContact O-N 2.67Å; V182-W234 HydrophobicContact CG2-CH2 4.01Å; V182-W234 HydrophobicContact CG2-CZ2 4.03Å
183	F	98.5	Very high	97.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.8	-48.7	172.5	171	-103.3	0	0	0	112.4	R133 A148 S151 L152 Y155 N179 F180 S181 Y185 I187 M188	R133-F183 HydrophobicContact CB-CD2 4.19Å; R133-F183 HydrophobicContact CG-CD2 4.3Å; A148-F183 HydrophobicContact CB-CE2 4.45Å; A148-F183 WeakPolarHBondContact O-CZ 3.48Å; S151-F183 WeakPolarHBondContact OG-CD2 3.3Å; S151-F183 WeakPolarHBondContact OG-CE2 3.11Å; L152-F183 HydrophobicContact CB-CE1 3.93Å; L152-F183 HydrophobicContact CB-CZ 3.92Å; L152-F183 HydrophobicContact CD1-CE1 4.1Å; Y155-F183 HydrophobicContact CD2-CB 4.25Å; Y155-F183 HydrophobicContact CD2-CD1 4.26Å; Y155-F183 HydrophobicContact CD2-CG 4.13Å; Y155-F183 HydrophobicContact CE2-CB 3.66Å; Y155-F183 HydrophobicContact CE2-CD1 4.4Å; Y155-F183 HydrophobicContact CE2-CD2 4.16Å; Y155-F183 AromaticContact CE2-CG 3.81Å; Y155-F183 HydrophobicContact CE2-CG 3.81Å; N179-F183 PolarHBondContact O-N 3.36Å; F180-F183 HydrophobicContact CD2-CB 4.24Å; F180-F183 AromaticContact CD2-CD1 3.76Å; F180-F183 HydrophobicContact CD2-CD1 3.76Å; F180-F183 HydrophobicContact CD2-CG 4.37Å; F180-F183 AromaticContact CE2-CD1 3.71Å; F180-F183 HydrophobicContact CE2-CD1 3.71Å; F180-F183 HydrophobicContact CE2-CE1 4.15Å; F180-F183 WeakPolarHBondContact O-CB 3.28Å; F180-F183 PolarHBondContact O-N 3.26Å; S181-F183 VanDerWaalsContact C-N 3.32Å; S181-F183 PolarHBondContact O-N 3.12Å; F183-Y185 VanDerWaalsContact C-N 3.29Å; F183-Y185 PolarHBondContact O-N 2.91Å; F183-I187 HydrophobicContact CD2-CB 3.75Å; F183-I187 HydrophobicContact CD2-CG1 3.87Å; F183-I187 HydrophobicContact CD2-CG2 4.17Å; F183-I187 HydrophobicContact CE2-CB 3.79Å; F183-I187 HydrophobicContact CE2-CG1 4.26Å; F183-I187 HydrophobicContact CE2-CG2 3.7Å; F183-I187 WeakPolarHBondContact O-CB 3.43Å; F183-I187 PolarHBondContact O-N 3Å; F183-M188 HydrophobicContact CD1-CG 3.94Å; F183-M188 HydrophobicContact CE1-CG 3.3Å; F183-M188 HydrophobicContact CE1-SD 3.92Å; F183-M188 HydrophobicContact CE2-CG 4.24Å; F183-M188 HydrophobicContact CE2-SD 4.37Å; F183-M188 HydrophobicContact CZ-CG 3.48Å; F183-M188 VanDerWaalsContact CZ-CG 3.48Å; F183-M188 HydrophobicContact CZ-SD 3.55Å; F183-M188 VanDerWaalsContact CZ-SD 3.55Å; F183-M188 PolarHBondContact O-N 2.88Å; F183-M188 VanDerWaalsContact O-N 3.15Å
184	Y	98.4	Very high	97.4	Very high	9 Å²	9	30.8 Å²	30.8	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-61.8	-40	179.4	-80.8	-55.2	0	0	0	112.1	L152 F180 S181 V182 M188 N189 A190 R193 L197	L152-Y184 HydrophobicContact CD1-CE1 4.22Å; L152-Y184 WeakPolarHBondContact CD1-OH 3.44Å; F180-Y184 HydrophobicContact CD1-CE2 4.25Å; F180-Y184 HydrophobicContact CD2-CD2 4Å; F180-Y184 AromaticContact CD2-CE2 3.64Å; F180-Y184 HydrophobicContact CD2-CE2 3.64Å; F180-Y184 AromaticContact CE1-CE2 3.99Å; F180-Y184 HydrophobicContact CE1-CE2 3.99Å; F180-Y184 HydrophobicContact CE2-CD2 4.08Å; F180-Y184 HydrophobicContact CE2-CE1 4.2Å; F180-Y184 AromaticContact CE2-CE2 3.34Å; F180-Y184 HydrophobicContact CE2-CE2 3.34Å; F180-Y184 AromaticContact CE2-CZ 3.39Å; F180-Y184 WeakPolarHBondContact CE2-OH 3.44Å; F180-Y184 HydrophobicContact CG-CD2 4.49Å; F180-Y184 HydrophobicContact CG-CE2 4.1Å; F180-Y184 AromaticContact CZ-CE2 3.55Å; F180-Y184 HydrophobicContact CZ-CE2 3.55Å; F180-Y184 AromaticContact CZ-CZ 3.52Å; F180-Y184 WeakPolarHBondContact CZ-OH 3.4Å; F180-Y184 VanDerWaalsContact O-CD2 3.3Å; F180-Y184 WeakPolarHBondContact O-CD2 3.4Å; F180-Y184 PolarHBondContact O-N 3.42Å; S181-Y184 PolarHBondContact O-N 3.33Å; S181-Y184 VanDerWaalsContact O-N 3.17Å; V182-Y184 PolarHBondContact O-N 3.24Å; Y184-M188 HydrophobicContact CD1-CB 4.12Å; Y184-M188 HydrophobicContact CD1-CG 4.04Å; Y184-M188 HydrophobicContact CE1-CG 4.49Å; Y184-M188 CarbonylContact O-C 3.59Å; Y184-M188 WeakPolarHBondContact O-CB 3.45Å; Y184-N189 PolarHBondContact O-N 3.17Å; Y184-N189 VanDerWaalsContact O-N 3.17Å; Y184-A190 PolarHBondContact O-N 3.34Å; Y184-R193 HydrophobicContact CD1-CB 4.47Å; Y184-R193 HydrophobicContact CD1-CG 4.04Å; Y184-R193 HydrophobicContact CD2-CG 4.04Å; Y184-R193 VanDerWaalsContact CE1-CD 3.46Å; Y184-R193 HydrophobicContact CE1-CG 4.16Å; Y184-R193 VanDerWaalsContact CE1-NE 3.33Å; Y184-R193 HydrophobicContact CE2-CG 4.1Å; Y184-R193 HydrophobicContact CG-CB 4.37Å; Y184-R193 HydrophobicContact CG-CG 4.01Å; Y184-R193 VanDerWaalsContact CZ-CZ 3.49Å; Y184-R193 PolarHBondContact OH-NE 3.1Å; Y184-R193 PolarHBondContact OH-NH2 3.39Å; Y184-L197 HydrophobicContact CD2-CD2 4Å; Y184-L197 HydrophobicContact CE2-CD2 3.99Å
185	Y	97.5	Very high	97.4	Very high	22 Å²	22	31.4 Å²	31.4	9%	0.086	16%	0.157	C	C	.	.	H	α-helix	trans	-70.1	-58.3	179	-175.4	-93.6	0	0	0	111.5	S181 V182 F183 N189 P191 W234 D237 A253	S181-Y185 PolarHBondContact O-N 3.47Å; V182-Y185 PolarHBondContact O-N 3.5Å; F183-Y185 VanDerWaalsContact C-N 3.29Å; F183-Y185 PolarHBondContact O-N 2.91Å; Y185-N189 WeakPolarHBondContact O-CA 3.28Å; Y185-N189 PolarHBondContact O-N 2.86Å; Y185-P191 HydrophobicContact CD2-CB 3.89Å; Y185-P191 HydrophobicContact CE2-CB 4.09Å; Y185-W234 AromaticContact CD1-CD1 3.9Å; Y185-W234 AromaticContact CD1-CE2 3.92Å; Y185-W234 HydrophobicContact CD1-CZ2 4.38Å; Y185-W234 AromaticContact CD1-NE1 3.41Å; Y185-W234 HydrophobicContact CD2-CB 3.99Å; Y185-W234 AromaticContact CD2-CD1 3.4Å; Y185-W234 VanDerWaalsContact CD2-CD1 3.4Å; Y185-W234 AromaticContact CD2-CD2 3.78Å; Y185-W234 HydrophobicContact CD2-CD2 3.78Å; Y185-W234 AromaticContact CD2-CE2 3.86Å; Y185-W234 AromaticContact CD2-CG 3.45Å; Y185-W234 HydrophobicContact CD2-CG 3.45Å; Y185-W234 VanDerWaalsContact CD2-CG 3.45Å; Y185-W234 AromaticContact CD2-NE1 3.63Å; Y185-W234 AromaticContact CE1-CD1 3.66Å; Y185-W234 AromaticContact CE1-NE1 3.49Å; Y185-W234 HydrophobicContact CE2-CB 3.79Å; Y185-W234 AromaticContact CE2-CD1 3.12Å; Y185-W234 HydrophobicContact CE2-CD2 4.25Å; Y185-W234 AromaticContact CE2-CG 3.46Å; Y185-W234 HydrophobicContact CE2-CG 3.46Å; Y185-W234 VanDerWaalsContact CE2-CG 3.46Å; Y185-W234 AromaticContact CE2-NE1 3.71Å; Y185-W234 AromaticContact CG-CD1 3.79Å; Y185-W234 HydrophobicContact CG-CD2 4.01Å; Y185-W234 AromaticContact CG-CE2 3.62Å; Y185-W234 HydrophobicContact CG-CG 4.07Å; Y185-W234 HydrophobicContact CG-CZ2 4.11Å; Y185-W234 AromaticContact CG-NE1 3.49Å; Y185-W234 AromaticContact CZ-CD1 3.26Å; Y185-W234 AromaticContact CZ-NE1 3.63Å; Y185-D237 PolarHBondContact OH-OD2 2.81Å; Y185-A253 HydrophobicContact CE1-CB 4.02Å; Y185-A253 WeakPolarHBondContact OH-CB 3.31Å
186	E	95.6	Very high	97.4	Very high	46 Å²	46	37 Å²	37	22%	0.215	18%	0.181	C	C	.	.	H	α-helix	trans	-81.2	-34.5	-168.4	-62	-174.9	172.1	0	0	114.3	V182 P255 G256	V182-E186 VanDerWaalsContact CG1-CD 3.47Å; V182-E186 HydrophobicContact CG1-CG 3.99Å; V182-E186 WeakPolarHBondContact O-CB 3.33Å; V182-E186 PolarHBondContact O-N 2.67Å; E186-P255 WeakPolarHBondContact OE1-CA 3.43Å; E186-P255 WeakPolarHBondContact OE1-CB 3.38Å; E186-G256 PolarHBondContact OE1-N 3Å
187	I	97.6	Very high	97.4	Very high	18 Å²	18	38.3 Å²	38.3	9%	0.092	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-46.2	-173.8	-54.6	-53.4	0	0	0	111.4	R133 A136 E137 A148 F183	R133-I187 HydrophobicContact CG-CD1 4.36Å; R133-I187 HydrophobicContact CG-CG1 3.82Å; A136-I187 HydrophobicContact CB-CD1 4.17Å; A136-I187 HydrophobicContact CB-CG1 4.44Å; A136-I187 HydrophobicContact CB-CG2 3.79Å; E137-I187 HydrophobicContact CG-CD1 4.01Å; A148-I187 HydrophobicContact CB-CG2 3.83Å; F183-I187 HydrophobicContact CD2-CB 3.75Å; F183-I187 HydrophobicContact CD2-CG1 3.87Å; F183-I187 HydrophobicContact CD2-CG2 4.17Å; F183-I187 HydrophobicContact CE2-CB 3.79Å; F183-I187 HydrophobicContact CE2-CG1 4.26Å; F183-I187 HydrophobicContact CE2-CG2 3.7Å; F183-I187 WeakPolarHBondContact O-CB 3.43Å; F183-I187 PolarHBondContact O-N 3Å
188	M	97.6	Very high	97.3	Very high	78 Å²	78	37.9 Å²	37.9	38%	0.384	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-8.5	-177.7	-59.9	-59.3	-62.3	0	0	113.4	A148 F183 Y184 A190	A148-M188 HydrophobicContact CB-SD 4.39Å; F183-M188 HydrophobicContact CD1-CG 3.94Å; F183-M188 HydrophobicContact CE1-CG 3.3Å; F183-M188 HydrophobicContact CE1-SD 3.92Å; F183-M188 HydrophobicContact CE2-CG 4.24Å; F183-M188 HydrophobicContact CE2-SD 4.37Å; F183-M188 HydrophobicContact CZ-CG 3.48Å; F183-M188 VanDerWaalsContact CZ-CG 3.48Å; F183-M188 HydrophobicContact CZ-SD 3.55Å; F183-M188 VanDerWaalsContact CZ-SD 3.55Å; F183-M188 PolarHBondContact O-N 2.88Å; F183-M188 VanDerWaalsContact O-N 3.15Å; Y184-M188 HydrophobicContact CD1-CB 4.12Å; Y184-M188 HydrophobicContact CD1-CG 4.04Å; Y184-M188 HydrophobicContact CE1-CG 4.49Å; Y184-M188 CarbonylContact O-C 3.59Å; Y184-M188 WeakPolarHBondContact O-CB 3.45Å; M188-A190 HydrophobicContact CB-CB 4.21Å; M188-A190 PolarHBondContact O-N 3.01Å
189	N	95.8	Very high	97.3	Very high	139 Å²	139	43.6 Å²	43.6	74%	0.743	21%	0.209	S	C	*	.			trans	50	45.5	-176.8	-165.5	70.2	0	0	0	111.8	Y184 Y185 P191	Y184-N189 PolarHBondContact O-N 3.17Å; Y184-N189 VanDerWaalsContact O-N 3.17Å; Y185-N189 WeakPolarHBondContact O-CA 3.28Å; Y185-N189 PolarHBondContact O-N 2.86Å; N189-P191 VanDerWaalsContact C-CD 3.47Å; N189-P191 WeakPolarHBondContact O-CD 3.14Å
190	A	96.7	Very high	97.3	Very high	24 Å²	24	47 Å²	47	20%	0.198	23%	0.225	C	C	.	.			trans	-123.6	68.4	-175.1	0	0	0	0	0	110.2	Y184 M188 E192 R193 A194	Y184-A190 PolarHBondContact O-N 3.34Å; M188-A190 HydrophobicContact CB-CB 4.21Å; M188-A190 PolarHBondContact O-N 3.01Å; A190-E192 VanDerWaalsContact C-N 3.32Å; A190-E192 PolarHBondContact O-N 3.41Å; A190-R193 HydrophobicContact CB-CB 4.09Å; A190-R193 PolarHBondContact O-N 3.22Å; A190-R193 VanDerWaalsContact O-N 3.13Å; A190-A194 PolarHBondContact O-N 3.27Å
191	P	95.4	Very high	97.3	Very high	20 Å²	20	47.1 Å²	47.1	13%	0.13	23%	0.228	C	C	.	.	H	α-helix	trans	-63.6	-33.5	-171.5	27.2	-35.5	0	0	0	113	Y185 N189 R193 A194 C195 I238	Y185-P191 HydrophobicContact CD2-CB 3.89Å; Y185-P191 HydrophobicContact CE2-CB 4.09Å; N189-P191 VanDerWaalsContact C-CD 3.47Å; N189-P191 WeakPolarHBondContact O-CD 3.14Å; P191-R193 VanDerWaalsContact C-N 3.33Å; P191-R193 PolarHBondContact O-N 3.02Å; P191-A194 PolarHBondContact O-N 3.17Å; P191-C195 WeakPolarHBondContact O-CB 3.18Å; P191-C195 PolarHBondContact O-N 3.17Å; P191-C195 PolarHBondContact O-SG 2.97Å; P191-I238 HydrophobicContact CB-CD1 4.06Å; P191-I238 HydrophobicContact CB-CG1 4.01Å; P191-I238 HydrophobicContact CG-CG1 4.28Å
192	E	95.4	Very high	97.2	Very high	125 Å²	125	49 Å²	49	58%	0.584	24%	0.236	S	C	*	.	H	α-helix	trans	-64.9	-40.1	175.9	-59.4	78.7	-173.9	0	0	111.3	A190 H196	A190-E192 VanDerWaalsContact C-N 3.32Å; A190-E192 PolarHBondContact O-N 3.41Å; E192-H196 VanDerWaalsContact O-CB 3.29Å; E192-H196 WeakPolarHBondContact O-CB 3.47Å; E192-H196 PolarHBondContact O-N 3.47Å
193	R	96.6	Very high	97.2	Very high	132 Å²	132	52.7 Å²	52.7	50%	0.498	26%	0.255	S	S	.	.	H	α-helix	trans	-70.5	-39.3	178	-169.7	168.7	-178.1	173.3	-0.8	111.2	Y184 A190 P191 H196 L197	Y184-R193 HydrophobicContact CD1-CB 4.47Å; Y184-R193 HydrophobicContact CD1-CG 4.04Å; Y184-R193 HydrophobicContact CD2-CG 4.04Å; Y184-R193 VanDerWaalsContact CE1-CD 3.46Å; Y184-R193 HydrophobicContact CE1-CG 4.16Å; Y184-R193 VanDerWaalsContact CE1-NE 3.33Å; Y184-R193 HydrophobicContact CE2-CG 4.1Å; Y184-R193 HydrophobicContact CG-CB 4.37Å; Y184-R193 HydrophobicContact CG-CG 4.01Å; Y184-R193 VanDerWaalsContact CZ-CZ 3.49Å; Y184-R193 PolarHBondContact OH-NE 3.1Å; Y184-R193 PolarHBondContact OH-NH2 3.39Å; A190-R193 HydrophobicContact CB-CB 4.09Å; A190-R193 PolarHBondContact O-N 3.22Å; A190-R193 VanDerWaalsContact O-N 3.13Å; P191-R193 VanDerWaalsContact C-N 3.33Å; P191-R193 PolarHBondContact O-N 3.02Å; R193-H196 PolarHBondContact O-N 3.04Å; R193-L197 WeakPolarHBondContact O-CB 3.47Å; R193-L197 PolarHBondContact O-N 2.92Å
194	A	97.1	Very high	97.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-49.9	173.1	0	0	0	0	0	111.5	S181 A190 P191 L197 A198 W234	S181-A194 VanDerWaalsContact O-CB 3.22Å; S181-A194 WeakPolarHBondContact O-CB 3.23Å; A190-A194 PolarHBondContact O-N 3.27Å; P191-A194 PolarHBondContact O-N 3.17Å; A194-L197 PolarHBondContact O-N 2.86Å; A194-A198 WeakPolarHBondContact O-CB 3.47Å; A194-A198 PolarHBondContact O-N 3.41Å; A194-W234 HydrophobicContact CB-CE3 4.04Å; A194-W234 HydrophobicContact CB-CZ3 3.95Å
195	C	97.4	Very high	97	Very high	16 Å²	16	54.9 Å²	54.9	11%	0.108	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-41.8	178.6	-67	0	0	0	0	112.1	P191 L197 K199 L231	P191-C195 WeakPolarHBondContact O-CB 3.18Å; P191-C195 PolarHBondContact O-N 3.17Å; P191-C195 PolarHBondContact O-SG 2.97Å; C195-L197 PolarHBondContact O-N 3.15Å; C195-K199 WeakPolarHBondContact O-CB 3.23Å; C195-K199 PolarHBondContact O-N 3.31Å; C195-L231 HydrophobicContact CB-CD2 4.07Å; C195-L231 VanDerWaalsContact O-CD2 3.31Å; C195-L231 WeakPolarHBondContact O-CD2 3.47Å
196	H	97.4	Very high	96.9	Very high	125 Å²	125	58.1 Å²	58.1	58%	0.579	28%	0.284	S	S	*	.	H	α-helix	trans	-59.2	-48.6	177.2	-178.5	66.4	0	0	0	111.6	E192 R193 K199 Q200	E192-H196 VanDerWaalsContact O-CB 3.29Å; E192-H196 WeakPolarHBondContact O-CB 3.47Å; E192-H196 PolarHBondContact O-N 3.47Å; R193-H196 PolarHBondContact O-N 3.04Å; H196-K199 PolarHBondContact O-N 3.43Å; H196-Q200 VanDerWaalsContact O-CB 3.31Å; H196-Q200 WeakPolarHBondContact O-CB 3.42Å; H196-Q200 PolarHBondContact O-N 3.46Å
197	L	98.1	Very high	96.8	Very high	31 Å²	31	60.2 Å²	60.2	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-48.4	179.6	179.9	62.2	0	0	0	112.2	F180 Y184 R193 A194 C195 K199 Q200 A201	F180-L197 HydrophobicContact CB-CD2 3.79Å; F180-L197 HydrophobicContact CD1-CD2 3.66Å; F180-L197 HydrophobicContact CE1-CD2 4.46Å; F180-L197 HydrophobicContact CG-CD2 3.73Å; Y184-L197 HydrophobicContact CD2-CD2 4Å; Y184-L197 HydrophobicContact CE2-CD2 3.99Å; R193-L197 WeakPolarHBondContact O-CB 3.47Å; R193-L197 PolarHBondContact O-N 2.92Å; A194-L197 PolarHBondContact O-N 2.86Å; C195-L197 PolarHBondContact O-N 3.15Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 2.98Å; L197-Q200 PolarHBondContact O-N 2.93Å; L197-A201 PolarHBondContact O-N 3.45Å
198	A	97.6	Very high	96.7	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-40.7	-179.7	0	0	0	0	0	111.9	A194 F202 L227 L231 W234	A194-A198 WeakPolarHBondContact O-CB 3.47Å; A194-A198 PolarHBondContact O-N 3.41Å; A198-F202 WeakPolarHBondContact O-CB 3.37Å; A198-F202 PolarHBondContact O-N 3.29Å; A198-L227 HydrophobicContact CB-CD2 3.8Å; A198-L231 HydrophobicContact CB-CD1 4.33Å; A198-L231 HydrophobicContact CB-CD2 3.81Å; A198-L231 HydrophobicContact CB-CG 3.89Å; A198-W234 HydrophobicContact CB-CZ3 4.33Å
199	K	97.5	Very high	96.4	Very high	120 Å²	120	60.2 Å²	60.2	52%	0.522	30%	0.303	S	S	.	.	H	α-helix	trans	-67	-45.6	177.6	-177.1	175.3	-179.9	-179.4	0	111.8	C195 H196 L197 A201 F202 D203 L231	C195-K199 WeakPolarHBondContact O-CB 3.23Å; C195-K199 PolarHBondContact O-N 3.31Å; H196-K199 PolarHBondContact O-N 3.43Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 2.98Å; K199-A201 VanDerWaalsContact C-N 3.34Å; K199-A201 PolarHBondContact O-N 2.66Å; K199-F202 PolarHBondContact O-N 2.9Å; K199-D203 WeakPolarHBondContact CE-OD2 3.45Å; K199-D203 WeakPolarHBondContact CG-OD2 3.33Å; K199-D203 WeakPolarHBondContact O-CB 3.42Å; K199-D203 VanDerWaalsContact O-CG 3.3Å; K199-D203 PolarHBondContact O-N 3.27Å; K199-L231 HydrophobicContact CB-CD1 4.14Å; K199-L231 HydrophobicContact CB-CD2 4.02Å
200	Q	98.2	Very high	96.1	Very high	72 Å²	72	61.2 Å²	61.2	34%	0.336	31%	0.308	S	S	.	.	H	α-helix	trans	-57.8	-48.6	177.4	-178.7	-176.4	-24.2	0	0	110.9	H196 L197 F202 D203 E204	H196-Q200 VanDerWaalsContact O-CB 3.31Å; H196-Q200 WeakPolarHBondContact O-CB 3.42Å; H196-Q200 PolarHBondContact O-N 3.46Å; L197-Q200 PolarHBondContact O-N 2.93Å; Q200-F202 VanDerWaalsContact C-N 3.33Å; Q200-F202 PolarHBondContact O-N 3.07Å; Q200-D203 PolarHBondContact O-N 3.1Å; Q200-E204 HydrophobicContact CG-CG 4.35Å; Q200-E204 VanDerWaalsContact CG-OE1 3.3Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.5Å; Q200-E204 PolarHBondContact NE2-OE1 3.07Å; Q200-E204 WeakPolarHBondContact O-CB 3.29Å; Q200-E204 VanDerWaalsContact O-CG 3.3Å; Q200-E204 WeakPolarHBondContact O-CG 3.33Å; Q200-E204 PolarHBondContact O-N 3.5Å
201	A	97.9	Very high	95.7	Very high	12 Å²	12	65.2 Å²	65.2	10%	0.099	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-40.3	178.7	0	0	0	0	0	112.6	A177 L197 K199 A205 L227	A177-A201 HydrophobicContact CB-CB 3.38Å; L197-A201 PolarHBondContact O-N 3.45Å; K199-A201 VanDerWaalsContact C-N 3.34Å; K199-A201 PolarHBondContact O-N 2.66Å; A201-A205 VanDerWaalsContact O-CB 3.31Å; A201-A205 WeakPolarHBondContact O-CB 3.49Å; A201-A205 PolarHBondContact O-N 3.09Å; A201-A205 VanDerWaalsContact O-N 3.07Å; A201-L227 HydrophobicContact CB-CD1 4.31Å
202	F	97.5	Very high	95.3	Very high	38 Å²	38	66.3 Å²	66.3	17%	0.167	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-47.1	176.2	-173.6	-86.6	0	0	0	112.1	A198 K199 Q200 A205 I206 M224 L227 R228	A198-F202 WeakPolarHBondContact O-CB 3.37Å; A198-F202 PolarHBondContact O-N 3.29Å; K199-F202 PolarHBondContact O-N 2.9Å; Q200-F202 VanDerWaalsContact C-N 3.33Å; Q200-F202 PolarHBondContact O-N 3.07Å; F202-A205 PolarHBondContact O-N 3.39Å; F202-I206 HydrophobicContact CE1-CD1 3.75Å; F202-I206 HydrophobicContact CZ-CD1 4.11Å; F202-I206 WeakPolarHBondContact O-CB 3.44Å; F202-I206 PolarHBondContact O-N 3.28Å; F202-M224 HydrophobicContact CD2-CB 4.07Å; F202-M224 HydrophobicContact CD2-CE 4.21Å; F202-M224 HydrophobicContact CD2-CG 4.49Å; F202-M224 WeakPolarHBondContact CD2-O 3.31Å; F202-M224 HydrophobicContact CE2-CB 4.01Å; F202-M224 HydrophobicContact CE2-CE 4.1Å; F202-M224 WeakPolarHBondContact CE2-O 3.12Å; F202-M224 HydrophobicContact CZ-CE 4.41Å; F202-L227 HydrophobicContact CD2-CB 4.46Å; F202-R228 HydrophobicContact CD2-CB 4.42Å; F202-R228 HydrophobicContact CE2-CB 4Å
203	D	97.5	Very high	94.9	Very high	79 Å²	79	64.9 Å²	64.9	42%	0.422	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-34.7	-178.4	-70.5	-15.5	0	0	0	112.2	K199 Q200 I206	K199-D203 WeakPolarHBondContact CE-OD2 3.45Å; K199-D203 WeakPolarHBondContact CG-OD2 3.33Å; K199-D203 WeakPolarHBondContact O-CB 3.42Å; K199-D203 VanDerWaalsContact O-CG 3.3Å; K199-D203 PolarHBondContact O-N 3.27Å; Q200-D203 PolarHBondContact O-N 3.1Å; D203-I206 WeakPolarHBondContact O-CG2 3.47Å
204	E	96.8	Very high	94.5	Very high	56 Å²	56	67.1 Å²	67.1	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-67.7	-47.8	173	-71.2	174.8	-174.6	0	0	110.8	P168 R173 Q200 S207	P168-E204 HydrophobicContact CB-CB 3.81Å; P168-E204 HydrophobicContact CG-CB 4.29Å; R173-E204 IonicContact CZ-OE2 3.88Å; R173-E204 IonicContact NH2-OE2 3.75Å; R173-E204 PolarHBondContact NH2-OE2 2.93Å; Q200-E204 HydrophobicContact CG-CG 4.35Å; Q200-E204 VanDerWaalsContact CG-OE1 3.3Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.5Å; Q200-E204 PolarHBondContact NE2-OE1 3.07Å; Q200-E204 WeakPolarHBondContact O-CB 3.29Å; Q200-E204 VanDerWaalsContact O-CG 3.3Å; Q200-E204 WeakPolarHBondContact O-CG 3.33Å; Q200-E204 PolarHBondContact O-N 3.5Å; E204-S207 PolarHBondContact O-N 3.48Å; E204-S207 PolarHBondContact O-OG 3.46Å
205	A	96.5	Very high	93.8	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-67.1	-38.7	-178.3	0	0	0	0	0	113	T169 L174 A201 F202 S207 E208 L209 M224	T169-A205 HydrophobicContact CG2-CB 4.35Å; T169-A205 WeakPolarHBondContact CG2-O 3.48Å; L174-A205 HydrophobicContact CD1-CB 4.42Å; L174-A205 HydrophobicContact CD2-CB 3.72Å; L174-A205 HydrophobicContact CG-CB 4.49Å; A201-A205 VanDerWaalsContact O-CB 3.31Å; A201-A205 WeakPolarHBondContact O-CB 3.49Å; A201-A205 PolarHBondContact O-N 3.09Å; A201-A205 VanDerWaalsContact O-N 3.07Å; F202-A205 PolarHBondContact O-N 3.39Å; A205-S207 PolarHBondContact O-N 3.03Å; A205-E208 PolarHBondContact O-N 2.84Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 PolarHBondContact O-N 3.46Å; A205-M224 HydrophobicContact CB-CE 4.01Å; A205-M224 HydrophobicContact CB-CG 4.34Å; A205-M224 HydrophobicContact CB-SD 3.83Å
206	I	95.3	Very high	93.3	Very high	89 Å²	89	75.2 Å²	75.2	46%	0.456	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-29.2	178.7	-155.1	164	0	0	0	112	F202 D203 E208 M224	F202-I206 HydrophobicContact CE1-CD1 3.75Å; F202-I206 HydrophobicContact CZ-CD1 4.11Å; F202-I206 WeakPolarHBondContact O-CB 3.44Å; F202-I206 PolarHBondContact O-N 3.28Å; D203-I206 WeakPolarHBondContact O-CG2 3.47Å; I206-E208 VanDerWaalsContact C-N 3.29Å; I206-E208 PolarHBondContact O-N 2.9Å; I206-M224 HydrophobicContact CB-CE 3.9Å; I206-M224 HydrophobicContact CG1-CE 4.31Å
207	S	93.9	Very high	93	Very high	90 Å²	90	74.4 Å²	74.4	63%	0.629	38%	0.38	S	S	*	.	H	α-helix	trans	-72	-20.4	179.7	76.9	0	0	0	0	114.1	E204 A205	E204-S207 PolarHBondContact O-N 3.48Å; E204-S207 PolarHBondContact O-OG 3.46Å; A205-S207 PolarHBondContact O-N 3.03Å
208	E	94	Very high	92.7	Very high	76 Å²	76	80 Å²	80	36%	0.355	40%	0.403	S	S	.	.	H	α-helix	trans	-118.8	-0.5	-177	-68.4	-176.1	-154.4	0	0	113	P168 T169 A205 I206 D210 T211	P168-E208 WeakPolarHBondContact CD-OE2 3.42Å; T169-E208 HydrophobicContact CG2-CB 3.74Å; A205-E208 PolarHBondContact O-N 2.84Å; I206-E208 VanDerWaalsContact C-N 3.29Å; I206-E208 PolarHBondContact O-N 2.9Å; E208-D210 VanDerWaalsContact C-N 3.28Å; E208-D210 PolarHBondContact O-N 3.17Å; E208-T211 WeakPolarHBondContact O-CB 3.42Å; E208-T211 PolarHBondContact O-N 2.93Å; E208-T211 VanDerWaalsContact O-N 3.1Å; E208-T211 PolarHBondContact O-OG1 3.2Å
209	L	91.2	Very high	92.4	Very high	20 Å²	20	82.5 Å²	82.5	11%	0.105	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-59.8	-35.6	-170.2	-168	66.9	0	0	0	113.3	A205 T211 L212 Y217 T221 M224	A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 PolarHBondContact O-N 3.46Å; L209-T211 PolarHBondContact O-N 3.39Å; L209-L212 HydrophobicContact CD1-CD1 3.75Å; L209-L212 PolarHBondContact O-N 3.16Å; L209-Y217 HydrophobicContact CD1-CD2 4.36Å; L209-Y217 HydrophobicContact CD1-CE2 4.39Å; L209-Y217 HydrophobicContact CD2-CE2 4.07Å; L209-Y217 HydrophobicContact CG-CD2 4.22Å; L209-Y217 HydrophobicContact CG-CE2 3.84Å; L209-T221 HydrophobicContact CD1-CG2 4.17Å; L209-T221 HydrophobicContact CD2-CG2 4.03Å; L209-M224 HydrophobicContact CD1-SD 3.82Å; L209-M224 HydrophobicContact CD2-CE 4.39Å; L209-M224 HydrophobicContact CD2-SD 4.32Å
210	D	89.9	Confident	92.2	Very high	160 Å²	160	76.8 Å²	76.8	86%	0.856	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-65.7	-9.7	-178.8	-69.2	-22.4	0	0	0	113.7	E208	E208-D210 VanDerWaalsContact C-N 3.28Å; E208-D210 PolarHBondContact O-N 3.17Å
211	T	87.7	Confident	92.1	Very high	109 Å²	109	75.5 Å²	75.5	67%	0.669	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-92.2	-7.5	-180	69.5	0	0	0	0	114.1	E208 L209	E208-T211 WeakPolarHBondContact O-CB 3.42Å; E208-T211 PolarHBondContact O-N 2.93Å; E208-T211 VanDerWaalsContact O-N 3.1Å; E208-T211 PolarHBondContact O-OG1 3.2Å; L209-T211 PolarHBondContact O-N 3.39Å
212	L	88	Confident	91.9	Very high	42 Å²	42	78.5 Å²	78.5	22%	0.22	40%	0.402	C	S	.	.			trans	-74.6	152.3	-175	-70.3	-176.6	0	0	0	113.2	T169 L209 Y217	T169-L212 HydrophobicContact CG2-CD1 4.39Å; T169-L212 HydrophobicContact CG2-CG 4.38Å; L209-L212 HydrophobicContact CD1-CD1 3.75Å; L209-L212 PolarHBondContact O-N 3.16Å; L212-Y217 HydrophobicContact CB-CD2 4.4Å
213	N	88	Confident	91.9	Very high	95 Å²	95	77.4 Å²	77.4	51%	0.508	40%	0.398	S	S	.	.			trans	-75.2	167.3	163.2	68.5	47.4	0	0	0	110.7	E215 S216 Y217	N213-E215 PolarHBondContact O-N 2.79Å; N213-E215 PolarHBondContact OD1-N 3.47Å; N213-S216 WeakPolarHBondContact OD1-CB 3.35Å; N213-S216 PolarHBondContact OD1-N 3.25Å; N213-S216 PolarHBondContact OD1-OG 2.89Å; N213-Y217 WeakPolarHBondContact O-CB 3.33Å; N213-Y217 PolarHBondContact O-N 2.8Å
214	E	87	Confident	91.8	Very high	179 Å²	179	74 Å²	74	84%	0.836	38%	0.38	S	S	*	.	H	α-helix	trans	-61.3	-38.7	-174.3	-169.7	174.8	-175.8	0	0	114	K218	E214-K218 PolarHBondContact O-N 3.34Å
215	E	83.4	Confident	91.8	Very high	152 Å²	152	74.3 Å²	74.3	71%	0.71	38%	0.381	S	S	*	.	H	α-helix	trans	-67.5	-54.7	-179.3	-176.5	177	-171.5	0	0	111.1	N213 Y217 K218	N213-E215 PolarHBondContact O-N 2.79Å; N213-E215 PolarHBondContact OD1-N 3.47Å; E215-Y217 PolarHBondContact O-N 3.49Å; E215-K218 PolarHBondContact O-N 2.85Å
216	S	87.2	Confident	91.9	Very high	34 Å²	34	75.3 Å²	75.3	24%	0.238	39%	0.387	C	S	.	.	H	α-helix	trans	-63.3	-31.7	177.4	-56.6	0	0	0	0	112.2	N213 K218 S220	N213-S216 WeakPolarHBondContact OD1-CB 3.35Å; N213-S216 PolarHBondContact OD1-N 3.25Å; N213-S216 PolarHBondContact OD1-OG 2.89Å; S216-K218 VanDerWaalsContact C-N 3.35Å; S216-K218 PolarHBondContact O-N 2.94Å; S216-S220 WeakPolarHBondContact O-CB 3.49Å; S216-S220 PolarHBondContact O-N 3.01Å; S216-S220 PolarHBondContact O-OG 2.95Å
217	Y	89.8	Confident	92	Very high	108 Å²	108	71.1 Å²	71.1	42%	0.424	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-43.1	177.5	-174.1	-88.1	0	0	0	111.8	L209 L212 N213 E215 T221	L209-Y217 HydrophobicContact CD1-CD2 4.36Å; L209-Y217 HydrophobicContact CD1-CE2 4.39Å; L209-Y217 HydrophobicContact CD2-CE2 4.07Å; L209-Y217 HydrophobicContact CG-CD2 4.22Å; L209-Y217 HydrophobicContact CG-CE2 3.84Å; L212-Y217 HydrophobicContact CB-CD2 4.4Å; N213-Y217 WeakPolarHBondContact O-CB 3.33Å; N213-Y217 PolarHBondContact O-N 2.8Å; E215-Y217 PolarHBondContact O-N 3.49Å; Y217-T221 HydrophobicContact CD1-CG2 4.04Å; Y217-T221 HydrophobicContact CD2-CG2 4.45Å; Y217-T221 HydrophobicContact CE1-CG2 3.75Å; Y217-T221 HydrophobicContact CE2-CG2 4.21Å; Y217-T221 HydrophobicContact CG-CG2 4.37Å; Y217-T221 VanDerWaalsContact O-CB 3.32Å; Y217-T221 WeakPolarHBondContact O-CB 3.35Å; Y217-T221 WeakPolarHBondContact O-CG2 3.36Å; Y217-T221 PolarHBondContact O-N 2.86Å; Y217-T221 PolarHBondContact O-OG1 3.46Å
218	K	91.4	Very high	92.1	Very high	148 Å²	148	72.6 Å²	72.6	64%	0.643	36%	0.357	S	S	*	.	H	α-helix	trans	-63	-51.1	-179.6	-174.5	-171.7	169.9	-158.5	0	111.7	E214 E215 S216 T221 L222	E214-K218 PolarHBondContact O-N 3.34Å; E215-K218 PolarHBondContact O-N 2.85Å; S216-K218 VanDerWaalsContact C-N 3.35Å; S216-K218 PolarHBondContact O-N 2.94Å; K218-T221 PolarHBondContact O-N 3.27Å; K218-T221 PolarHBondContact O-OG1 2.92Å; K218-L222 PolarHBondContact O-N 3.46Å; K218-L222 VanDerWaalsContact O-N 3.14Å
219	D	91.5	Very high	92.2	Very high	54 Å²	54	72.3 Å²	72.3	29%	0.289	36%	0.358	S	S	.	.	H	α-helix	trans	-67.9	-43.9	-176.1	-60.7	-10.6	0	0	0	110.8	P171 T221 L222 I223	P171-D219 HydrophobicContact CB-CB 4.21Å; P171-D219 HydrophobicContact CG-CB 3.96Å; D219-T221 PolarHBondContact O-N 3.27Å; D219-L222 PolarHBondContact O-N 3.24Å; D219-I223 WeakPolarHBondContact O-CG1 3.27Å; D219-I223 PolarHBondContact O-N 3.28Å; D219-I223 VanDerWaalsContact O-N 3.13Å
220	S	94.1	Very high	92.3	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-40.5	179.2	-64.3	0	0	0	0	112.5	T169 P171 S216 I223 M224	T169-S220 WeakPolarHBondContact O-CB 3.34Å; T169-S220 PolarHBondContact O-OG 3.3Å; P171-S220 WeakPolarHBondContact CG-OG 3.46Å; S216-S220 WeakPolarHBondContact O-CB 3.49Å; S216-S220 PolarHBondContact O-N 3.01Å; S216-S220 PolarHBondContact O-OG 2.95Å; S220-I223 PolarHBondContact O-N 2.71Å; S220-M224 WeakPolarHBondContact O-CB 3.37Å; S220-M224 WeakPolarHBondContact O-CG 3.38Å; S220-M224 PolarHBondContact O-N 3.47Å
221	T	95	Very high	92.6	Very high	45 Å²	45	65.1 Å²	65.1	28%	0.276	32%	0.319	S	S	.	.	H	α-helix	trans	-68.2	-34.6	178.1	52	0	0	0	0	112.7	L209 Y217 K218 D219 M224 Q225	L209-T221 HydrophobicContact CD1-CG2 4.17Å; L209-T221 HydrophobicContact CD2-CG2 4.03Å; Y217-T221 HydrophobicContact CD1-CG2 4.04Å; Y217-T221 HydrophobicContact CD2-CG2 4.45Å; Y217-T221 HydrophobicContact CE1-CG2 3.75Å; Y217-T221 HydrophobicContact CE2-CG2 4.21Å; Y217-T221 HydrophobicContact CG-CG2 4.37Å; Y217-T221 VanDerWaalsContact O-CB 3.32Å; Y217-T221 WeakPolarHBondContact O-CB 3.35Å; Y217-T221 WeakPolarHBondContact O-CG2 3.36Å; Y217-T221 PolarHBondContact O-N 2.86Å; Y217-T221 PolarHBondContact O-OG1 3.46Å; K218-T221 PolarHBondContact O-N 3.27Å; K218-T221 PolarHBondContact O-OG1 2.92Å; D219-T221 PolarHBondContact O-N 3.27Å; T221-M224 PolarHBondContact O-N 3.09Å; T221-Q225 WeakPolarHBondContact O-CB 3.49Å; T221-Q225 PolarHBondContact O-N 2.85Å
222	L	95.1	Very high	92.9	Very high	74 Å²	74	64.3 Å²	64.3	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-44	173.3	179.2	58.1	0	0	0	111.4	K218 D219 Q225 L226 A262 E263	K218-L222 PolarHBondContact O-N 3.46Å; K218-L222 VanDerWaalsContact O-N 3.14Å; D219-L222 PolarHBondContact O-N 3.24Å; L222-Q225 WeakPolarHBondContact O-CB 3.4Å; L222-Q225 PolarHBondContact O-N 2.87Å; L222-L226 PolarHBondContact O-N 2.78Å; L222-A262 HydrophobicContact CD2-CB 4.01Å; L222-A262 HydrophobicContact CG-CB 3.88Å; L222-E263 WeakPolarHBondContact CD2-O 3.13Å
223	I	96.1	Very high	93.1	Very high	15 Å²	15	64.1 Å²	64.1	8%	0.077	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-40.9	177.9	-59.2	166.6	0	0	0	111.3	P171 L174 L178 D219 S220 Q225 L226 L227	P171-I223 HydrophobicContact CB-CD1 4.01Å; P171-I223 WeakPolarHBondContact O-CD1 3.43Å; L174-I223 HydrophobicContact CB-CB 4.15Å; L174-I223 HydrophobicContact CB-CD1 4.35Å; L174-I223 HydrophobicContact CB-CG2 3.63Å; L178-I223 HydrophobicContact CB-CG2 4.3Å; L178-I223 HydrophobicContact CD2-CG2 4.14Å; D219-I223 WeakPolarHBondContact O-CG1 3.27Å; D219-I223 PolarHBondContact O-N 3.28Å; D219-I223 VanDerWaalsContact O-N 3.13Å; S220-I223 PolarHBondContact O-N 2.71Å; I223-Q225 VanDerWaalsContact C-N 3.26Å; I223-Q225 PolarHBondContact O-N 3.48Å; I223-L226 PolarHBondContact O-N 3.24Å; I223-L227 PolarHBondContact O-N 3.22Å
224	M	96.9	Very high	93.4	Very high	9 Å²	9	59.6 Å²	59.6	4%	0.044	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-36.1	174.5	-73.5	175	72.7	0	0	112.1	L174 F202 A205 I206 L209 S220 T221 L227 R228	L174-M224 HydrophobicContact CD1-CG 4.01Å; L174-M224 HydrophobicContact CD2-CG 4.08Å; F202-M224 HydrophobicContact CD2-CB 4.07Å; F202-M224 HydrophobicContact CD2-CE 4.21Å; F202-M224 HydrophobicContact CD2-CG 4.49Å; F202-M224 WeakPolarHBondContact CD2-O 3.31Å; F202-M224 HydrophobicContact CE2-CB 4.01Å; F202-M224 HydrophobicContact CE2-CE 4.1Å; F202-M224 WeakPolarHBondContact CE2-O 3.12Å; F202-M224 HydrophobicContact CZ-CE 4.41Å; A205-M224 HydrophobicContact CB-CE 4.01Å; A205-M224 HydrophobicContact CB-CG 4.34Å; A205-M224 HydrophobicContact CB-SD 3.83Å; I206-M224 HydrophobicContact CB-CE 3.9Å; I206-M224 HydrophobicContact CG1-CE 4.31Å; L209-M224 HydrophobicContact CD1-SD 3.82Å; L209-M224 HydrophobicContact CD2-CE 4.39Å; L209-M224 HydrophobicContact CD2-SD 4.32Å; S220-M224 WeakPolarHBondContact O-CB 3.37Å; S220-M224 WeakPolarHBondContact O-CG 3.38Å; S220-M224 PolarHBondContact O-N 3.47Å; T221-M224 PolarHBondContact O-N 3.09Å; M224-L227 PolarHBondContact O-N 3.42Å; M224-R228 PolarHBondContact O-N 3.32Å
225	Q	96.7	Very high	93.6	Very high	61 Å²	61	54.8 Å²	54.8	29%	0.285	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-45.7	173.8	176.8	55.4	41.7	0	0	111.3	T221 L222 I223 R228 D229	T221-Q225 WeakPolarHBondContact O-CB 3.49Å; T221-Q225 PolarHBondContact O-N 2.85Å; L222-Q225 WeakPolarHBondContact O-CB 3.4Å; L222-Q225 PolarHBondContact O-N 2.87Å; I223-Q225 VanDerWaalsContact C-N 3.26Å; I223-Q225 PolarHBondContact O-N 3.48Å; Q225-R228 WeakPolarHBondContact O-CB 3.49Å; Q225-R228 PolarHBondContact O-N 2.99Å; Q225-D229 PolarHBondContact NE2-OD1 3.02Å; Q225-D229 PolarHBondContact NE2-OD2 2.93Å; Q225-D229 PolarHBondContact O-N 2.91Å
226	L	97.1	Very high	93.7	Very high	22 Å²	22	49.6 Å²	49.6	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-41.5	175.3	-67	-170.1	0	0	0	112.9	L178 L222 I223 R228 D229 N230 A257 A262	L178-L226 HydrophobicContact CD1-CB 3.99Å; L178-L226 HydrophobicContact CD2-CB 3.86Å; L178-L226 HydrophobicContact CD2-CD1 3.65Å; L178-L226 HydrophobicContact CD2-CG 4.43Å; L222-L226 PolarHBondContact O-N 2.78Å; I223-L226 PolarHBondContact O-N 3.24Å; L226-R228 VanDerWaalsContact C-N 3.31Å; L226-R228 PolarHBondContact O-N 3.5Å; L226-D229 PolarHBondContact O-N 2.89Å; L226-N230 PolarHBondContact O-N 3.37Å; L226-A257 HydrophobicContact CD1-CB 4.47Å; L226-A257 HydrophobicContact CD2-CB 3.98Å; L226-A262 HydrophobicContact CD1-CB 3.26Å; L226-A262 HydrophobicContact CG-CB 4.17Å
227	L	97.4	Very high	93.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-57.1	-45.8	174.5	-78.2	168.6	0	0	0	111.3	L174 L178 A198 A201 F202 I223 M224 D229 N230 L231	L174-L227 HydrophobicContact CD2-CD1 4.01Å; L178-L227 HydrophobicContact CB-CD2 3.95Å; L178-L227 HydrophobicContact CB-CG 4.25Å; L178-L227 HydrophobicContact CD1-CD2 3.9Å; L178-L227 HydrophobicContact CD1-CG 4.08Å; A198-L227 HydrophobicContact CB-CD2 3.8Å; A201-L227 HydrophobicContact CB-CD1 4.31Å; F202-L227 HydrophobicContact CD2-CB 4.46Å; I223-L227 PolarHBondContact O-N 3.22Å; M224-L227 PolarHBondContact O-N 3.42Å; L227-D229 PolarHBondContact O-N 3.4Å; L227-N230 PolarHBondContact O-N 2.87Å; L227-L231 VanDerWaalsContact O-CG 3.31Å; L227-L231 WeakPolarHBondContact O-CG 3.29Å; L227-L231 PolarHBondContact O-N 3.4Å
228	R	96.5	Very high	93.2	Very high	121 Å²	121	47 Å²	47	46%	0.457	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-40.9	177.6	-171.7	-171.8	74.8	-170.3	5.6	112.4	F202 M224 Q225 L226 L231 T232	F202-R228 HydrophobicContact CD2-CB 4.42Å; F202-R228 HydrophobicContact CE2-CB 4Å; M224-R228 PolarHBondContact O-N 3.32Å; Q225-R228 WeakPolarHBondContact O-CB 3.49Å; Q225-R228 PolarHBondContact O-N 2.99Å; L226-R228 VanDerWaalsContact C-N 3.31Å; L226-R228 PolarHBondContact O-N 3.5Å; R228-L231 PolarHBondContact O-N 3.24Å; R228-T232 PolarHBondContact O-N 3.44Å; R228-T232 PolarHBondContact O-OG1 3.17Å
229	D	96	Very high	92.5	Very high	70 Å²	70	43.9 Å²	43.9	37%	0.374	24%	0.239	S	C	.	.	H	α-helix	trans	-67.5	-41.1	-179	-65.8	-11.7	0	0	0	110.6	Q225 L226 L227 T232 L233	Q225-D229 PolarHBondContact NE2-OD1 3.02Å; Q225-D229 PolarHBondContact NE2-OD2 2.93Å; Q225-D229 PolarHBondContact O-N 2.91Å; L226-D229 PolarHBondContact O-N 2.89Å; L227-D229 PolarHBondContact O-N 3.4Å; D229-T232 PolarHBondContact O-N 3.09Å; D229-L233 PolarHBondContact O-N 3.18Å
230	N	94.6	Very high	91.5	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-45.1	171.7	-76.2	-6.7	0	0	0	112.7	L178 L226 L227 T232 L233 W234 G256 A257	L178-N230 VanDerWaalsContact CD1-ND2 3.3Å; L178-N230 WeakPolarHBondContact CD1-ND2 3.43Å; L226-N230 PolarHBondContact O-N 3.37Å; L227-N230 PolarHBondContact O-N 2.87Å; N230-T232 VanDerWaalsContact C-N 3.26Å; N230-T232 PolarHBondContact O-N 3.42Å; N230-L233 WeakPolarHBondContact O-CB 3.32Å; N230-L233 PolarHBondContact O-N 3Å; N230-W234 HydrophobicContact CB-CD2 4.17Å; N230-W234 HydrophobicContact CB-CE3 4.04Å; N230-W234 HydrophobicContact CB-CH2 3.65Å; N230-W234 HydrophobicContact CB-CZ2 3.79Å; N230-W234 HydrophobicContact CB-CZ3 3.77Å; N230-W234 VanDerWaalsContact O-CD2 3.28Å; N230-W234 PolarHBondContact O-N 3.28Å; N230-G256 WeakPolarHBondContact OD1-CA 3.46Å; N230-A257 PolarHBondContact ND2-O 2.98Å; N230-A257 PolarHBondContact OD1-N 2.98Å
231	L	95.1	Very high	89.9	Confident	25 Å²	25	56.3 Å²	56.3	13%	0.131	30%	0.296	C	S	.	.	H	α-helix	trans	-57.7	-41.9	176	-77.6	168.9	0	0	0	111.9	C195 A198 K199 L227 R228 T235	C195-L231 HydrophobicContact CB-CD2 4.07Å; C195-L231 VanDerWaalsContact O-CD2 3.31Å; C195-L231 WeakPolarHBondContact O-CD2 3.47Å; A198-L231 HydrophobicContact CB-CD1 4.33Å; A198-L231 HydrophobicContact CB-CD2 3.81Å; A198-L231 HydrophobicContact CB-CG 3.89Å; K199-L231 HydrophobicContact CB-CD1 4.14Å; K199-L231 HydrophobicContact CB-CD2 4.02Å; L227-L231 VanDerWaalsContact O-CG 3.31Å; L227-L231 WeakPolarHBondContact O-CG 3.29Å; L227-L231 PolarHBondContact O-N 3.4Å; R228-L231 PolarHBondContact O-N 3.24Å; L231-T235 WeakPolarHBondContact O-CB 3.25Å; L231-T235 PolarHBondContact O-N 2.97Å; L231-T235 PolarHBondContact O-OG1 2.75Å
232	T	94.4	Very high	87.9	Confident	92 Å²	92	57.5 Å²	57.5	56%	0.564	32%	0.317	S	S	*	.	H	α-helix	trans	-62.9	-46.5	177.9	-56.4	0	0	0	0	110.6	R228 D229 N230 S236	R228-T232 PolarHBondContact O-N 3.44Å; R228-T232 PolarHBondContact O-OG1 3.17Å; D229-T232 PolarHBondContact O-N 3.09Å; N230-T232 VanDerWaalsContact C-N 3.26Å; N230-T232 PolarHBondContact O-N 3.42Å; T232-S236 PolarHBondContact O-N 3.08Å; T232-S236 PolarHBondContact O-OG 3.23Å
233	L	91.9	Very high	85.2	Confident	39 Å²	39	56.3 Å²	56.3	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-51.7	179.8	-174.4	64.1	0	0	0	112.4	D229 N230 S236 D237 K254	D229-L233 PolarHBondContact O-N 3.18Å; N230-L233 WeakPolarHBondContact O-CB 3.32Å; N230-L233 PolarHBondContact O-N 3Å; L233-S236 PolarHBondContact O-N 3.15Å; L233-S236 PolarHBondContact O-OG 3.46Å; L233-D237 PolarHBondContact O-N 3.03Å; L233-K254 HydrophobicContact CD1-CB 3.9Å; L233-K254 HydrophobicContact CD1-CD 3.9Å; L233-K254 HydrophobicContact CD2-CB 3.84Å; L233-K254 HydrophobicContact CG-CB 4.27Å
234	W	93.8	Very high	82.4	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-75	-30.9	-174	-56	-27.4	0	0	0	112.6	S181 V182 Y185 A194 A198 N230 S236 D237 I238	S181-W234 WeakPolarHBondContact OG-CH2 3.42Å; V182-W234 HydrophobicContact CG2-CH2 4.01Å; V182-W234 HydrophobicContact CG2-CZ2 4.03Å; Y185-W234 AromaticContact CD1-CD1 3.9Å; Y185-W234 AromaticContact CD1-CE2 3.92Å; Y185-W234 HydrophobicContact CD1-CZ2 4.38Å; Y185-W234 AromaticContact CD1-NE1 3.41Å; Y185-W234 HydrophobicContact CD2-CB 3.99Å; Y185-W234 AromaticContact CD2-CD1 3.4Å; Y185-W234 VanDerWaalsContact CD2-CD1 3.4Å; Y185-W234 AromaticContact CD2-CD2 3.78Å; Y185-W234 HydrophobicContact CD2-CD2 3.78Å; Y185-W234 AromaticContact CD2-CE2 3.86Å; Y185-W234 AromaticContact CD2-CG 3.45Å; Y185-W234 HydrophobicContact CD2-CG 3.45Å; Y185-W234 VanDerWaalsContact CD2-CG 3.45Å; Y185-W234 AromaticContact CD2-NE1 3.63Å; Y185-W234 AromaticContact CE1-CD1 3.66Å; Y185-W234 AromaticContact CE1-NE1 3.49Å; Y185-W234 HydrophobicContact CE2-CB 3.79Å; Y185-W234 AromaticContact CE2-CD1 3.12Å; Y185-W234 HydrophobicContact CE2-CD2 4.25Å; Y185-W234 AromaticContact CE2-CG 3.46Å; Y185-W234 HydrophobicContact CE2-CG 3.46Å; Y185-W234 VanDerWaalsContact CE2-CG 3.46Å; Y185-W234 AromaticContact CE2-NE1 3.71Å; Y185-W234 AromaticContact CG-CD1 3.79Å; Y185-W234 HydrophobicContact CG-CD2 4.01Å; Y185-W234 AromaticContact CG-CE2 3.62Å; Y185-W234 HydrophobicContact CG-CG 4.07Å; Y185-W234 HydrophobicContact CG-CZ2 4.11Å; Y185-W234 AromaticContact CG-NE1 3.49Å; Y185-W234 AromaticContact CZ-CD1 3.26Å; Y185-W234 AromaticContact CZ-NE1 3.63Å; A194-W234 HydrophobicContact CB-CE3 4.04Å; A194-W234 HydrophobicContact CB-CZ3 3.95Å; A198-W234 HydrophobicContact CB-CZ3 4.33Å; N230-W234 HydrophobicContact CB-CD2 4.17Å; N230-W234 HydrophobicContact CB-CE3 4.04Å; N230-W234 HydrophobicContact CB-CH2 3.65Å; N230-W234 HydrophobicContact CB-CZ2 3.79Å; N230-W234 HydrophobicContact CB-CZ3 3.77Å; N230-W234 VanDerWaalsContact O-CD2 3.28Å; N230-W234 PolarHBondContact O-N 3.28Å; W234-S236 VanDerWaalsContact C-N 3.33Å; W234-D237 PolarHBondContact O-N 2.8Å; W234-I238 VanDerWaalsContact O-CG1 3.3Å; W234-I238 WeakPolarHBondContact O-CG1 3.45Å; W234-I238 PolarHBondContact O-N 3.42Å; W234-I238 VanDerWaalsContact O-N 3.11Å
235	T	90.7	Very high	79.4	Confident	77 Å²	77	69.8 Å²	69.8	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-67.3	-35.9	174.4	-55.1	0	0	0	0	111.1	L231 S239	L231-T235 WeakPolarHBondContact O-CB 3.25Å; L231-T235 PolarHBondContact O-N 2.97Å; L231-T235 PolarHBondContact O-OG1 2.75Å; T235-S239 PolarHBondContact O-N 2.89Å; T235-S239 VanDerWaalsContact O-N 3.15Å; T235-S239 PolarHBondContact O-OG 2.94Å; T235-S239 VanDerWaalsContact O-OG 3.11Å
236	S	87	Confident	76.9	Confident	43 Å²	43	71.4 Å²	71.4	30%	0.301	42%	0.419	S	S	.	.	H	α-helix	trans	-62.9	-43	173.1	46.4	0	0	0	0	112.1	T232 L233 W234 I238 S239 E240	T232-S236 PolarHBondContact O-N 3.08Å; T232-S236 PolarHBondContact O-OG 3.23Å; L233-S236 PolarHBondContact O-N 3.15Å; L233-S236 PolarHBondContact O-OG 3.46Å; W234-S236 VanDerWaalsContact C-N 3.33Å; S236-I238 PolarHBondContact O-N 3.27Å; S236-S239 WeakPolarHBondContact CA-OG 2.74Å; S236-S239 PolarHBondContact O-N 3.04Å; S236-S239 VanDerWaalsContact O-N 3.16Å; S236-S239 PolarHBondContact O-OG 3.1Å; S236-E240 WeakPolarHBondContact O-CG 3.38Å; S236-E240 PolarHBondContact O-N 3.4Å
237	D	82.1	Confident	73.9	Confident	34 Å²	34	78.5 Å²	78.5	18%	0.182	45%	0.451	C	S	.	.	H	α-helix	trans	-62.7	-43	179.8	-60.2	-28.3	0	0	0	111.9	Y185 L233 W234 S239 E240 E241	Y185-D237 PolarHBondContact OH-OD2 2.81Å; L233-D237 PolarHBondContact O-N 3.03Å; W234-D237 PolarHBondContact O-N 2.8Å; D237-S239 VanDerWaalsContact C-N 3.3Å; D237-S239 PolarHBondContact O-N 3.35Å; D237-E240 PolarHBondContact O-N 3.49Å; D237-E241 PolarHBondContact O-N 3.29Å
238	I	83	Confident	70.7	Confident	55 Å²	55	88.4 Å²	88.4	28%	0.282	49%	0.494	S	S	.	.	H	α-helix	trans	-60.9	-40.2	176.1	-64.4	163.3	0	0	0	110.9	P191 W234 S236 G242	P191-I238 HydrophobicContact CB-CD1 4.06Å; P191-I238 HydrophobicContact CB-CG1 4.01Å; P191-I238 HydrophobicContact CG-CG1 4.28Å; W234-I238 VanDerWaalsContact O-CG1 3.3Å; W234-I238 WeakPolarHBondContact O-CG1 3.45Å; W234-I238 PolarHBondContact O-N 3.42Å; W234-I238 VanDerWaalsContact O-N 3.11Å; S236-I238 PolarHBondContact O-N 3.27Å; I238-G242 PolarHBondContact O-N 3.41Å
239	S	77.9	Confident	67.7	Low	81 Å²	81	88 Å²	88	57%	0.566	51%	0.505	S	S	*	.	H	α-helix	trans	-72.8	-28.5	178.8	54.9	0	0	0	0	113.9	T235 S236 D237	T235-S239 PolarHBondContact O-N 2.89Å; T235-S239 VanDerWaalsContact O-N 3.15Å; T235-S239 PolarHBondContact O-OG 2.94Å; T235-S239 VanDerWaalsContact O-OG 3.11Å; S236-S239 WeakPolarHBondContact CA-OG 2.74Å; S236-S239 PolarHBondContact O-N 3.04Å; S236-S239 VanDerWaalsContact O-N 3.16Å; S236-S239 PolarHBondContact O-OG 3.1Å; D237-S239 VanDerWaalsContact C-N 3.3Å; D237-S239 PolarHBondContact O-N 3.35Å
240	E	71.1	Confident	64.8	Low	147 Å²	147	92.9 Å²	92.9	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-75.2	-38.2	174.7	-72.8	-176.7	-175.1	0	0	111.9	S236 D237 G242 G243	S236-E240 WeakPolarHBondContact O-CG 3.38Å; S236-E240 PolarHBondContact O-N 3.4Å; D237-E240 PolarHBondContact O-N 3.49Å; E240-G242 VanDerWaalsContact C-N 3.32Å; E240-G242 PolarHBondContact O-N 3.46Å; E240-G243 PolarHBondContact O-N 3.3Å
241	E	59.5	Low	61.9	Low	169 Å²	169	96 Å²	96	79%	0.79	56%	0.564	S	S	*	*	H	α-helix	trans	-70.8	-25.8	175.9	-70.8	-172.3	168.6	0	0	113.5	D237	D237-E241 PolarHBondContact O-N 3.29Å
242	G	52.3	Low	59.6	Low	70 Å²	70	99.4 Å²	99.4	72%	0.722	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-7	176.4	0	0	0	0	0	115.2	I238 E240	I238-G242 PolarHBondContact O-N 3.41Å; E240-G242 VanDerWaalsContact C-N 3.32Å; E240-G242 PolarHBondContact O-N 3.46Å
243	G	39.7	Very low	57.7	Low	48 Å²	48	97.9 Å²	97.9	50%	0.495	59%	0.587	S	S	.	*	S	Bend	trans	-96.7	137.4	179	0	0	0	0	0	112.4	E240	E240-G243 PolarHBondContact O-N 3.3Å
244	D	36.6	Very low	56.2	Low	156 Å²	156	102.8 Å²	102.8	83%	0.834	61%	0.607	S	S	*	*			trans	-46	149.9	-177.2	-68.8	-48.6	0	0	0	116.6
245	D	34.5	Very low	55.2	Low	151 Å²	151	106.7 Å²	106.7	81%	0.807	63%	0.632	S	S	*	*			trans	80.5	102.1	155.6	-71.2	-33.1	0	0	0	121.6	H247	D245-H247 PolarHBondContact O-N 2.99Å; D245-H247 VanDerWaalsContact O-N 3.09Å
246	A	43.8	Very low	54.2	Low	95 Å²	95	103.4 Å²	103.4	79%	0.785	61%	0.614	S	S	*	*				36.6	62.5	124.6	0	0	0	0	0	118.9
247	H	33.1	Very low	53.8	Low	172 Å²	172	102.5 Å²	102.5	80%	0.796	61%	0.608	S	S	*	*			trans	-142.5	93.4	143.8	-114.2	-71.5	0	0	0	110.6	D245 T249	D245-H247 PolarHBondContact O-N 2.99Å; D245-H247 VanDerWaalsContact O-N 3.09Å; H247-T249 PolarHBondContact O-N 3.29Å
248	K	31.7	Very low	52.9	Low	207 Å²	207	101.1 Å²	101.1	90%	0.9	60%	0.602	S	S	*	*			trans	-62.6	88	163.4	-73.1	-177.9	177	-179.7	0	109.1
249	T	33	Very low	51.7	Low	114 Å²	114	99.3 Å²	99.3	70%	0.699	60%	0.598	S	S	*	*			trans	-105.2	125	143.7	46.9	0	0	0	0	105.5	H247 G251	H247-T249 PolarHBondContact O-N 3.29Å; T249-G251 PolarHBondContact O-N 3.28Å
250	N	35.9	Very low	50.5	Low	172 Å²	172	97.2 Å²	97.2	92%	0.92	58%	0.58	S	S	*	*			trans	-53.7	85	169.1	-82.8	-5.1	0	0	0	108.5	S252	N250-S252 VanDerWaalsContact C-N 3.31Å; N250-S252 PolarHBondContact O-N 3.01Å
251	G	33.5	Very low	49.3	Very low	68 Å²	68	96 Å²	96	70%	0.701	58%	0.578	S	S	*	*			trans	-66.4	102.4	159.4	0	0	0	0	0	104.2	T249 A253	T249-G251 PolarHBondContact O-N 3.28Å; G251-A253 PolarHBondContact O-N 3.22Å
252	S	45.1	Very low	48.3	Very low	97 Å²	97	88.5 Å²	88.5	68%	0.678	55%	0.545	S	S	*	.			trans	-56.3	110.6	163.1	51.3	0	0	0	0	106.1	N250 K254	N250-S252 VanDerWaalsContact C-N 3.31Å; N250-S252 PolarHBondContact O-N 3.01Å; S252-K254 PolarHBondContact O-N 3.1Å; S252-K254 VanDerWaalsContact O-N 3.16Å
253	A	55.3	Low	47.5	Very low	61 Å²	61	95.1 Å²	95.1	50%	0.504	56%	0.557	S	S	.	*			trans	-37.6	123.3	166.2	0	0	0	0	0	108.4	Y185 G251	Y185-A253 HydrophobicContact CE1-CB 4.02Å; Y185-A253 WeakPolarHBondContact OH-CB 3.31Å; G251-A253 PolarHBondContact O-N 3.22Å
254	K	59.8	Low	47.9	Very low	142 Å²	142	97.5 Å²	97.5	62%	0.617	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-68.1	127.7	-179.1	-81.4	179.3	179.8	172.4	0	107.1	L233 S252 G256	L233-K254 HydrophobicContact CD1-CB 3.9Å; L233-K254 HydrophobicContact CD1-CD 3.9Å; L233-K254 HydrophobicContact CD2-CB 3.84Å; L233-K254 HydrophobicContact CG-CB 4.27Å; S252-K254 PolarHBondContact O-N 3.1Å; S252-K254 VanDerWaalsContact O-N 3.16Å; K254-G256 PolarHBondContact O-N 2.9Å
255	P	74.1	Confident	48.5	Very low	81 Å²	81	94.4 Å²	94.4	53%	0.526	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-59.4	142.9	179.8	25.1	-32.8	0	0	0	109.5	E186	E186-P255 WeakPolarHBondContact OE1-CA 3.43Å; E186-P255 WeakPolarHBondContact OE1-CB 3.38Å
256	G	69.9	Low	49.3	Very low	9 Å²	9	91.2 Å²	91.2	9%	0.093	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-71	152.6	171.9	0	0	0	0	0	110.2	E186 N230 K254 G258	E186-G256 PolarHBondContact OE1-N 3Å; N230-G256 WeakPolarHBondContact OD1-CA 3.46Å; K254-G256 PolarHBondContact O-N 2.9Å; G256-G258 PolarHBondContact O-N 3.35Å
257	A	77.2	Confident	49.6	Very low	23 Å²	23	91 Å²	91	19%	0.19	52%	0.516	C	S	.	.			trans	-65.5	114.5	165.5	0	0	0	0	0	108.4	L178 L226 N230	L178-A257 WeakPolarHBondContact CD1-O 3.42Å; L226-A257 HydrophobicContact CD1-CB 4.47Å; L226-A257 HydrophobicContact CD2-CB 3.98Å; N230-A257 PolarHBondContact ND2-O 2.98Å; N230-A257 PolarHBondContact OD1-N 2.98Å
258	G	63.6	Low	50.7	Low	5 Å²	5	85.9 Å²	85.9	5%	0.052	50%	0.498	C	S	.	.			trans	-80.6	165.8	164.7	0	0	0	0	0	110.1	G256 D260 D261	G256-G258 PolarHBondContact O-N 3.35Å; G258-D260 PolarHBondContact O-N 3.44Å; G258-D261 PolarHBondContact O-N 3.39Å
259	G	57.7	Low	51.9	Low	18 Å²	18	77.9 Å²	77.9	19%	0.186	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	1.4	166.4	0	0	0	0	0	113.8	N179 D261	N179-G259 WeakPolarHBondContact OD1-CA 3.42Å; N179-G259 PolarHBondContact OD1-N 3.46Å; G259-D261 PolarHBondContact O-N 3.02Å
260	D	53.8	Low	53.3	Low	36 Å²	36	75.3 Å²	75.3	19%	0.193	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.9	161.1	-64.1	-26	0	0	0	111.4	K53 R60 Y134 G258	K53-D260 WeakPolarHBondContact CE-O 3.37Å; K53-D260 VanDerWaalsContact NZ-C 3.33Å; K53-D260 PolarHBondContact NZ-O 3.13Å; R60-D260 IonicContact CZ-OD2 3.34Å; R60-D260 IonicContact NH1-OD2 3.53Å; R60-D260 PolarHBondContact NH1-OD2 3.32Å; R60-D260 IonicContact NH2-OD2 2.59Å; Y134-D260 PolarHBondContact OH-OD1 3.05Å; Y134-D260 PolarHBondContact OH-OD2 3.21Å; G258-D260 PolarHBondContact O-N 3.44Å
261	D	46.2	Very low	54.6	Low	123 Å²	123	67.8 Å²	67.8	66%	0.658	42%	0.42	S	S	*	.	S	Bend	trans	-105.7	-9.5	-176.3	-59.9	-46.4	0	0	0	114.4	G258 G259	G258-D261 PolarHBondContact O-N 3.39Å; G259-D261 PolarHBondContact O-N 3.02Å
262	A	38.2	Very low	56.4	Low	10 Å²	10	67.8 Å²	67.8	8%	0.083	40%	0.396	C	S	.	.			trans	-109	131.7	171.8	0	0	0	0	0	111.4	L222 L226	L222-A262 HydrophobicContact CD2-CB 4.01Å; L222-A262 HydrophobicContact CG-CB 3.88Å; L226-A262 HydrophobicContact CD1-CB 3.26Å; L226-A262 HydrophobicContact CG-CB 4.17Å
263	E	35.8	Very low	57.4	Low	209 Å²	209	65.2 Å²	65.2	98%	0.977	37%	0.371	S	S	*	.			trans	-79.8	0	166.6	-70.7	178.9	166.9	0	0	111	L222	L222-E263 WeakPolarHBondContact CD2-O 3.13Å

Retrieved 263 of 263 residues in 707.7 ms (Link to these results)

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