1433C_SOYBN Loading...

14-3-3-like protein C

AlphaFold DB , UniProt , Accession Q96452, Species SOYBN (Glycine max, Soybean), Gene GF14C, Length 258 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	56.2	Low	86.8	Confident	202 Å²	202	89.2 Å²	89.2	100%	0.995	47%	0.466	S	S	*	.				0	-54.5	0	-70.8	-160.5	-161.8	0	0	111.8	T4 K5	M1-T4 PolarHBondContact O-N 3.17Å; M1-K5 PolarHBondContact O-N 3.26Å
2	A	60.7	Low	87.7	Confident	72 Å²	72	93.8 Å²	93.8	60%	0.595	47%	0.474	S	S	*	.	H	α-helix	trans	-58.8	-52.2	176.8	0	0	0	0	0	112.7	T4 K5 E6	A2-T4 VanDerWaalsContact C-N 3.29Å; A2-T4 PolarHBondContact O-N 3.09Å; A2-K5 PolarHBondContact O-N 3Å; A2-K5 VanDerWaalsContact O-N 3.12Å; A2-E6 WeakPolarHBondContact O-CG 3.42Å; A2-E6 PolarHBondContact O-N 3.28Å
3	S	79.5	Confident	88.5	Confident	68 Å²	68	92 Å²	92	48%	0.476	47%	0.471	S	S	.	.	H	α-helix	trans	-59	-35.6	179	60.5	0	0	0	0	114.2	E6 R7	S3-E6 WeakPolarHBondContact CA-OE2 3.41Å; S3-E6 PolarHBondContact O-N 3.19Å; S3-R7 WeakPolarHBondContact O-CB 3.38Å; S3-R7 PolarHBondContact O-N 3.44Å
4	T	87	Confident	89.3	Confident	72 Å²	72	85.4 Å²	85.4	44%	0.442	44%	0.437	S	S	.	.	H	α-helix	trans	-65.3	-46.6	176.6	-45.2	0	0	0	0	111	M1 A2 E6 R7 E8	M1-T4 PolarHBondContact O-N 3.17Å; A2-T4 VanDerWaalsContact C-N 3.29Å; A2-T4 PolarHBondContact O-N 3.09Å; T4-E6 VanDerWaalsContact C-N 3.32Å; T4-E6 PolarHBondContact O-N 2.99Å; T4-R7 WeakPolarHBondContact O-CB 3.08Å; T4-R7 PolarHBondContact O-N 3.19Å; T4-E8 WeakPolarHBondContact O-CG 3.33Å; T4-E8 PolarHBondContact O-N 3.36Å
5	K	90.8	Very high	89.9	Confident	137 Å²	137	83.6 Å²	83.6	60%	0.596	43%	0.425	S	S	*	.	H	α-helix	trans	-66.4	-36.4	178.3	-170.1	177.7	-178	-179.4	0	111.8	M1 A2 N9	M1-K5 PolarHBondContact O-N 3.26Å; A2-K5 PolarHBondContact O-N 3Å; A2-K5 VanDerWaalsContact O-N 3.12Å; K5-N9 WeakPolarHBondContact O-CB 3.39Å; K5-N9 PolarHBondContact O-N 3.4Å; K5-N9 PolarHBondContact O-ND2 3.29Å
6	E	93.2	Very high	90.4	Very high	95 Å²	95	83.2 Å²	83.2	44%	0.444	42%	0.423	S	S	.	.	H	α-helix	trans	-64.3	-47.3	174.2	-71.1	171.1	122.6	0	0	111.3	A2 S3 T4 E8 N9 F10	A2-E6 WeakPolarHBondContact O-CG 3.42Å; A2-E6 PolarHBondContact O-N 3.28Å; S3-E6 WeakPolarHBondContact CA-OE2 3.41Å; S3-E6 PolarHBondContact O-N 3.19Å; T4-E6 VanDerWaalsContact C-N 3.32Å; T4-E6 PolarHBondContact O-N 2.99Å; E6-E8 PolarHBondContact O-N 3Å; E6-N9 WeakPolarHBondContact O-CB 3.25Å; E6-N9 PolarHBondContact O-N 3.38Å; E6-F10 HydrophobicContact CB-CE2 4.15Å; E6-F10 WeakPolarHBondContact O-CD2 3.35Å; E6-F10 WeakPolarHBondContact O-CG 3.4Å; E6-F10 PolarHBondContact O-N 2.65Å
7	R	96.7	Very high	90.9	Very high	53 Å²	53	78.8 Å²	78.8	20%	0.2	40%	0.402	C	S	.	.	H	α-helix	trans	-54.7	-51.1	173.7	-176.7	175	-178.7	167	5.8	111.7	S3 T4 N9 F10 V11 V33 L36 V38 E39 E44	S3-R7 WeakPolarHBondContact O-CB 3.38Å; S3-R7 PolarHBondContact O-N 3.44Å; T4-R7 WeakPolarHBondContact O-CB 3.08Å; T4-R7 PolarHBondContact O-N 3.19Å; R7-N9 VanDerWaalsContact C-N 3.31Å; R7-N9 PolarHBondContact O-N 2.63Å; R7-F10 PolarHBondContact O-N 2.79Å; R7-V11 WeakPolarHBondContact O-CG2 3.42Å; R7-V11 PolarHBondContact O-N 2.62Å; R7-V33 HydrophobicContact CG-CG1 4.17Å; R7-L36 HydrophobicContact CB-CD1 3.61Å; R7-L36 HydrophobicContact CG-CD1 4.21Å; R7-V38 VanDerWaalsContact NH1-CG2 3.26Å; R7-E39 PolarHBondContact NH2-O 2.92Å; R7-E44 IonicContact CZ-OE1 3.56Å; R7-E44 IonicContact CZ-OE2 2.8Å; R7-E44 IonicContact NE-OE1 3.13Å; R7-E44 PolarHBondContact NE-OE1 2.99Å; R7-E44 IonicContact NE-OE2 2.6Å; R7-E44 VanDerWaalsContact NH2-CD 3.34Å; R7-E44 IonicContact NH2-OE1 3.92Å; R7-E44 PolarHBondContact NH2-OE1 3.13Å; R7-E44 IonicContact NH2-OE2 3.37Å; R7-E44 PolarHBondContact NH2-OE2 3.26Å
8	E	96.8	Very high	91.3	Very high	121 Å²	121	78.5 Å²	78.5	57%	0.565	40%	0.399	S	S	*	.	H	α-helix	trans	-58.4	-41.9	178.5	-73.4	169.2	-175.8	0	0	112.1	T4 E6 Y12	T4-E8 WeakPolarHBondContact O-CG 3.33Å; T4-E8 PolarHBondContact O-N 3.36Å; E6-E8 PolarHBondContact O-N 3Å; E8-Y12 VanDerWaalsContact O-CB 3.3Å; E8-Y12 WeakPolarHBondContact O-CB 3.46Å; E8-Y12 PolarHBondContact O-N 3.45Å
9	N	97.3	Very high	91.6	Very high	87 Å²	87	82.6 Å²	82.6	47%	0.465	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-45.3	176.7	-72.3	-21.1	0	0	0	112	K5 E6 R7 Y12 V13	K5-N9 WeakPolarHBondContact O-CB 3.39Å; K5-N9 PolarHBondContact O-N 3.4Å; K5-N9 PolarHBondContact O-ND2 3.29Å; E6-N9 WeakPolarHBondContact O-CB 3.25Å; E6-N9 PolarHBondContact O-N 3.38Å; R7-N9 VanDerWaalsContact C-N 3.31Å; R7-N9 PolarHBondContact O-N 2.63Å; N9-Y12 PolarHBondContact O-N 3.39Å; N9-V13 WeakPolarHBondContact O-CG2 3.33Å; N9-V13 PolarHBondContact O-N 3.01Å
10	F	98	Very high	92	Very high	60 Å²	60	81.7 Å²	81.7	26%	0.263	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-43.7	178.4	-65.8	-48.8	0	0	0	111.8	E6 R7 Y12 V13 A14 N32 V33	E6-F10 HydrophobicContact CB-CE2 4.15Å; E6-F10 WeakPolarHBondContact O-CD2 3.35Å; E6-F10 WeakPolarHBondContact O-CG 3.4Å; E6-F10 PolarHBondContact O-N 2.65Å; R7-F10 PolarHBondContact O-N 2.79Å; F10-Y12 VanDerWaalsContact C-N 3.32Å; F10-Y12 PolarHBondContact O-N 3.19Å; F10-V13 PolarHBondContact O-N 2.99Å; F10-A14 PolarHBondContact O-N 3.18Å; F10-N32 HydrophobicContact CD1-CB 3.7Å; F10-N32 HydrophobicContact CD2-CB 3.7Å; F10-N32 HydrophobicContact CE1-CB 3.64Å; F10-N32 HydrophobicContact CE2-CB 3.65Å; F10-N32 HydrophobicContact CG-CB 3.74Å; F10-N32 HydrophobicContact CZ-CB 3.63Å; F10-V33 HydrophobicContact CB-CG2 3.5Å; F10-V33 VanDerWaalsContact CB-CG2 3.5Å; F10-V33 HydrophobicContact CG-CG2 4.43Å
11	V	98.3	Very high	92.3	Very high	14 Å²	14	84.6 Å²	84.6	9%	0.085	43%	0.434	C	S	.	.	H	α-helix	trans	-61.8	-41.7	175.7	172.3	0	0	0	0	111.2	R7 A14 K15 V33 E44 L47	R7-V11 WeakPolarHBondContact O-CG2 3.42Å; R7-V11 PolarHBondContact O-N 2.62Å; V11-A14 PolarHBondContact O-N 3.18Å; V11-K15 HydrophobicContact CG1-CD 4.42Å; V11-K15 WeakPolarHBondContact O-CG 3.41Å; V11-K15 PolarHBondContact O-N 3.25Å; V11-V33 HydrophobicContact CG2-CG2 3.88Å; V11-E44 HydrophobicContact CG2-CG 3.76Å; V11-E44 WeakPolarHBondContact CG2-OE1 3.45Å; V11-L47 HydrophobicContact CG1-CD1 4.03Å
12	Y	98.3	Very high	94.3	Very high	144 Å²	144	81.6 Å²	81.6	57%	0.565	41%	0.411	S	S	*	.	H	α-helix	trans	-61.9	-43.8	175.5	180	-109.8	0	0	0	112.2	E8 N9 F10 A14 K15 L16	E8-Y12 VanDerWaalsContact O-CB 3.3Å; E8-Y12 WeakPolarHBondContact O-CB 3.46Å; E8-Y12 PolarHBondContact O-N 3.45Å; N9-Y12 PolarHBondContact O-N 3.39Å; F10-Y12 VanDerWaalsContact C-N 3.32Å; F10-Y12 PolarHBondContact O-N 3.19Å; Y12-A14 PolarHBondContact O-N 2.7Å; Y12-K15 PolarHBondContact O-N 3.37Å; Y12-L16 HydrophobicContact CD1-CD1 3.98Å; Y12-L16 HydrophobicContact CE1-CD1 3.45Å; Y12-L16 VanDerWaalsContact CE1-CD1 3.45Å; Y12-L16 HydrophobicContact CE1-CG 4.17Å; Y12-L16 HydrophobicContact CE2-CG 4.42Å; Y12-L16 WeakPolarHBondContact O-CG 3.43Å; Y12-L16 PolarHBondContact O-N 3.44Å
13	V	98.4	Very high	96.1	Very high	71 Å²	71	80.8 Å²	80.8	43%	0.43	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-43	174.7	171.3	0	0	0	0	111.2	N9 F10 K15 L16 A17 A29	N9-V13 WeakPolarHBondContact O-CG2 3.33Å; N9-V13 PolarHBondContact O-N 3.01Å; F10-V13 PolarHBondContact O-N 2.99Å; V13-K15 VanDerWaalsContact C-N 3.33Å; V13-K15 PolarHBondContact O-N 3.3Å; V13-L16 PolarHBondContact O-N 3.48Å; V13-A17 WeakPolarHBondContact O-CB 3.37Å; V13-A17 PolarHBondContact O-N 3Å; V13-A29 HydrophobicContact CB-CB 4.28Å; V13-A29 HydrophobicContact CG1-CB 3.98Å
14	A	98.6	Very high	96.9	Very high	0 Å²	0	81.4 Å²	81.4	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-60.2	-41.5	176.9	0	0	0	0	0	112.2	F10 V11 Y12 A17 E18 M26 A29 M30 L47	F10-A14 PolarHBondContact O-N 3.18Å; V11-A14 PolarHBondContact O-N 3.18Å; Y12-A14 PolarHBondContact O-N 2.7Å; A14-A17 PolarHBondContact O-N 2.91Å; A14-E18 WeakPolarHBondContact O-CB 3.37Å; A14-E18 PolarHBondContact O-N 3.33Å; A14-M26 HydrophobicContact CB-CG 4.18Å; A14-A29 HydrophobicContact CB-CB 4.02Å; A14-M30 HydrophobicContact CB-CG 3.8Å; A14-M30 HydrophobicContact CB-SD 3.56Å; A14-M30 VanDerWaalsContact CB-SD 3.56Å; A14-L47 HydrophobicContact CB-CD1 4.49Å
15	K	98.6	Very high	97.5	Very high	58 Å²	58	81 Å²	81	25%	0.252	38%	0.382	S	S	.	.	H	α-helix	trans	-65.8	-38	176	-69.4	178.3	-173.4	-171.1	0	112.9	V11 Y12 V13 Q19 E43 L47	V11-K15 HydrophobicContact CG1-CD 4.42Å; V11-K15 WeakPolarHBondContact O-CG 3.41Å; V11-K15 PolarHBondContact O-N 3.25Å; Y12-K15 PolarHBondContact O-N 3.37Å; V13-K15 VanDerWaalsContact C-N 3.33Å; V13-K15 PolarHBondContact O-N 3.3Å; K15-Q19 WeakPolarHBondContact O-CG 3.28Å; K15-Q19 PolarHBondContact O-N 2.73Å; K15-Q19 PolarHBondContact O-NE2 2.73Å; K15-E43 VanDerWaalsContact CE-CD 3.42Å; K15-E43 WeakPolarHBondContact CE-OE1 3.38Å; K15-E43 IonicContact NZ-OE1 3.78Å; K15-E43 PolarHBondContact NZ-OE1 3.09Å; K15-E43 IonicContact NZ-OE2 2.83Å; K15-E43 PolarHBondContact NZ-OE2 2.84Å; K15-L47 HydrophobicContact CG-CD1 3.97Å; K15-L47 HydrophobicContact CG-CD2 4.1Å
16	L	98.6	Very high	97.8	Very high	77 Å²	77	74.5 Å²	74.5	40%	0.403	35%	0.354	S	S	.	.	H	α-helix	trans	-67.1	-41.7	173.9	-70.9	177.7	0	0	0	111.3	Y12 V13 Q19 A20	Y12-L16 HydrophobicContact CD1-CD1 3.98Å; Y12-L16 HydrophobicContact CE1-CD1 3.45Å; Y12-L16 VanDerWaalsContact CE1-CD1 3.45Å; Y12-L16 HydrophobicContact CE1-CG 4.17Å; Y12-L16 HydrophobicContact CE2-CG 4.42Å; Y12-L16 WeakPolarHBondContact O-CG 3.43Å; Y12-L16 PolarHBondContact O-N 3.44Å; V13-L16 PolarHBondContact O-N 3.48Å; L16-Q19 PolarHBondContact O-N 2.64Å; L16-A20 WeakPolarHBondContact O-CB 3.46Å; L16-A20 PolarHBondContact O-N 3.28Å
17	A	98.6	Very high	98.1	Very high	8 Å²	8	70.4 Å²	70.4	7%	0.066	34%	0.335	C	S	.	.	H	α-helix	trans	-64.2	-40.7	178.1	0	0	0	0	0	111.6	V13 A14 A20 E21 R22 E25 M26	V13-A17 WeakPolarHBondContact O-CB 3.37Å; V13-A17 PolarHBondContact O-N 3Å; A14-A17 PolarHBondContact O-N 2.91Å; A17-A20 CarbonylContact O-C 3.46Å; A17-A20 PolarHBondContact O-N 3.42Å; A17-E21 PolarHBondContact O-N 3.02Å; A17-R22 HydrophobicContact CB-CB 4.18Å; A17-R22 PolarHBondContact O-N 3.45Å; A17-E25 HydrophobicContact CB-CB 4.23Å; A17-M26 HydrophobicContact CB-CB 3.88Å
18	E	98.2	Very high	98.2	Very high	74 Å²	74	73.9 Å²	73.9	35%	0.346	35%	0.354	S	S	.	.	H	α-helix	trans	-56.9	-51.6	172.4	-174.7	-179.7	-156.1	0	0	111.8	A14 A20 E21 M26 L47	A14-E18 WeakPolarHBondContact O-CB 3.37Å; A14-E18 PolarHBondContact O-N 3.33Å; E18-A20 PolarHBondContact O-N 3.3Å; E18-E21 PolarHBondContact O-N 3.29Å; E18-M26 HydrophobicContact CB-CE 3.83Å; E18-M26 HydrophobicContact CB-SD 4.02Å; E18-M26 HydrophobicContact CG-CE 4.08Å; E18-M26 HydrophobicContact CG-SD 4.43Å; E18-L47 WeakPolarHBondContact OE2-CD2 3.35Å
19	Q	97.8	Very high	98.3	Very high	157 Å²	157	68.4 Å²	68.4	73%	0.734	33%	0.329	S	S	*	.	H	α-helix	trans	-63.1	-26.3	179.1	-72.4	175	58.9	0	0	113.3	K15 L16	K15-Q19 WeakPolarHBondContact O-CG 3.28Å; K15-Q19 PolarHBondContact O-N 2.73Å; K15-Q19 PolarHBondContact O-NE2 2.73Å; L16-Q19 PolarHBondContact O-N 2.64Å
20	A	98.1	Very high	98.3	Very high	63 Å²	63	64.2 Å²	64.2	52%	0.521	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	3.8	176.8	0	0	0	0	0	113.5	L16 A17 E18 R22	L16-A20 WeakPolarHBondContact O-CB 3.46Å; L16-A20 PolarHBondContact O-N 3.28Å; A17-A20 CarbonylContact O-C 3.46Å; A17-A20 PolarHBondContact O-N 3.42Å; E18-A20 PolarHBondContact O-N 3.3Å; A20-R22 HydrophobicContact CB-CB 4.46Å; A20-R22 HydrophobicContact CB-CG 3.9Å; A20-R22 PolarHBondContact O-N 2.96Å
21	E	97.9	Very high	98.3	Very high	144 Å²	144	63.9 Å²	63.9	67%	0.673	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	30.2	-174.7	-55.5	-174.1	154.7	0	0	113.7	A17 E18 Y23	A17-E21 PolarHBondContact O-N 3.02Å; E18-E21 PolarHBondContact O-N 3.29Å; E21-Y23 HydrophobicContact CB-CE2 3.92Å; E21-Y23 WeakPolarHBondContact O-CD2 3.42Å; E21-Y23 PolarHBondContact O-N 2.94Å
22	R	98.4	Very high	98.3	Very high	138 Å²	138	65.9 Å²	65.9	52%	0.521	32%	0.315	S	S	.	.			trans	-93.3	64.9	178.9	-70.3	-64.4	-68.1	-142.8	-7.8	110.3	A17 A20 E24 E25 M26	A17-R22 HydrophobicContact CB-CB 4.18Å; A17-R22 PolarHBondContact O-N 3.45Å; A20-R22 HydrophobicContact CB-CB 4.46Å; A20-R22 HydrophobicContact CB-CG 3.9Å; A20-R22 PolarHBondContact O-N 2.96Å; R22-E24 VanDerWaalsContact C-N 3.32Å; R22-E24 PolarHBondContact O-N 3.21Å; R22-E25 HydrophobicContact CB-CB 4.4Å; R22-E25 WeakPolarHBondContact CB-OE2 3.36Å; R22-E25 IonicContact CZ-OE1 2.64Å; R22-E25 VanDerWaalsContact CZ-OE1 3.29Å; R22-E25 IonicContact CZ-OE2 3.55Å; R22-E25 IonicContact NE-OE1 3.49Å; R22-E25 PolarHBondContact NE-OE1 3.33Å; R22-E25 IonicContact NE-OE2 3.28Å; R22-E25 PolarHBondContact NE-OE2 2.93Å; R22-E25 IonicContact NH2-OE1 3.4Å; R22-E25 PolarHBondContact NH2-OE1 3.12Å; R22-E25 IonicContact NH2-OE2 2.73Å; R22-E25 PolarHBondContact O-N 3.23Å; R22-M26 PolarHBondContact O-N 3.38Å
23	Y	98.5	Very high	98.3	Very high	55 Å²	55	59 Å²	59	22%	0.216	29%	0.289	C	S	.	.	H	α-helix	trans	-67.8	-25.7	-168.8	-57.8	-69.4	0	0	0	114.9	E21 M26 V27 V50 N54	E21-Y23 HydrophobicContact CB-CE2 3.92Å; E21-Y23 WeakPolarHBondContact O-CD2 3.42Å; E21-Y23 PolarHBondContact O-N 2.94Å; Y23-M26 HydrophobicContact CD1-SD 4.08Å; Y23-M26 WeakPolarHBondContact O-CB 3.39Å; Y23-M26 PolarHBondContact O-N 3.23Å; Y23-V27 WeakPolarHBondContact O-CG2 3.43Å; Y23-V27 PolarHBondContact O-N 3.32Å; Y23-V50 HydrophobicContact CE1-CG1 4.3Å; Y23-N54 HydrophobicContact CD1-CB 3.56Å; Y23-N54 HydrophobicContact CD2-CB 3.44Å; Y23-N54 VanDerWaalsContact CD2-CB 3.44Å; Y23-N54 HydrophobicContact CE1-CB 3.86Å; Y23-N54 VanDerWaalsContact CE1-CG 3.47Å; Y23-N54 VanDerWaalsContact CE1-ND2 3.29Å; Y23-N54 WeakPolarHBondContact CE1-ND2 3.5Å; Y23-N54 HydrophobicContact CE2-CB 3.74Å; Y23-N54 HydrophobicContact CG-CB 3.33Å; Y23-N54 VanDerWaalsContact CZ-CG 3.4Å
24	E	98	Very high	98.2	Very high	82 Å²	82	55.7 Å²	55.7	38%	0.383	27%	0.268	S	S	.	.	H	α-helix	trans	-67	-44	174.6	-60.3	-73.8	-174.8	0	0	110.5	R22 M26 V27 E28 V55 R59	R22-E24 VanDerWaalsContact C-N 3.32Å; R22-E24 PolarHBondContact O-N 3.21Å; E24-M26 VanDerWaalsContact C-N 3.33Å; E24-M26 PolarHBondContact O-N 3.24Å; E24-V27 WeakPolarHBondContact O-CB 3.48Å; E24-V27 PolarHBondContact O-N 2.87Å; E24-E28 PolarHBondContact O-N 3.46Å; E24-V55 HydrophobicContact CG-CG2 4.2Å; E24-V55 WeakPolarHBondContact OE1-CG1 3.3Å; E24-R59 IonicContact OE1-CZ 3.47Å; E24-R59 IonicContact OE1-NH1 2.64Å; E24-R59 PolarHBondContact OE1-NH1 2.84Å; E24-R59 IonicContact OE1-NH2 2.69Å; E24-R59 PolarHBondContact OE1-NH2 3.44Å; E24-R59 VanDerWaalsContact OE1-NH2 3.13Å
25	E	98.3	Very high	98	Very high	63 Å²	63	58.9 Å²	58.9	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-67.1	-34.7	174	-68.6	78.8	-179.4	0	0	112.2	A17 R22 V27 E28 A29	A17-E25 HydrophobicContact CB-CB 4.23Å; R22-E25 HydrophobicContact CB-CB 4.4Å; R22-E25 WeakPolarHBondContact CB-OE2 3.36Å; R22-E25 IonicContact CZ-OE1 2.64Å; R22-E25 VanDerWaalsContact CZ-OE1 3.29Å; R22-E25 IonicContact CZ-OE2 3.55Å; R22-E25 IonicContact NE-OE1 3.49Å; R22-E25 PolarHBondContact NE-OE1 3.33Å; R22-E25 IonicContact NE-OE2 3.28Å; R22-E25 PolarHBondContact NE-OE2 2.93Å; R22-E25 IonicContact NH2-OE1 3.4Å; R22-E25 PolarHBondContact NH2-OE1 3.12Å; R22-E25 IonicContact NH2-OE2 2.73Å; R22-E25 PolarHBondContact O-N 3.23Å; E25-V27 VanDerWaalsContact C-N 3.34Å; E25-E28 PolarHBondContact O-N 3.25Å; E25-A29 WeakPolarHBondContact O-CB 3.4Å; E25-A29 PolarHBondContact O-N 3.05Å
26	M	98.3	Very high	97.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-44.8	173	-170.2	-174.6	-170	0	0	111	A14 A17 E18 R22 Y23 E24 A29 M30 L47 V50 G51	A14-M26 HydrophobicContact CB-CG 4.18Å; A17-M26 HydrophobicContact CB-CB 3.88Å; E18-M26 HydrophobicContact CB-CE 3.83Å; E18-M26 HydrophobicContact CB-SD 4.02Å; E18-M26 HydrophobicContact CG-CE 4.08Å; E18-M26 HydrophobicContact CG-SD 4.43Å; R22-M26 PolarHBondContact O-N 3.38Å; Y23-M26 HydrophobicContact CD1-SD 4.08Å; Y23-M26 WeakPolarHBondContact O-CB 3.39Å; Y23-M26 PolarHBondContact O-N 3.23Å; E24-M26 VanDerWaalsContact C-N 3.33Å; E24-M26 PolarHBondContact O-N 3.24Å; M26-A29 PolarHBondContact O-N 3.37Å; M26-M30 WeakPolarHBondContact O-CB 3.33Å; M26-M30 WeakPolarHBondContact O-CG 3.3Å; M26-M30 PolarHBondContact O-N 3.22Å; M26-L47 HydrophobicContact CE-CB 3.8Å; M26-L47 HydrophobicContact CE-CD2 3.38Å; M26-L47 HydrophobicContact CE-CG 4.2Å; M26-L47 WeakPolarHBondContact CE-O 3.14Å; M26-V50 HydrophobicContact CE-CB 4.05Å; M26-V50 HydrophobicContact CE-CG1 4.02Å; M26-V50 HydrophobicContact SD-CG1 4.12Å; M26-G51 VanDerWaalsContact SD-CA 3.52Å
27	V	98.6	Very high	97.7	Very high	10 Å²	10	59.6 Å²	59.6	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-49.5	174.5	164.5	0	0	0	0	110.6	Y23 E24 E25 A29 M30 K31 G51 Y52 V55	Y23-V27 WeakPolarHBondContact O-CG2 3.43Å; Y23-V27 PolarHBondContact O-N 3.32Å; E24-V27 WeakPolarHBondContact O-CB 3.48Å; E24-V27 PolarHBondContact O-N 2.87Å; E25-V27 VanDerWaalsContact C-N 3.34Å; V27-A29 PolarHBondContact O-N 3.24Å; V27-M30 PolarHBondContact O-N 3.49Å; V27-K31 HydrophobicContact CG1-CD 3.79Å; V27-K31 HydrophobicContact CG1-CG 4.23Å; V27-K31 VanDerWaalsContact O-CG 3.24Å; V27-K31 WeakPolarHBondContact O-CG 3.39Å; V27-K31 PolarHBondContact O-N 3.21Å; V27-G51 VanDerWaalsContact CG2-C 3.45Å; V27-Y52 HydrophobicContact CB-CE2 4.42Å; V27-Y52 HydrophobicContact CG1-CD1 4.22Å; V27-Y52 HydrophobicContact CG1-CD2 4.18Å; V27-Y52 HydrophobicContact CG1-CE1 3.67Å; V27-Y52 HydrophobicContact CG1-CE2 3.64Å; V27-Y52 HydrophobicContact CG1-CG 4.46Å; V27-Y52 HydrophobicContact CG2-CD1 4.03Å; V27-Y52 HydrophobicContact CG2-CD2 3.86Å; V27-Y52 HydrophobicContact CG2-CE1 4.33Å; V27-Y52 HydrophobicContact CG2-CE2 4.19Å; V27-Y52 HydrophobicContact CG2-CG 3.79Å; V27-V55 HydrophobicContact CG2-CG2 4.15Å
28	E	98.4	Very high	97.4	Very high	126 Å²	126	61.3 Å²	61.3	59%	0.589	30%	0.302	S	S	*	.	H	α-helix	trans	-57.2	-46.8	179.1	-174.2	179.8	-167.6	0	0	112.2	E24 E25 M30 K31 N32	E24-E28 PolarHBondContact O-N 3.46Å; E25-E28 PolarHBondContact O-N 3.25Å; E28-M30 PolarHBondContact O-N 3.44Å; E28-K31 PolarHBondContact O-N 3Å; E28-N32 PolarHBondContact O-N 3.23Å; E28-N32 VanDerWaalsContact O-N 3.14Å; E28-N32 PolarHBondContact O-ND2 3.04Å
29	A	98.4	Very high	97.3	Very high	5 Å²	5	61.3 Å²	61.3	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-45.6	177.1	0	0	0	0	0	111.8	V13 A14 E25 M26 V27 K31 N32 V33	V13-A29 HydrophobicContact CB-CB 4.28Å; V13-A29 HydrophobicContact CG1-CB 3.98Å; A14-A29 HydrophobicContact CB-CB 4.02Å; E25-A29 WeakPolarHBondContact O-CB 3.4Å; E25-A29 PolarHBondContact O-N 3.05Å; M26-A29 PolarHBondContact O-N 3.37Å; V27-A29 PolarHBondContact O-N 3.24Å; A29-K31 PolarHBondContact O-N 3.28Å; A29-N32 WeakPolarHBondContact O-CB 3.46Å; A29-N32 PolarHBondContact O-N 3.24Å; A29-V33 PolarHBondContact O-N 2.95Å
30	M	98.5	Very high	97.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-72.2	-28	-179	-68.4	-52.4	-50.2	0	0	113.6	A14 M26 V27 E28 N32 V33 A34 E44 L47 L48	A14-M30 HydrophobicContact CB-CG 3.8Å; A14-M30 HydrophobicContact CB-SD 3.56Å; A14-M30 VanDerWaalsContact CB-SD 3.56Å; M26-M30 WeakPolarHBondContact O-CB 3.33Å; M26-M30 WeakPolarHBondContact O-CG 3.3Å; M26-M30 PolarHBondContact O-N 3.22Å; V27-M30 PolarHBondContact O-N 3.49Å; E28-M30 PolarHBondContact O-N 3.44Å; M30-N32 VanDerWaalsContact C-N 3.33Å; M30-V33 HydrophobicContact CE-CB 4.09Å; M30-V33 HydrophobicContact CE-CG1 4.33Å; M30-V33 HydrophobicContact CE-CG2 4.14Å; M30-V33 WeakPolarHBondContact O-CB 3.44Å; M30-V33 PolarHBondContact O-N 3.34Å; M30-V33 HydrophobicContact SD-CG2 4.24Å; M30-A34 PolarHBondContact O-N 2.91Å; M30-E44 HydrophobicContact CE-CB 3.89Å; M30-E44 HydrophobicContact CE-CG 4.38Å; M30-E44 VanDerWaalsContact CE-O 3.24Å; M30-E44 WeakPolarHBondContact CE-O 3.42Å; M30-L47 HydrophobicContact CE-CB 4.3Å; M30-L47 HydrophobicContact CG-CB 4.13Å; M30-L47 HydrophobicContact SD-CB 3.81Å; M30-L47 HydrophobicContact SD-CD1 4.25Å; M30-L48 HydrophobicContact CB-CB 4.14Å; M30-L48 HydrophobicContact CB-CD1 3.6Å; M30-L48 HydrophobicContact CB-CG 4.5Å; M30-L48 HydrophobicContact CE-CB 4.28Å; M30-L48 HydrophobicContact CG-CB 4.43Å
31	K	98.1	Very high	97.3	Very high	53 Å²	53	54.5 Å²	54.5	23%	0.23	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-41.2	168.3	-71.2	171.7	74.7	168.7	0	111.4	V27 E28 A29 V33 A34 N35 Y52 D102 V106	V27-K31 HydrophobicContact CG1-CD 3.79Å; V27-K31 HydrophobicContact CG1-CG 4.23Å; V27-K31 VanDerWaalsContact O-CG 3.24Å; V27-K31 WeakPolarHBondContact O-CG 3.39Å; V27-K31 PolarHBondContact O-N 3.21Å; E28-K31 PolarHBondContact O-N 3Å; A29-K31 PolarHBondContact O-N 3.28Å; K31-V33 VanDerWaalsContact C-N 3.26Å; K31-V33 PolarHBondContact O-N 2.88Å; K31-A34 PolarHBondContact O-N 3.42Å; K31-A34 VanDerWaalsContact O-N 3.17Å; K31-N35 WeakPolarHBondContact O-CB 3.32Å; K31-N35 PolarHBondContact O-N 2.61Å; K31-N35 PolarHBondContact O-ND2 2.97Å; K31-N35 PolarHBondContact O-OD1 2.68Å; K31-Y52 VanDerWaalsContact CD-OH 3.31Å; K31-Y52 WeakPolarHBondContact CD-OH 3.31Å; K31-Y52 HydrophobicContact CG-CE2 4.39Å; K31-Y52 WeakPolarHBondContact CG-OH 3.48Å; K31-D102 WeakPolarHBondContact CE-OD1 3.49Å; K31-D102 WeakPolarHBondContact CE-OD2 3.47Å; K31-D102 IonicContact NZ-OD1 3.63Å; K31-D102 PolarHBondContact NZ-OD1 3.44Å; K31-D102 IonicContact NZ-OD2 3.45Å; K31-D102 PolarHBondContact NZ-OD2 2.64Å; K31-V106 HydrophobicContact CG-CG2 4.05Å
32	N	97.7	Very high	97.1	Very high	56 Å²	56	51.5 Å²	51.5	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-35.2	175.1	-69.3	-46.2	0	0	0	112	F10 E28 A29 M30 L36	F10-N32 HydrophobicContact CD1-CB 3.7Å; F10-N32 HydrophobicContact CD2-CB 3.7Å; F10-N32 HydrophobicContact CE1-CB 3.64Å; F10-N32 HydrophobicContact CE2-CB 3.65Å; F10-N32 HydrophobicContact CG-CB 3.74Å; F10-N32 HydrophobicContact CZ-CB 3.63Å; E28-N32 PolarHBondContact O-N 3.23Å; E28-N32 VanDerWaalsContact O-N 3.14Å; E28-N32 PolarHBondContact O-ND2 3.04Å; A29-N32 WeakPolarHBondContact O-CB 3.46Å; A29-N32 PolarHBondContact O-N 3.24Å; M30-N32 VanDerWaalsContact C-N 3.33Å; N32-L36 WeakPolarHBondContact O-CG 3.41Å
33	V	97.8	Very high	97.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-47	171.4	-178.3	0	0	0	0	111.3	R7 F10 V11 A29 M30 K31 N35 L36 L40	R7-V33 HydrophobicContact CG-CG1 4.17Å; F10-V33 HydrophobicContact CB-CG2 3.5Å; F10-V33 VanDerWaalsContact CB-CG2 3.5Å; F10-V33 HydrophobicContact CG-CG2 4.43Å; V11-V33 HydrophobicContact CG2-CG2 3.88Å; A29-V33 PolarHBondContact O-N 2.95Å; M30-V33 HydrophobicContact CE-CB 4.09Å; M30-V33 HydrophobicContact CE-CG1 4.33Å; M30-V33 HydrophobicContact CE-CG2 4.14Å; M30-V33 WeakPolarHBondContact O-CB 3.44Å; M30-V33 PolarHBondContact O-N 3.34Å; M30-V33 HydrophobicContact SD-CG2 4.24Å; K31-V33 VanDerWaalsContact C-N 3.26Å; K31-V33 PolarHBondContact O-N 2.88Å; V33-N35 VanDerWaalsContact C-N 3.3Å; V33-N35 PolarHBondContact O-N 3.5Å; V33-L36 WeakPolarHBondContact O-CB 3.28Å; V33-L36 PolarHBondContact O-N 3.45Å; V33-L36 VanDerWaalsContact O-N 3.12Å; V33-L40 HydrophobicContact CG1-CD2 3.57Å
34	A	96.8	Very high	97.1	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-42.1	178.7	0	0	0	0	0	111.9	M30 K31 L36 N37 V106 Y110 L111	M30-A34 PolarHBondContact O-N 2.91Å; K31-A34 PolarHBondContact O-N 3.42Å; K31-A34 VanDerWaalsContact O-N 3.17Å; A34-L36 PolarHBondContact O-N 3.13Å; A34-N37 PolarHBondContact O-N 3Å; A34-V106 HydrophobicContact CB-CG1 3.71Å; A34-Y110 WeakPolarHBondContact O-CB 3.43Å; A34-L111 HydrophobicContact CB-CD2 3.73Å; A34-L111 HydrophobicContact CB-CG 4.32Å
35	N	95.3	Very high	97	Very high	67 Å²	67	44.4 Å²	44.4	36%	0.358	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.4	178.7	-68.9	-14.3	0	0	0	114.2	K31 V33 N37 Y110	K31-N35 WeakPolarHBondContact O-CB 3.32Å; K31-N35 PolarHBondContact O-N 2.61Å; K31-N35 PolarHBondContact O-ND2 2.97Å; K31-N35 PolarHBondContact O-OD1 2.68Å; V33-N35 VanDerWaalsContact C-N 3.3Å; V33-N35 PolarHBondContact O-N 3.5Å; N35-N37 PolarHBondContact O-N 3.35Å; N35-N37 PolarHBondContact O-ND2 2.94Å; N35-Y110 VanDerWaalsContact OD1-CE2 3.27Å; N35-Y110 WeakPolarHBondContact OD1-CE2 3.48Å
36	L	95.7	Very high	97	Very high	52 Å²	52	45.2 Å²	45.2	27%	0.272	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-4	173.7	-58.8	177.4	0	0	0	113	R7 N32 V33 A34 V38	R7-L36 HydrophobicContact CB-CD1 3.61Å; R7-L36 HydrophobicContact CG-CD1 4.21Å; N32-L36 WeakPolarHBondContact O-CG 3.41Å; V33-L36 WeakPolarHBondContact O-CB 3.28Å; V33-L36 PolarHBondContact O-N 3.45Å; V33-L36 VanDerWaalsContact O-N 3.12Å; A34-L36 PolarHBondContact O-N 3.13Å; L36-V38 VanDerWaalsContact C-N 3.3Å; L36-V38 HydrophobicContact CB-CG1 4.39Å; L36-V38 HydrophobicContact CB-CG2 4.08Å; L36-V38 PolarHBondContact O-N 3.13Å
37	N	93.7	Very high	97	Very high	98 Å²	98	45.6 Å²	45.6	52%	0.524	24%	0.238	S	C	.	.			trans	53.6	46.4	-179.8	-65	-73	0	0	0	112.3	A34 N35 Y110	A34-N37 PolarHBondContact O-N 3Å; N35-N37 PolarHBondContact O-N 3.35Å; N35-N37 PolarHBondContact O-ND2 2.94Å; N37-Y110 WeakPolarHBondContact OD1-CD1 3.37Å
38	V	93.9	Very high	97	Very high	44 Å²	44	45.1 Å²	45.1	27%	0.267	24%	0.235	S	C	.	.			trans	-120.5	146.1	177.8	-65.8	0	0	0	0	109.4	R7 L36 L40	R7-V38 VanDerWaalsContact NH1-CG2 3.26Å; L36-V38 VanDerWaalsContact C-N 3.3Å; L36-V38 HydrophobicContact CB-CG1 4.39Å; L36-V38 HydrophobicContact CB-CG2 4.08Å; L36-V38 PolarHBondContact O-N 3.13Å; V38-L40 PolarHBondContact O-N 3.12Å
39	E	96.2	Very high	97	Very high	73 Å²	73	40.8 Å²	40.8	34%	0.341	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-61.6	128.6	170.6	-169.1	173.5	69.5	0	0	109.7	R7 S114 S116	R7-E39 PolarHBondContact NH2-O 2.92Å; E39-S114 WeakPolarHBondContact CB-O 3.37Å; E39-S116 VanDerWaalsContact CD-OG 3.24Å; E39-S116 PolarHBondContact OE1-OG 2.86Å; E39-S116 WeakPolarHBondContact OE2-CA 3.4Å; E39-S116 VanDerWaalsContact OE2-CB 3.31Å; E39-S116 WeakPolarHBondContact OE2-CB 3.42Å; E39-S116 PolarHBondContact OE2-N 2.71Å; E39-S116 PolarHBondContact OE2-OG 3.18Å
40	L	97.4	Very high	97	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-76.5	134.5	176.8	-61.3	-164.9	0	0	0	110.3	V33 V38 E44 R45 L48 L111 F124	V33-L40 HydrophobicContact CG1-CD2 3.57Å; V38-L40 PolarHBondContact O-N 3.12Å; L40-E44 HydrophobicContact CB-CB 4.08Å; L40-E44 HydrophobicContact CD1-CB 4.48Å; L40-E44 HydrophobicContact CD2-CB 4.36Å; L40-R45 HydrophobicContact CB-CG 3.5Å; L40-R45 HydrophobicContact CD1-CG 4.24Å; L40-R45 HydrophobicContact CG-CG 4.47Å; L40-L48 HydrophobicContact CD1-CD2 4.23Å; L40-L111 HydrophobicContact CD1-CD2 3.54Å; L40-L111 HydrophobicContact CG-CD2 3.84Å; L40-F124 HydrophobicContact CD1-CZ 4.21Å
41	T	96.7	Very high	97	Very high	72 Å²	72	42.7 Å²	42.7	44%	0.442	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-65	164.2	167.6	63.5	0	0	0	0	111	E43 E44 R45	T41-E43 VanDerWaalsContact C-N 3.27Å; T41-E43 PolarHBondContact O-N 2.93Å; T41-E44 WeakPolarHBondContact CB-OE2 3.5Å; T41-E44 WeakPolarHBondContact CG2-OE2 3.29Å; T41-E44 PolarHBondContact N-OE2 3.49Å; T41-E44 PolarHBondContact O-N 3Å; T41-E44 VanDerWaalsContact O-N 3.15Å; T41-E44 VanDerWaalsContact OG1-CG 3.28Å; T41-E44 WeakPolarHBondContact OG1-CG 3.37Å; T41-E44 PolarHBondContact OG1-N 3.01Å; T41-E44 PolarHBondContact OG1-OE2 2.94Å; T41-R45 WeakPolarHBondContact O-CG 3.3Å; T41-R45 PolarHBondContact O-N 3.41Å
42	V	95.4	Very high	97	Very high	81 Å²	81	40.3 Å²	40.3	49%	0.491	22%	0.219	S	C	.	.	H	α-helix	trans	-53.8	-45.2	176.4	178.7	0	0	0	0	111.5	E44 R45 N46	V42-E44 PolarHBondContact O-N 3.38Å; V42-R45 PolarHBondContact O-N 3.46Å; V42-N46 WeakPolarHBondContact O-CB 3.16Å; V42-N46 PolarHBondContact O-N 2.89Å; V42-N46 PolarHBondContact O-ND2 3.25Å
43	E	97	Very high	97	Very high	103 Å²	103	44.3 Å²	44.3	48%	0.481	23%	0.234	S	C	.	.	H	α-helix	trans	-61.1	-45.6	178.4	-173.6	178.7	-145.8	0	0	111.6	K15 T41 N46 L47	K15-E43 VanDerWaalsContact CE-CD 3.42Å; K15-E43 WeakPolarHBondContact CE-OE1 3.38Å; K15-E43 IonicContact NZ-OE1 3.78Å; K15-E43 PolarHBondContact NZ-OE1 3.09Å; K15-E43 IonicContact NZ-OE2 2.83Å; K15-E43 PolarHBondContact NZ-OE2 2.84Å; T41-E43 VanDerWaalsContact C-N 3.27Å; T41-E43 PolarHBondContact O-N 2.93Å; E43-N46 WeakPolarHBondContact O-CB 3.27Å; E43-N46 PolarHBondContact O-N 3.44Å; E43-L47 HydrophobicContact CG-CD1 4.33Å; E43-L47 WeakPolarHBondContact O-CG 3.43Å; E43-L47 PolarHBondContact O-N 3.2Å
44	E	98.1	Very high	97.1	Very high	11 Å²	11	47 Å²	47	5%	0.051	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-39.3	-179.7	-70.3	163.2	144	0	0	112.7	R7 V11 M30 L40 T41 V42 N46 L47 L48	R7-E44 IonicContact CZ-OE1 3.56Å; R7-E44 IonicContact CZ-OE2 2.8Å; R7-E44 IonicContact NE-OE1 3.13Å; R7-E44 PolarHBondContact NE-OE1 2.99Å; R7-E44 IonicContact NE-OE2 2.6Å; R7-E44 VanDerWaalsContact NH2-CD 3.34Å; R7-E44 IonicContact NH2-OE1 3.92Å; R7-E44 PolarHBondContact NH2-OE1 3.13Å; R7-E44 IonicContact NH2-OE2 3.37Å; R7-E44 PolarHBondContact NH2-OE2 3.26Å; V11-E44 HydrophobicContact CG2-CG 3.76Å; V11-E44 WeakPolarHBondContact CG2-OE1 3.45Å; M30-E44 HydrophobicContact CE-CB 3.89Å; M30-E44 HydrophobicContact CE-CG 4.38Å; M30-E44 VanDerWaalsContact CE-O 3.24Å; M30-E44 WeakPolarHBondContact CE-O 3.42Å; L40-E44 HydrophobicContact CB-CB 4.08Å; L40-E44 HydrophobicContact CD1-CB 4.48Å; L40-E44 HydrophobicContact CD2-CB 4.36Å; T41-E44 WeakPolarHBondContact CB-OE2 3.5Å; T41-E44 WeakPolarHBondContact CG2-OE2 3.29Å; T41-E44 PolarHBondContact N-OE2 3.49Å; T41-E44 PolarHBondContact O-N 3Å; T41-E44 VanDerWaalsContact O-N 3.15Å; T41-E44 VanDerWaalsContact OG1-CG 3.28Å; T41-E44 WeakPolarHBondContact OG1-CG 3.37Å; T41-E44 PolarHBondContact OG1-N 3.01Å; T41-E44 PolarHBondContact OG1-OE2 2.94Å; V42-E44 PolarHBondContact O-N 3.38Å; E44-N46 VanDerWaalsContact C-N 3.28Å; E44-N46 PolarHBondContact O-N 2.64Å; E44-L47 PolarHBondContact O-N 3.27Å; E44-L48 WeakPolarHBondContact O-CB 3.43Å; E44-L48 PolarHBondContact O-N 3.15Å
45	R	97.7	Very high	97.1	Very high	12 Å²	12	47.3 Å²	47.3	5%	0.045	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-40.9	173	-67.6	-167.5	-47.7	-132.6	3.5	111.1	L40 T41 V42 S49 E119 F123 F124	L40-R45 HydrophobicContact CB-CG 3.5Å; L40-R45 HydrophobicContact CD1-CG 4.24Å; L40-R45 HydrophobicContact CG-CG 4.47Å; T41-R45 WeakPolarHBondContact O-CG 3.3Å; T41-R45 PolarHBondContact O-N 3.41Å; V42-R45 PolarHBondContact O-N 3.46Å; R45-S49 VanDerWaalsContact O-CB 3.31Å; R45-S49 WeakPolarHBondContact O-CB 3.46Å; R45-S49 PolarHBondContact O-N 3.49Å; R45-E119 IonicContact CZ-OE1 2.89Å; R45-E119 IonicContact NH1-OE1 3.14Å; R45-E119 IonicContact NH2-OE1 3.91Å; R45-E119 PolarHBondContact NH2-OE1 2.95Å; R45-F123 HydrophobicContact CB-CD1 4.4Å; R45-F123 HydrophobicContact CB-CE1 4Å; R45-F123 HydrophobicContact CB-CZ 4.19Å; R45-F124 HydrophobicContact CG-CE1 4.16Å; R45-F124 HydrophobicContact CG-CZ 3.68Å
46	N	96.8	Very high	97.3	Very high	81 Å²	81	44.2 Å²	44.2	43%	0.433	23%	0.234	S	C	.	.	H	α-helix	trans	-64.5	-45.4	176.7	-71.6	-15.5	0	0	0	111.3	V42 E43 E44 S49 V50	V42-N46 WeakPolarHBondContact O-CB 3.16Å; V42-N46 PolarHBondContact O-N 2.89Å; V42-N46 PolarHBondContact O-ND2 3.25Å; E43-N46 WeakPolarHBondContact O-CB 3.27Å; E43-N46 PolarHBondContact O-N 3.44Å; E44-N46 VanDerWaalsContact C-N 3.28Å; E44-N46 PolarHBondContact O-N 2.64Å; N46-S49 PolarHBondContact O-N 2.73Å; N46-V50 WeakPolarHBondContact O-CB 3.46Å; N46-V50 VanDerWaalsContact O-CG2 3.3Å; N46-V50 WeakPolarHBondContact O-CG2 3.48Å; N46-V50 PolarHBondContact O-N 2.63Å
47	L	98.5	Very high	97.4	Very high	7 Å²	7	43 Å²	43	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-58.8	-49.3	175.9	-71.1	169.4	0	0	0	111.7	V11 A14 K15 E18 M26 M30 E43 E44 S49 V50 G51	V11-L47 HydrophobicContact CG1-CD1 4.03Å; A14-L47 HydrophobicContact CB-CD1 4.49Å; K15-L47 HydrophobicContact CG-CD1 3.97Å; K15-L47 HydrophobicContact CG-CD2 4.1Å; E18-L47 WeakPolarHBondContact OE2-CD2 3.35Å; M26-L47 HydrophobicContact CE-CB 3.8Å; M26-L47 HydrophobicContact CE-CD2 3.38Å; M26-L47 HydrophobicContact CE-CG 4.2Å; M26-L47 WeakPolarHBondContact CE-O 3.14Å; M30-L47 HydrophobicContact CE-CB 4.3Å; M30-L47 HydrophobicContact CG-CB 4.13Å; M30-L47 HydrophobicContact SD-CB 3.81Å; M30-L47 HydrophobicContact SD-CD1 4.25Å; E43-L47 HydrophobicContact CG-CD1 4.33Å; E43-L47 WeakPolarHBondContact O-CG 3.43Å; E43-L47 PolarHBondContact O-N 3.2Å; E44-L47 PolarHBondContact O-N 3.27Å; L47-S49 VanDerWaalsContact C-N 3.29Å; L47-S49 PolarHBondContact O-N 3.44Å; L47-V50 PolarHBondContact O-N 2.96Å; L47-G51 PolarHBondContact O-N 2.9Å
48	L	98.6	Very high	97.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56	-46.9	176.2	180	78.8	0	0	0	111.1	M30 L40 E44 G51 Y52 I103 L111 F124	M30-L48 HydrophobicContact CB-CB 4.14Å; M30-L48 HydrophobicContact CB-CD1 3.6Å; M30-L48 HydrophobicContact CB-CG 4.5Å; M30-L48 HydrophobicContact CE-CB 4.28Å; M30-L48 HydrophobicContact CG-CB 4.43Å; L40-L48 HydrophobicContact CD1-CD2 4.23Å; E44-L48 WeakPolarHBondContact O-CB 3.43Å; E44-L48 PolarHBondContact O-N 3.15Å; L48-G51 PolarHBondContact O-N 2.8Å; L48-Y52 HydrophobicContact CD1-CD2 3.82Å; L48-Y52 HydrophobicContact CD1-CE2 3.68Å; L48-Y52 HydrophobicContact CG-CD2 4.16Å; L48-Y52 HydrophobicContact CG-CE2 4.45Å; L48-Y52 PolarHBondContact O-N 3.29Å; L48-Y52 VanDerWaalsContact O-N 3.14Å; L48-I103 HydrophobicContact CD2-CD1 4.46Å; L48-L111 HydrophobicContact CD2-CD1 3.38Å; L48-L111 HydrophobicContact CD2-CD2 4.45Å; L48-F124 HydrophobicContact CD2-CE1 4.19Å
49	S	98.1	Very high	97.8	Very high	36 Å²	36	42 Å²	42	25%	0.252	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-46.2	-179.7	-169.8	0	0	0	0	112.2	R45 N46 L47 K53	R45-S49 VanDerWaalsContact O-CB 3.31Å; R45-S49 WeakPolarHBondContact O-CB 3.46Å; R45-S49 PolarHBondContact O-N 3.49Å; N46-S49 PolarHBondContact O-N 2.73Å; L47-S49 VanDerWaalsContact C-N 3.29Å; L47-S49 PolarHBondContact O-N 3.44Å; S49-K53 WeakPolarHBondContact O-CB 3.41Å; S49-K53 PolarHBondContact O-N 3.36Å
50	V	98.3	Very high	97.9	Very high	44 Å²	44	40 Å²	40	27%	0.267	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-45.7	178.3	168	0	0	0	0	111.1	Y23 M26 N46 L47 K53 N54	Y23-V50 HydrophobicContact CE1-CG1 4.3Å; M26-V50 HydrophobicContact CE-CB 4.05Å; M26-V50 HydrophobicContact CE-CG1 4.02Å; M26-V50 HydrophobicContact SD-CG1 4.12Å; N46-V50 WeakPolarHBondContact O-CB 3.46Å; N46-V50 VanDerWaalsContact O-CG2 3.3Å; N46-V50 WeakPolarHBondContact O-CG2 3.48Å; N46-V50 PolarHBondContact O-N 2.63Å; L47-V50 PolarHBondContact O-N 2.96Å; V50-K53 PolarHBondContact O-N 3.32Å; V50-N54 PolarHBondContact O-N 2.84Å; V50-N54 PolarHBondContact O-ND2 2.82Å
51	G	98.7	Very high	98	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-58.1	178.5	0	0	0	0	0	111.6	M26 V27 L47 L48 K53 N54 V55	M26-G51 VanDerWaalsContact SD-CA 3.52Å; V27-G51 VanDerWaalsContact CG2-C 3.45Å; L47-G51 PolarHBondContact O-N 2.9Å; L48-G51 PolarHBondContact O-N 2.8Å; G51-K53 VanDerWaalsContact C-N 3.34Å; G51-K53 PolarHBondContact O-N 2.99Å; G51-N54 PolarHBondContact O-N 3.48Å; G51-V55 WeakPolarHBondContact O-CG2 3.31Å; G51-V55 PolarHBondContact O-N 2.83Å; G51-V55 VanDerWaalsContact O-N 3.12Å
52	Y	98.7	Very high	98.1	Very high	3 Å²	3	40.9 Å²	40.9	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-34.9	-179	-88.5	-74.1	0	0	0	113	V27 K31 L48 V56 I99 D102 I103 M127 Y131	V27-Y52 HydrophobicContact CB-CE2 4.42Å; V27-Y52 HydrophobicContact CG1-CD1 4.22Å; V27-Y52 HydrophobicContact CG1-CD2 4.18Å; V27-Y52 HydrophobicContact CG1-CE1 3.67Å; V27-Y52 HydrophobicContact CG1-CE2 3.64Å; V27-Y52 HydrophobicContact CG1-CG 4.46Å; V27-Y52 HydrophobicContact CG2-CD1 4.03Å; V27-Y52 HydrophobicContact CG2-CD2 3.86Å; V27-Y52 HydrophobicContact CG2-CE1 4.33Å; V27-Y52 HydrophobicContact CG2-CE2 4.19Å; V27-Y52 HydrophobicContact CG2-CG 3.79Å; K31-Y52 VanDerWaalsContact CD-OH 3.31Å; K31-Y52 WeakPolarHBondContact CD-OH 3.31Å; K31-Y52 HydrophobicContact CG-CE2 4.39Å; K31-Y52 WeakPolarHBondContact CG-OH 3.48Å; L48-Y52 HydrophobicContact CD1-CD2 3.82Å; L48-Y52 HydrophobicContact CD1-CE2 3.68Å; L48-Y52 HydrophobicContact CG-CD2 4.16Å; L48-Y52 HydrophobicContact CG-CE2 4.45Å; L48-Y52 PolarHBondContact O-N 3.29Å; L48-Y52 VanDerWaalsContact O-N 3.14Å; Y52-V56 WeakPolarHBondContact O-CB 3.46Å; Y52-V56 VanDerWaalsContact O-CG1 3.25Å; Y52-V56 WeakPolarHBondContact O-CG1 3.1Å; Y52-V56 PolarHBondContact O-N 2.95Å; Y52-I99 HydrophobicContact CD1-CG2 4.36Å; Y52-D102 PolarHBondContact OH-OD2 3.35Å; Y52-I103 HydrophobicContact CD1-CB 3.8Å; Y52-I103 HydrophobicContact CD1-CG1 4.46Å; Y52-I103 HydrophobicContact CD1-CG2 4.31Å; Y52-I103 HydrophobicContact CD2-CB 4.45Å; Y52-I103 HydrophobicContact CD2-CD1 3.77Å; Y52-I103 HydrophobicContact CD2-CG1 4.39Å; Y52-I103 HydrophobicContact CE1-CB 3.61Å; Y52-I103 HydrophobicContact CE1-CG2 4.37Å; Y52-I103 HydrophobicContact CE2-CB 4.26Å; Y52-I103 HydrophobicContact CE2-CD1 3.67Å; Y52-I103 HydrophobicContact CE2-CG1 4.43Å; Y52-I103 HydrophobicContact CG-CB 4.21Å; Y52-I103 HydrophobicContact CG-CD1 4.25Å; Y52-I103 HydrophobicContact CG-CG1 4.39Å; Y52-M127 HydrophobicContact CD2-CE 4.45Å; Y52-M127 HydrophobicContact CG-CE 4.35Å; Y52-Y131 VanDerWaalsContact CB-OH 3.27Å; Y52-Y131 WeakPolarHBondContact CB-OH 3.45Å; Y52-Y131 PolarHBondContact O-OH 3.44Å
53	K	98.2	Very high	98.2	Very high	140 Å²	140	38.6 Å²	38.6	61%	0.609	21%	0.214	S	C	*	.	H	α-helix	trans	-63.1	-41.6	177.1	179.6	-179.9	176.8	-176.9	0	111.7	S49 V50 G51 V56 G57 Y131	S49-K53 WeakPolarHBondContact O-CB 3.41Å; S49-K53 PolarHBondContact O-N 3.36Å; V50-K53 PolarHBondContact O-N 3.32Å; G51-K53 VanDerWaalsContact C-N 3.34Å; G51-K53 PolarHBondContact O-N 2.99Å; K53-V56 WeakPolarHBondContact O-CG1 3.37Å; K53-G57 WeakPolarHBondContact O-CA 3.24Å; K53-G57 PolarHBondContact O-N 3.24Å; K53-Y131 PolarHBondContact N-OH 3.32Å
54	N	98.4	Very high	98.3	Very high	58 Å²	58	38.6 Å²	38.6	31%	0.31	21%	0.209	S	C	.	.	H	α-helix	trans	-70.9	-45.3	178.6	-82.1	-75.3	0	0	0	111.8	Y23 V50 G51 G57 A58	Y23-N54 HydrophobicContact CD1-CB 3.56Å; Y23-N54 HydrophobicContact CD2-CB 3.44Å; Y23-N54 VanDerWaalsContact CD2-CB 3.44Å; Y23-N54 HydrophobicContact CE1-CB 3.86Å; Y23-N54 VanDerWaalsContact CE1-CG 3.47Å; Y23-N54 VanDerWaalsContact CE1-ND2 3.29Å; Y23-N54 WeakPolarHBondContact CE1-ND2 3.5Å; Y23-N54 HydrophobicContact CE2-CB 3.74Å; Y23-N54 HydrophobicContact CG-CB 3.33Å; Y23-N54 VanDerWaalsContact CZ-CG 3.4Å; V50-N54 PolarHBondContact O-N 2.84Å; V50-N54 PolarHBondContact O-ND2 2.82Å; G51-N54 PolarHBondContact O-N 3.48Å; N54-G57 PolarHBondContact O-N 3.3Å; N54-A58 PolarHBondContact O-N 2.9Å
55	V	98.4	Very high	98.3	Very high	6 Å²	6	43 Å²	43	4%	0.036	23%	0.232	C	C	.	.	H	α-helix	trans	-59.4	-50.1	178	171.2	0	0	0	0	111.3	E24 V27 G51 R59 I99	E24-V55 HydrophobicContact CG-CG2 4.2Å; E24-V55 WeakPolarHBondContact OE1-CG1 3.3Å; V27-V55 HydrophobicContact CG2-CG2 4.15Å; G51-V55 WeakPolarHBondContact O-CG2 3.31Å; G51-V55 PolarHBondContact O-N 2.83Å; G51-V55 VanDerWaalsContact O-N 3.12Å; V55-R59 PolarHBondContact O-N 3.18Å; V55-I99 HydrophobicContact CG1-CD1 3.62Å; V55-I99 HydrophobicContact CG1-CG1 3.84Å; V55-I99 HydrophobicContact CG1-CG2 4.1Å
56	V	98.5	Very high	98.4	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-68.6	-37.6	178.9	81.5	0	0	0	0	111.8	Y52 K53 A58 R59 R60 L96 I99 Y131 Y134	Y52-V56 WeakPolarHBondContact O-CB 3.46Å; Y52-V56 VanDerWaalsContact O-CG1 3.25Å; Y52-V56 WeakPolarHBondContact O-CG1 3.1Å; Y52-V56 PolarHBondContact O-N 2.95Å; K53-V56 WeakPolarHBondContact O-CG1 3.37Å; V56-A58 PolarHBondContact O-N 2.97Å; V56-R59 PolarHBondContact O-N 3.31Å; V56-R60 HydrophobicContact CG2-CG 4.41Å; V56-R60 WeakPolarHBondContact O-CB 3.46Å; V56-R60 WeakPolarHBondContact O-CG 3.47Å; V56-R60 PolarHBondContact O-N 3.42Å; V56-L96 HydrophobicContact CG2-CD1 3.36Å; V56-I99 HydrophobicContact CB-CG2 3.97Å; V56-I99 HydrophobicContact CG2-CG2 4.13Å; V56-Y131 HydrophobicContact CB-CE1 3.74Å; V56-Y131 HydrophobicContact CG1-CE1 3.85Å; V56-Y131 WeakPolarHBondContact CG1-OH 3.47Å; V56-Y131 HydrophobicContact CG2-CD1 4.17Å; V56-Y131 HydrophobicContact CG2-CE1 3.7Å; V56-Y134 HydrophobicContact CG1-CD2 4.29Å; V56-Y134 HydrophobicContact CG1-CE2 3.98Å; V56-Y134 HydrophobicContact CG2-CD2 3.9Å; V56-Y134 HydrophobicContact CG2-CE2 4.41Å
57	G	98.2	Very high	98.4	Very high	28 Å²	28	40.5 Å²	40.5	29%	0.289	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-45	179.6	0	0	0	0	0	112.3	K53 N54 R59 R60 A61	K53-G57 WeakPolarHBondContact O-CA 3.24Å; K53-G57 PolarHBondContact O-N 3.24Å; N54-G57 PolarHBondContact O-N 3.3Å; G57-R59 PolarHBondContact O-N 3.01Å; G57-R60 PolarHBondContact O-N 3.02Å; G57-A61 WeakPolarHBondContact O-CB 3.34Å; G57-A61 PolarHBondContact O-N 2.89Å
58	A	98.1	Very high	98.4	Very high	52 Å²	52	42.3 Å²	42.3	43%	0.43	24%	0.235	S	C	.	.	H	α-helix	trans	-61.1	-42.2	177.2	0	0	0	0	0	112.4	N54 V56 A61 S62	N54-A58 PolarHBondContact O-N 2.9Å; V56-A58 PolarHBondContact O-N 2.97Å; A58-A61 PolarHBondContact O-N 3.4Å; A58-S62 PolarHBondContact O-N 2.82Å; A58-S62 PolarHBondContact O-OG 2.9Å
59	R	98.5	Very high	98.4	Very high	67 Å²	67	45.6 Å²	45.6	25%	0.253	25%	0.251	S	S	.	.	H	α-helix	trans	-70.6	-41.8	178.2	-88.8	57.9	177.1	-146.9	-5.5	111.7	E24 V55 V56 G57 A61 S62 W63 V92 E95 L96 I99	E24-R59 IonicContact OE1-CZ 3.47Å; E24-R59 IonicContact OE1-NH1 2.64Å; E24-R59 PolarHBondContact OE1-NH1 2.84Å; E24-R59 IonicContact OE1-NH2 2.69Å; E24-R59 PolarHBondContact OE1-NH2 3.44Å; E24-R59 VanDerWaalsContact OE1-NH2 3.13Å; V55-R59 PolarHBondContact O-N 3.18Å; V56-R59 PolarHBondContact O-N 3.31Å; G57-R59 PolarHBondContact O-N 3.01Å; R59-A61 VanDerWaalsContact C-N 3.34Å; R59-A61 PolarHBondContact O-N 3.21Å; R59-S62 WeakPolarHBondContact O-CB 3.49Å; R59-S62 PolarHBondContact O-N 2.85Å; R59-W63 WeakPolarHBondContact O-CB 3.29Å; R59-W63 PolarHBondContact O-N 3.28Å; R59-V92 HydrophobicContact CB-CG1 4.46Å; R59-V92 WeakPolarHBondContact O-CG1 3.33Å; R59-E95 HydrophobicContact CG-CB 4.19Å; R59-E95 IonicContact NE-OE2 3.59Å; R59-E95 PolarHBondContact NE-OE2 3.31Å; R59-L96 HydrophobicContact CB-CB 4.41Å; R59-L96 HydrophobicContact CB-CD1 4.19Å; R59-I99 HydrophobicContact CB-CD1 4.23Å; R59-I99 HydrophobicContact CG-CD1 3.84Å
60	R	98.3	Very high	98.4	Very high	33 Å²	33	44.9 Å²	44.9	13%	0.125	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-40	174	-73.4	178.3	67.7	-130.8	14.1	112.4	V56 G57 W63 R64 L96 Y134 E137	V56-R60 HydrophobicContact CG2-CG 4.41Å; V56-R60 WeakPolarHBondContact O-CB 3.46Å; V56-R60 WeakPolarHBondContact O-CG 3.47Å; V56-R60 PolarHBondContact O-N 3.42Å; G57-R60 PolarHBondContact O-N 3.02Å; R60-W63 PolarHBondContact O-N 3.32Å; R60-R64 WeakPolarHBondContact O-CG 3.43Å; R60-R64 PolarHBondContact O-N 3.07Å; R60-L96 HydrophobicContact CG-CD1 3.73Å; R60-L96 HydrophobicContact CG-CD2 3.8Å; R60-L96 HydrophobicContact CG-CG 4.46Å; R60-Y134 VanDerWaalsContact CZ-CD1 3.43Å; R60-Y134 VanDerWaalsContact NE-CD1 3.34Å; R60-E137 IonicContact CZ-OE1 2.66Å; R60-E137 IonicContact CZ-OE2 2.8Å; R60-E137 IonicContact NE-OE1 3.7Å; R60-E137 PolarHBondContact NE-OE1 3.05Å; R60-E137 IonicContact NE-OE2 3.37Å; R60-E137 PolarHBondContact NE-OE2 3.23Å; R60-E137 VanDerWaalsContact NH2-CD 3.34Å; R60-E137 IonicContact NH2-OE1 3.26Å; R60-E137 PolarHBondContact NH2-OE1 3.39Å; R60-E137 IonicContact NH2-OE2 3.46Å; R60-E137 PolarHBondContact NH2-OE2 3.01Å; R60-E137 VanDerWaalsContact NH2-OE2 3.14Å
61	A	98.5	Very high	98.4	Very high	45 Å²	45	48.9 Å²	48.9	37%	0.372	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-46	174.8	0	0	0	0	0	111.5	G57 A58 R59 W63 R64 I65	G57-A61 WeakPolarHBondContact O-CB 3.34Å; G57-A61 PolarHBondContact O-N 2.89Å; A58-A61 PolarHBondContact O-N 3.4Å; R59-A61 VanDerWaalsContact C-N 3.34Å; R59-A61 PolarHBondContact O-N 3.21Å; A61-W63 VanDerWaalsContact C-N 3.34Å; A61-W63 PolarHBondContact O-N 3.46Å; A61-R64 PolarHBondContact O-N 2.83Å; A61-I65 WeakPolarHBondContact O-CG1 3.4Å; A61-I65 PolarHBondContact O-N 3.35Å
62	S	98.6	Very high	98.3	Very high	50 Å²	50	54.9 Å²	54.9	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-59.1	-45.9	176.3	-58.2	0	0	0	0	111.5	A58 R59 I65 L66	A58-S62 PolarHBondContact O-N 2.82Å; A58-S62 PolarHBondContact O-OG 2.9Å; R59-S62 WeakPolarHBondContact O-CB 3.49Å; R59-S62 PolarHBondContact O-N 2.85Å; S62-I65 PolarHBondContact O-N 3.29Å; S62-L66 WeakPolarHBondContact O-CB 3.47Å; S62-L66 VanDerWaalsContact O-CG 3.3Å; S62-L66 WeakPolarHBondContact O-CG 3.44Å; S62-L66 PolarHBondContact O-N 3.38Å
63	W	98.6	Very high	98.3	Very high	33 Å²	33	56.2 Å²	56.2	13%	0.125	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-50.4	176.6	172.2	76.9	0	0	0	112.2	R59 R60 A61 I65 L66 S67 V92 E93 E137 F138	R59-W63 WeakPolarHBondContact O-CB 3.29Å; R59-W63 PolarHBondContact O-N 3.28Å; R60-W63 PolarHBondContact O-N 3.32Å; A61-W63 VanDerWaalsContact C-N 3.34Å; A61-W63 PolarHBondContact O-N 3.46Å; W63-I65 VanDerWaalsContact C-N 3.31Å; W63-I65 PolarHBondContact O-N 2.96Å; W63-L66 PolarHBondContact O-N 3.48Å; W63-S67 WeakPolarHBondContact O-CB 3.32Å; W63-S67 PolarHBondContact O-N 2.86Å; W63-S67 PolarHBondContact O-OG 3.16Å; W63-S67 VanDerWaalsContact O-OG 3.07Å; W63-V92 HydrophobicContact CB-CG1 3.93Å; W63-E93 PolarHBondContact NE1-OE1 2.91Å; W63-E137 HydrophobicContact CH2-CB 4.05Å; W63-E137 WeakPolarHBondContact CH2-O 3.34Å; W63-E137 HydrophobicContact CZ3-CB 4.15Å; W63-F138 HydrophobicContact CD2-CB 4.26Å; W63-F138 VanDerWaalsContact CE2-CB 3.42Å; W63-F138 HydrophobicContact CH2-CB 4.18Å; W63-F138 HydrophobicContact CZ2-CB 3.4Å
64	R	98.4	Very high	98.3	Very high	103 Å²	103	55.5 Å²	55.5	39%	0.389	29%	0.291	S	S	.	.	H	α-helix	trans	-56.8	-44	177.8	-74.5	-176.3	179.5	85	15.9	112.6	R60 A61 S68 E137	R60-R64 WeakPolarHBondContact O-CG 3.43Å; R60-R64 PolarHBondContact O-N 3.07Å; A61-R64 PolarHBondContact O-N 2.83Å; R64-S68 WeakPolarHBondContact O-CB 3.39Å; R64-S68 PolarHBondContact O-N 2.86Å; R64-E137 IonicContact CZ-OE2 3.01Å; R64-E137 IonicContact NH2-OE1 2.83Å; R64-E137 IonicContact NH2-OE2 3.87Å; R64-E137 PolarHBondContact NH2-OE2 3.02Å
65	I	98.5	Very high	98.2	Very high	103 Å²	103	57.1 Å²	57.1	53%	0.528	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-48.3	178.7	-68.8	167.4	0	0	0	110.1	A61 S62 W63 S67 S68 I69	A61-I65 WeakPolarHBondContact O-CG1 3.4Å; A61-I65 PolarHBondContact O-N 3.35Å; S62-I65 PolarHBondContact O-N 3.29Å; W63-I65 VanDerWaalsContact C-N 3.31Å; W63-I65 PolarHBondContact O-N 2.96Å; I65-S67 PolarHBondContact O-N 2.98Å; I65-S68 PolarHBondContact O-N 2.79Å; I65-I69 HydrophobicContact CG2-CD1 3.66Å; I65-I69 HydrophobicContact CG2-CG1 4.35Å; I65-I69 VanDerWaalsContact O-CG1 3.29Å; I65-I69 WeakPolarHBondContact O-CG1 3.33Å; I65-I69 PolarHBondContact O-N 3.41Å
66	L	98.6	Very high	98.2	Very high	18 Å²	18	63.2 Å²	63.2	9%	0.094	34%	0.338	C	S	.	.	H	α-helix	trans	-61.8	-43.9	179.4	-70.8	169.6	0	0	0	111.9	S62 W63 S68 I69 E70 I85 Y88 R89 V92	S62-L66 WeakPolarHBondContact O-CB 3.47Å; S62-L66 VanDerWaalsContact O-CG 3.3Å; S62-L66 WeakPolarHBondContact O-CG 3.44Å; S62-L66 PolarHBondContact O-N 3.38Å; W63-L66 PolarHBondContact O-N 3.48Å; L66-S68 VanDerWaalsContact C-N 3.32Å; L66-S68 PolarHBondContact O-N 3.01Å; L66-I69 PolarHBondContact O-N 3.27Å; L66-E70 WeakPolarHBondContact O-CB 3.08Å; L66-E70 PolarHBondContact O-N 3.06Å; L66-I85 HydrophobicContact CD2-CG2 4.41Å; L66-I85 WeakPolarHBondContact O-CG2 3.42Å; L66-Y88 HydrophobicContact CD1-CD1 3.96Å; L66-Y88 HydrophobicContact CD1-CE1 4.17Å; L66-Y88 HydrophobicContact CD1-CG 4.16Å; L66-Y88 HydrophobicContact CD2-CD1 3.6Å; L66-Y88 HydrophobicContact CD2-CE1 4.01Å; L66-Y88 HydrophobicContact CD2-CG 4.39Å; L66-Y88 HydrophobicContact CG-CD1 4.45Å; L66-R89 HydrophobicContact CB-CB 4.16Å; L66-R89 HydrophobicContact CB-CG 4.45Å; L66-R89 HydrophobicContact CD1-CB 4.5Å; L66-V92 HydrophobicContact CD1-CB 4.37Å; L66-V92 HydrophobicContact CD1-CG2 3.69Å
67	S	98	Very high	98.1	Very high	23 Å²	23	65.4 Å²	65.4	16%	0.161	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-41.8	174.6	-61.4	0	0	0	0	112	W63 I65 E70 Q71 R89	W63-S67 WeakPolarHBondContact O-CB 3.32Å; W63-S67 PolarHBondContact O-N 2.86Å; W63-S67 PolarHBondContact O-OG 3.16Å; W63-S67 VanDerWaalsContact O-OG 3.07Å; I65-S67 PolarHBondContact O-N 2.98Å; S67-E70 PolarHBondContact O-N 2.89Å; S67-Q71 WeakPolarHBondContact O-CG 3.44Å; S67-Q71 PolarHBondContact O-N 2.96Å; S67-Q71 VanDerWaalsContact O-N 3.16Å; S67-R89 WeakPolarHBondContact OG-CD 3.4Å
68	S	98.3	Very high	98	Very high	45 Å²	45	67.4 Å²	67.4	32%	0.315	37%	0.366	S	S	.	.	H	α-helix	trans	-67.3	-38.8	176.3	-174.8	0	0	0	0	112.8	R64 I65 L66 K72	R64-S68 WeakPolarHBondContact O-CB 3.39Å; R64-S68 PolarHBondContact O-N 2.86Å; I65-S68 PolarHBondContact O-N 2.79Å; L66-S68 VanDerWaalsContact C-N 3.32Å; L66-S68 PolarHBondContact O-N 3.01Å; S68-K72 VanDerWaalsContact O-CG 3.31Å; S68-K72 WeakPolarHBondContact O-CG 3.49Å; S68-K72 PolarHBondContact O-N 3.36Å
69	I	98.3	Very high	97.9	Very high	68 Å²	68	71 Å²	71	35%	0.349	38%	0.378	S	S	.	.	H	α-helix	trans	-69	-40.8	177	-63.8	168.2	0	0	0	110.3	I65 L66 Q71 K72 E73 I85	I65-I69 HydrophobicContact CG2-CD1 3.66Å; I65-I69 HydrophobicContact CG2-CG1 4.35Å; I65-I69 VanDerWaalsContact O-CG1 3.29Å; I65-I69 WeakPolarHBondContact O-CG1 3.33Å; I65-I69 PolarHBondContact O-N 3.41Å; L66-I69 PolarHBondContact O-N 3.27Å; I69-Q71 PolarHBondContact O-N 3.01Å; I69-K72 PolarHBondContact O-N 3.47Å; I69-E73 HydrophobicContact CG2-CG 4.33Å; I69-E73 WeakPolarHBondContact O-CG 3.37Å; I69-E73 PolarHBondContact O-N 3.49Å; I69-I85 HydrophobicContact CG2-CD1 3.72Å; I69-I85 HydrophobicContact CG2-CG1 4.38Å
70	E	98.1	Very high	97.9	Very high	21 Å²	21	72.6 Å²	72.6	10%	0.098	40%	0.395	C	S	.	.	H	α-helix	trans	-55.2	-52.1	175.6	-171.2	178.1	173.5	0	0	110.8	L66 S67 K72 E73 E74 V82 I85 R89	L66-E70 WeakPolarHBondContact O-CB 3.08Å; L66-E70 PolarHBondContact O-N 3.06Å; S67-E70 PolarHBondContact O-N 2.89Å; E70-K72 VanDerWaalsContact C-N 3.31Å; E70-K72 PolarHBondContact O-N 3.21Å; E70-E73 PolarHBondContact O-N 2.83Å; E70-E74 WeakPolarHBondContact O-CB 3.33Å; E70-E74 PolarHBondContact O-N 3.12Å; E70-V82 HydrophobicContact CG-CG1 4.16Å; E70-I85 HydrophobicContact CB-CB 4.49Å; E70-I85 HydrophobicContact CB-CG2 3.74Å; E70-I85 HydrophobicContact CG-CG2 4.41Å; E70-R89 IonicContact OE1-NH2 3.19Å; E70-R89 PolarHBondContact OE1-NH2 3.49Å; E70-R89 IonicContact OE2-CZ 3.99Å; E70-R89 VanDerWaalsContact OE2-CZ 3.26Å; E70-R89 IonicContact OE2-NE 2.74Å; E70-R89 PolarHBondContact OE2-NE 3.45Å; E70-R89 IonicContact OE2-NH2 2.67Å; E70-R89 PolarHBondContact OE2-NH2 3.24Å
71	Q	97.6	Very high	97.9	Very high	128 Å²	128	73.4 Å²	73.4	60%	0.598	41%	0.405	S	S	*	.	H	α-helix	trans	-58.6	-40	177.8	-71.5	173.9	-3.3	0	0	112.7	S67 I69 A75	S67-Q71 WeakPolarHBondContact O-CG 3.44Å; S67-Q71 PolarHBondContact O-N 2.96Å; S67-Q71 VanDerWaalsContact O-N 3.16Å; I69-Q71 PolarHBondContact O-N 3.01Å; Q71-A75 WeakPolarHBondContact O-CB 3.32Å; Q71-A75 PolarHBondContact O-N 2.79Å
72	K	98	Very high	97.9	Very high	126 Å²	126	72.2 Å²	72.2	55%	0.548	39%	0.394	S	S	.	.	H	α-helix	trans	-68.5	-35.9	178.4	-74.1	171.6	-174.5	171.3	0	112.8	S68 I69 E70 K76	S68-K72 VanDerWaalsContact O-CG 3.31Å; S68-K72 WeakPolarHBondContact O-CG 3.49Å; S68-K72 PolarHBondContact O-N 3.36Å; I69-K72 PolarHBondContact O-N 3.47Å; E70-K72 VanDerWaalsContact C-N 3.31Å; E70-K72 PolarHBondContact O-N 3.21Å; K72-K76 WeakPolarHBondContact O-CG 3.29Å; K72-K76 PolarHBondContact O-N 2.87Å
73	E	98.1	Very high	97.8	Very high	31 Å²	31	76.4 Å²	76.4	15%	0.145	41%	0.405	C	S	.	.	H	α-helix	trans	-77	-33.3	177.2	-69.2	-58.7	121.1	0	0	111.9	I69 E70 K76 G77 N78 V82 I85	I69-E73 HydrophobicContact CG2-CG 4.33Å; I69-E73 WeakPolarHBondContact O-CG 3.37Å; I69-E73 PolarHBondContact O-N 3.49Å; E70-E73 PolarHBondContact O-N 2.83Å; E73-K76 PolarHBondContact O-N 2.94Å; E73-K76 VanDerWaalsContact O-N 3.17Å; E73-K76 IonicContact OE1-NZ 3.8Å; E73-K76 PolarHBondContact OE1-NZ 3.47Å; E73-G77 PolarHBondContact O-N 3.24Å; E73-N78 HydrophobicContact CB-CB 4.39Å; E73-N78 PolarHBondContact O-N 3.43Å; E73-N78 WeakPolarHBondContact OE2-CB 3.36Å; E73-N78 PolarHBondContact OE2-ND2 2.84Å; E73-V82 HydrophobicContact CB-CG2 3.91Å; E73-I85 HydrophobicContact CB-CD1 4.01Å; E73-I85 HydrophobicContact CG-CD1 3.61Å
74	E	97.3	Very high	97.8	Very high	126 Å²	126	83.1 Å²	83.1	59%	0.589	43%	0.431	S	S	*	.	H	α-helix	trans	-62.2	-44.9	171.5	-174.5	171.9	-149.9	0	0	111	E70 K76 G77 V82	E70-E74 WeakPolarHBondContact O-CB 3.33Å; E70-E74 PolarHBondContact O-N 3.12Å; E74-K76 PolarHBondContact O-N 3.35Å; E74-K76 VanDerWaalsContact O-N 3.12Å; E74-G77 PolarHBondContact O-N 3.01Å; E74-V82 HydrophobicContact CB-CG2 3.97Å
75	A	97.6	Very high	97.8	Very high	92 Å²	92	79.5 Å²	79.5	76%	0.76	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.9	175	0	0	0	0	0	114.1	Q71	Q71-A75 WeakPolarHBondContact O-CB 3.32Å; Q71-A75 PolarHBondContact O-N 2.79Å
76	K	97.2	Very high	97.8	Very high	133 Å²	133	79.3 Å²	79.3	58%	0.578	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.1	174.7	-66.1	171.2	-167.2	169.2	0	113.3	K72 E73 E74 N78	K72-K76 WeakPolarHBondContact O-CG 3.29Å; K72-K76 PolarHBondContact O-N 2.87Å; E73-K76 PolarHBondContact O-N 2.94Å; E73-K76 VanDerWaalsContact O-N 3.17Å; E73-K76 IonicContact OE1-NZ 3.8Å; E73-K76 PolarHBondContact OE1-NZ 3.47Å; E74-K76 PolarHBondContact O-N 3.35Å; E74-K76 VanDerWaalsContact O-N 3.12Å; K76-N78 VanDerWaalsContact C-N 3.32Å
77	G	96.4	Very high	97.8	Very high	49 Å²	49	83.7 Å²	83.7	51%	0.505	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	23.4	-173.4	0	0	0	0	0	113.9	E73 E74 D79	E73-G77 PolarHBondContact O-N 3.24Å; E74-G77 PolarHBondContact O-N 3.01Å; G77-D79 VanDerWaalsContact C-N 3.29Å; G77-D79 PolarHBondContact O-N 3.02Å
78	N	96.7	Very high	97.8	Very high	69 Å²	69	88.8 Å²	88.8	37%	0.369	45%	0.451	S	S	.	.			trans	-85.7	64.6	-177.3	-72	-19.5	0	0	0	111.6	E73 K76 V80 S81 V82	E73-N78 HydrophobicContact CB-CB 4.39Å; E73-N78 PolarHBondContact O-N 3.43Å; E73-N78 WeakPolarHBondContact OE2-CB 3.36Å; E73-N78 PolarHBondContact OE2-ND2 2.84Å; K76-N78 VanDerWaalsContact C-N 3.32Å; N78-V80 VanDerWaalsContact C-N 3.26Å; N78-V80 PolarHBondContact O-N 3.41Å; N78-V80 VanDerWaalsContact O-N 3.09Å; N78-S81 WeakPolarHBondContact O-CA 3.38Å; N78-S81 WeakPolarHBondContact O-CB 3.2Å; N78-S81 PolarHBondContact O-N 2.74Å; N78-V82 WeakPolarHBondContact O-CG2 3.06Å; N78-V82 PolarHBondContact O-N 3.01Å
79	D	96.8	Very high	97.8	Very high	128 Å²	128	88.5 Å²	88.5	68%	0.684	44%	0.443	S	S	*	.	H	α-helix	trans	-51.4	-39.5	-171.3	-64.8	-30.4	0	0	0	114.4	G77 V82 K83	G77-D79 VanDerWaalsContact C-N 3.29Å; G77-D79 PolarHBondContact O-N 3.02Å; D79-V82 PolarHBondContact O-N 3.36Å; D79-K83 PolarHBondContact O-N 3.2Å
80	V	97.8	Very high	97.8	Very high	101 Å²	101	89.5 Å²	89.5	61%	0.612	45%	0.448	S	S	*	.	H	α-helix	trans	-65.6	-41.3	178.4	179.2	0	0	0	0	111.3	N78 R84	N78-V80 VanDerWaalsContact C-N 3.26Å; N78-V80 PolarHBondContact O-N 3.41Å; N78-V80 VanDerWaalsContact O-N 3.09Å; V80-R84 WeakPolarHBondContact O-CG 3.07Å; V80-R84 PolarHBondContact O-N 3.4Å
81	S	97.7	Very high	97.8	Very high	49 Å²	49	94.4 Å²	94.4	34%	0.343	47%	0.469	S	S	.	.	H	α-helix	trans	-68.2	-45.4	176.8	-62.5	0	0	0	0	110.6	N78 K83 R84 I85	N78-S81 WeakPolarHBondContact O-CA 3.38Å; N78-S81 WeakPolarHBondContact O-CB 3.2Å; N78-S81 PolarHBondContact O-N 2.74Å; S81-K83 VanDerWaalsContact C-N 3.3Å; S81-K83 PolarHBondContact O-N 2.84Å; S81-R84 PolarHBondContact O-N 3.17Å; S81-R84 VanDerWaalsContact O-N 3.12Å; S81-I85 WeakPolarHBondContact O-CD1 3.36Å; S81-I85 VanDerWaalsContact O-CG1 3.27Å; S81-I85 WeakPolarHBondContact O-CG1 3.4Å; S81-I85 PolarHBondContact O-N 3.38Å
82	V	98.5	Very high	97.9	Very high	21 Å²	21	88.4 Å²	88.4	13%	0.127	44%	0.442	C	S	.	.	H	α-helix	trans	-54.2	-48.1	177.2	173.2	0	0	0	0	110.5	E70 E73 E74 N78 D79 R84 I85 K86	E70-V82 HydrophobicContact CG-CG1 4.16Å; E73-V82 HydrophobicContact CB-CG2 3.91Å; E74-V82 HydrophobicContact CB-CG2 3.97Å; N78-V82 WeakPolarHBondContact O-CG2 3.06Å; N78-V82 PolarHBondContact O-N 3.01Å; D79-V82 PolarHBondContact O-N 3.36Å; V82-R84 PolarHBondContact O-N 2.67Å; V82-I85 PolarHBondContact O-N 3.45Å; V82-K86 VanDerWaalsContact O-CB 3.29Å; V82-K86 WeakPolarHBondContact O-CB 3.49Å; V82-K86 PolarHBondContact O-N 3.49Å
83	K	98.3	Very high	97.9	Very high	137 Å²	137	83.4 Å²	83.4	60%	0.596	42%	0.42	S	S	*	.	H	α-helix	trans	-58.2	-45.8	177.8	-174.6	177.8	176.2	-178.5	0	112.5	D79 S81 K86 E87	D79-K83 PolarHBondContact O-N 3.2Å; S81-K83 VanDerWaalsContact C-N 3.3Å; S81-K83 PolarHBondContact O-N 2.84Å; K83-K86 PolarHBondContact O-N 3.39Å; K83-E87 WeakPolarHBondContact CE-OE1 3.44Å; K83-E87 WeakPolarHBondContact O-CG 3.2Å; K83-E87 PolarHBondContact O-N 3.33Å
84	R	98.2	Very high	97.9	Very high	175 Å²	175	85 Å²	85	66%	0.66	43%	0.434	S	S	*	.	H	α-helix	trans	-64.8	-41.9	178.9	-69.5	175.9	-176.5	-162.7	1.4	112.3	V80 S81 V82 E87 Y88	V80-R84 WeakPolarHBondContact O-CG 3.07Å; V80-R84 PolarHBondContact O-N 3.4Å; S81-R84 PolarHBondContact O-N 3.17Å; S81-R84 VanDerWaalsContact O-N 3.12Å; V82-R84 PolarHBondContact O-N 2.67Å; R84-E87 PolarHBondContact O-N 3.03Å; R84-Y88 PolarHBondContact O-N 2.85Å; R84-Y88 VanDerWaalsContact O-N 3.1Å
85	I	98.4	Very high	98	Very high	26 Å²	26	81.8 Å²	81.8	13%	0.133	42%	0.419	C	S	.	.	H	α-helix	trans	-66.1	-43.6	178.9	-64.5	156.5	0	0	0	109.8	L66 I69 E70 E73 S81 V82 E87 Y88 R89	L66-I85 HydrophobicContact CD2-CG2 4.41Å; L66-I85 WeakPolarHBondContact O-CG2 3.42Å; I69-I85 HydrophobicContact CG2-CD1 3.72Å; I69-I85 HydrophobicContact CG2-CG1 4.38Å; E70-I85 HydrophobicContact CB-CB 4.49Å; E70-I85 HydrophobicContact CB-CG2 3.74Å; E70-I85 HydrophobicContact CG-CG2 4.41Å; E73-I85 HydrophobicContact CB-CD1 4.01Å; E73-I85 HydrophobicContact CG-CD1 3.61Å; S81-I85 WeakPolarHBondContact O-CD1 3.36Å; S81-I85 VanDerWaalsContact O-CG1 3.27Å; S81-I85 WeakPolarHBondContact O-CG1 3.4Å; S81-I85 PolarHBondContact O-N 3.38Å; V82-I85 PolarHBondContact O-N 3.45Å; I85-E87 PolarHBondContact O-N 3.14Å; I85-Y88 PolarHBondContact O-N 3.3Å; I85-R89 WeakPolarHBondContact O-CB 3.34Å; I85-R89 PolarHBondContact O-N 2.96Å
86	K	98.2	Very high	98.1	Very high	100 Å²	100	77.4 Å²	77.4	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-46.2	176.1	-176.8	170.1	-177.1	170.5	0	112.2	V82 K83 Y88 R89 L90	V82-K86 VanDerWaalsContact O-CB 3.29Å; V82-K86 WeakPolarHBondContact O-CB 3.49Å; V82-K86 PolarHBondContact O-N 3.49Å; K83-K86 PolarHBondContact O-N 3.39Å; K86-Y88 VanDerWaalsContact C-N 3.29Å; K86-Y88 PolarHBondContact O-N 3.07Å; K86-R89 PolarHBondContact O-N 3.5Å; K86-L90 HydrophobicContact CG-CD1 4.34Å; K86-L90 VanDerWaalsContact O-CG 3.31Å; K86-L90 WeakPolarHBondContact O-CG 3.18Å; K86-L90 PolarHBondContact O-N 3.03Å
87	E	98.4	Very high	98.1	Very high	110 Å²	110	71.9 Å²	71.9	51%	0.514	36%	0.361	S	S	.	.	H	α-helix	trans	-57.6	-42.5	174.7	-75.1	170	-173	0	0	111.6	K83 R84 I85 K91	K83-E87 WeakPolarHBondContact CE-OE1 3.44Å; K83-E87 WeakPolarHBondContact O-CG 3.2Å; K83-E87 PolarHBondContact O-N 3.33Å; R84-E87 PolarHBondContact O-N 3.03Å; I85-E87 PolarHBondContact O-N 3.14Å; E87-K91 PolarHBondContact O-N 3.49Å
88	Y	98.4	Very high	98.2	Very high	129 Å²	129	74.4 Å²	74.4	51%	0.506	36%	0.363	S	S	.	.	H	α-helix	trans	-70.6	-40.3	177.5	-171.9	-157.5	0	0	0	112.7	L66 R84 I85 K86 L90 K91 V92	L66-Y88 HydrophobicContact CD1-CD1 3.96Å; L66-Y88 HydrophobicContact CD1-CE1 4.17Å; L66-Y88 HydrophobicContact CD1-CG 4.16Å; L66-Y88 HydrophobicContact CD2-CD1 3.6Å; L66-Y88 HydrophobicContact CD2-CE1 4.01Å; L66-Y88 HydrophobicContact CD2-CG 4.39Å; L66-Y88 HydrophobicContact CG-CD1 4.45Å; R84-Y88 PolarHBondContact O-N 2.85Å; R84-Y88 VanDerWaalsContact O-N 3.1Å; I85-Y88 PolarHBondContact O-N 3.3Å; K86-Y88 VanDerWaalsContact C-N 3.29Å; K86-Y88 PolarHBondContact O-N 3.07Å; Y88-L90 VanDerWaalsContact C-N 3.34Å; Y88-L90 PolarHBondContact O-N 3.12Å; Y88-K91 HydrophobicContact CD2-CB 4.47Å; Y88-K91 HydrophobicContact CD2-CD 4.46Å; Y88-K91 WeakPolarHBondContact O-CB 3.46Å; Y88-K91 PolarHBondContact O-N 3.28Å; Y88-K91 VanDerWaalsContact O-N 3.17Å; Y88-V92 HydrophobicContact CD2-CG2 4.38Å; Y88-V92 HydrophobicContact CE2-CG2 4.09Å; Y88-V92 PolarHBondContact O-N 2.97Å; Y88-V92 VanDerWaalsContact O-N 3.13Å
89	R	98.4	Very high	98.3	Very high	40 Å²	40	72 Å²	72	15%	0.151	35%	0.351	C	S	.	.	H	α-helix	trans	-58.3	-46	174.3	-179.1	178.4	52.2	90.9	-9.9	111.3	L66 S67 E70 I85 K86 K91 V92 E93	L66-R89 HydrophobicContact CB-CB 4.16Å; L66-R89 HydrophobicContact CB-CG 4.45Å; L66-R89 HydrophobicContact CD1-CB 4.5Å; S67-R89 WeakPolarHBondContact OG-CD 3.4Å; E70-R89 IonicContact OE1-NH2 3.19Å; E70-R89 PolarHBondContact OE1-NH2 3.49Å; E70-R89 IonicContact OE2-CZ 3.99Å; E70-R89 VanDerWaalsContact OE2-CZ 3.26Å; E70-R89 IonicContact OE2-NE 2.74Å; E70-R89 PolarHBondContact OE2-NE 3.45Å; E70-R89 IonicContact OE2-NH2 2.67Å; E70-R89 PolarHBondContact OE2-NH2 3.24Å; I85-R89 WeakPolarHBondContact O-CB 3.34Å; I85-R89 PolarHBondContact O-N 2.96Å; K86-R89 PolarHBondContact O-N 3.5Å; R89-K91 VanDerWaalsContact C-N 3.25Å; R89-K91 PolarHBondContact O-N 2.86Å; R89-V92 CarbonylContact O-C 3.6Å; R89-V92 WeakPolarHBondContact O-CA 3.48Å; R89-V92 WeakPolarHBondContact O-CB 3.4Å; R89-V92 PolarHBondContact O-N 3.25Å; R89-E93 HydrophobicContact CG-CG 4.38Å; R89-E93 IonicContact CZ-OE1 2.63Å; R89-E93 IonicContact NE-OE1 2.9Å; R89-E93 IonicContact NH1-OE1 3.24Å; R89-E93 PolarHBondContact NH1-OE1 3.01Å; R89-E93 IonicContact NH1-OE2 3.05Å; R89-E93 WeakPolarHBondContact O-CG 3Å; R89-E93 PolarHBondContact O-N 3.18Å
90	L	98.2	Very high	98.4	Very high	88 Å²	88	66 Å²	66	46%	0.461	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-34.4	177.5	-72	172.4	0	0	0	112.5	K86 Y88 E93 S94	K86-L90 HydrophobicContact CG-CD1 4.34Å; K86-L90 VanDerWaalsContact O-CG 3.31Å; K86-L90 WeakPolarHBondContact O-CG 3.18Å; K86-L90 PolarHBondContact O-N 3.03Å; Y88-L90 VanDerWaalsContact C-N 3.34Å; Y88-L90 PolarHBondContact O-N 3.12Å; L90-E93 WeakPolarHBondContact CD2-OE2 3.43Å; L90-E93 PolarHBondContact O-N 3.39Å; L90-S94 PolarHBondContact O-N 3.17Å
91	K	98.6	Very high	98.4	Very high	124 Å²	124	64.1 Å²	64.1	54%	0.539	31%	0.31	S	S	.	.	H	α-helix	trans	-62.7	-46.8	171.8	-178	-176.5	173.3	-174.7	0	111.2	E87 Y88 R89 E93 S94 E95	E87-K91 PolarHBondContact O-N 3.49Å; Y88-K91 HydrophobicContact CD2-CB 4.47Å; Y88-K91 HydrophobicContact CD2-CD 4.46Å; Y88-K91 WeakPolarHBondContact O-CB 3.46Å; Y88-K91 PolarHBondContact O-N 3.28Å; Y88-K91 VanDerWaalsContact O-N 3.17Å; R89-K91 VanDerWaalsContact C-N 3.25Å; R89-K91 PolarHBondContact O-N 2.86Å; K91-E93 VanDerWaalsContact C-N 3.32Å; K91-E93 PolarHBondContact O-N 3.38Å; K91-S94 WeakPolarHBondContact O-CB 3.35Å; K91-S94 PolarHBondContact O-N 3.12Å; K91-E95 VanDerWaalsContact CE-OE1 3.29Å; K91-E95 WeakPolarHBondContact CE-OE1 3.47Å; K91-E95 WeakPolarHBondContact O-CG 3.36Å; K91-E95 PolarHBondContact O-N 3.38Å
92	V	98.7	Very high	98.5	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-37.6	177.3	177.3	0	0	0	0	111.5	R59 W63 L66 Y88 R89 S94 E95 L96	R59-V92 HydrophobicContact CB-CG1 4.46Å; R59-V92 WeakPolarHBondContact O-CG1 3.33Å; W63-V92 HydrophobicContact CB-CG1 3.93Å; L66-V92 HydrophobicContact CD1-CB 4.37Å; L66-V92 HydrophobicContact CD1-CG2 3.69Å; Y88-V92 HydrophobicContact CD2-CG2 4.38Å; Y88-V92 HydrophobicContact CE2-CG2 4.09Å; Y88-V92 PolarHBondContact O-N 2.97Å; Y88-V92 VanDerWaalsContact O-N 3.13Å; R89-V92 CarbonylContact O-C 3.6Å; R89-V92 WeakPolarHBondContact O-CA 3.48Å; R89-V92 WeakPolarHBondContact O-CB 3.4Å; R89-V92 PolarHBondContact O-N 3.25Å; V92-S94 VanDerWaalsContact C-N 3.33Å; V92-S94 PolarHBondContact O-N 3.21Å; V92-E95 PolarHBondContact O-N 3.48Å; V92-L96 VanDerWaalsContact O-CB 3.29Å; V92-L96 WeakPolarHBondContact O-CB 3.43Å; V92-L96 PolarHBondContact O-N 3.18Å
93	E	98.6	Very high	98.5	Very high	20 Å²	20	63.1 Å²	63.1	9%	0.093	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-36.7	174.5	-72	176.4	-176.7	0	0	112.5	W63 R89 L90 K91 L96 S97 F138	W63-E93 PolarHBondContact NE1-OE1 2.91Å; R89-E93 HydrophobicContact CG-CG 4.38Å; R89-E93 IonicContact CZ-OE1 2.63Å; R89-E93 IonicContact NE-OE1 2.9Å; R89-E93 IonicContact NH1-OE1 3.24Å; R89-E93 PolarHBondContact NH1-OE1 3.01Å; R89-E93 IonicContact NH1-OE2 3.05Å; R89-E93 WeakPolarHBondContact O-CG 3Å; R89-E93 PolarHBondContact O-N 3.18Å; L90-E93 WeakPolarHBondContact CD2-OE2 3.43Å; L90-E93 PolarHBondContact O-N 3.39Å; K91-E93 VanDerWaalsContact C-N 3.32Å; K91-E93 PolarHBondContact O-N 3.38Å; E93-L96 PolarHBondContact O-N 3.02Å; E93-S97 WeakPolarHBondContact O-CB 3.35Å; E93-S97 PolarHBondContact O-N 3.5Å; E93-S97 PolarHBondContact O-OG 2.92Å; E93-F138 HydrophobicContact CB-CD2 3.69Å; E93-F138 HydrophobicContact CB-CE2 3.78Å; E93-F138 HydrophobicContact CG-CB 4.19Å; E93-F138 HydrophobicContact CG-CD2 3.52Å; E93-F138 HydrophobicContact CG-CE2 4.12Å; E93-F138 HydrophobicContact CG-CG 4.01Å
94	S	98.6	Very high	98.4	Very high	64 Å²	64	57 Å²	57	45%	0.448	27%	0.274	S	S	.	.	H	α-helix	trans	-65.6	-46.4	172.7	-178	0	0	0	0	111.6	L90 K91 V92 L96 S97 N98	L90-S94 PolarHBondContact O-N 3.17Å; K91-S94 WeakPolarHBondContact O-CB 3.35Å; K91-S94 PolarHBondContact O-N 3.12Å; V92-S94 VanDerWaalsContact C-N 3.33Å; V92-S94 PolarHBondContact O-N 3.21Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 3.25Å; S94-S97 PolarHBondContact O-N 3.4Å; S94-N98 PolarHBondContact O-N 3.38Å; S94-N98 PolarHBondContact O-ND2 3.14Å
95	E	98.6	Very high	98.4	Very high	59 Å²	59	51.8 Å²	51.8	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-57.8	-46.2	174	-68.4	172.8	-161.9	0	0	111.5	R59 K91 V92 N98 I99	R59-E95 HydrophobicContact CG-CB 4.19Å; R59-E95 IonicContact NE-OE2 3.59Å; R59-E95 PolarHBondContact NE-OE2 3.31Å; K91-E95 VanDerWaalsContact CE-OE1 3.29Å; K91-E95 WeakPolarHBondContact CE-OE1 3.47Å; K91-E95 WeakPolarHBondContact O-CG 3.36Å; K91-E95 PolarHBondContact O-N 3.38Å; V92-E95 PolarHBondContact O-N 3.48Å; E95-N98 PolarHBondContact O-N 3.42Å; E95-I99 WeakPolarHBondContact O-CD1 3.41Å; E95-I99 VanDerWaalsContact O-CG1 3.28Å; E95-I99 WeakPolarHBondContact O-CG1 3.04Å; E95-I99 PolarHBondContact O-N 3.39Å
96	L	98.4	Very high	98.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-41.6	178.1	-175.9	57.2	0	0	0	112	V56 R59 R60 V92 E93 S94 I99 C100 F138	V56-L96 HydrophobicContact CG2-CD1 3.36Å; R59-L96 HydrophobicContact CB-CB 4.41Å; R59-L96 HydrophobicContact CB-CD1 4.19Å; R60-L96 HydrophobicContact CG-CD1 3.73Å; R60-L96 HydrophobicContact CG-CD2 3.8Å; R60-L96 HydrophobicContact CG-CG 4.46Å; V92-L96 VanDerWaalsContact O-CB 3.29Å; V92-L96 WeakPolarHBondContact O-CB 3.43Å; V92-L96 PolarHBondContact O-N 3.18Å; E93-L96 PolarHBondContact O-N 3.02Å; S94-L96 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 3.25Å; L96-I99 PolarHBondContact O-N 3.36Å; L96-C100 PolarHBondContact O-N 2.63Å; L96-C100 PolarHBondContact O-SG 3.46Å; L96-F138 HydrophobicContact CB-CE1 4.26Å; L96-F138 HydrophobicContact CB-CZ 4.27Å; L96-F138 HydrophobicContact CD2-CD1 3.57Å; L96-F138 HydrophobicContact CD2-CE1 3.31Å; L96-F138 HydrophobicContact CD2-CZ 4.12Å; L96-F138 HydrophobicContact CG-CD1 4.37Å; L96-F138 HydrophobicContact CG-CE1 3.61Å; L96-F138 HydrophobicContact CG-CZ 4.08Å
97	S	98.6	Very high	98.5	Very high	17 Å²	17	46 Å²	46	12%	0.119	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-46.2	175.2	-60	0	0	0	0	111.1	E93 S94 I99 C100 S101 F138	E93-S97 WeakPolarHBondContact O-CB 3.35Å; E93-S97 PolarHBondContact O-N 3.5Å; E93-S97 PolarHBondContact O-OG 2.92Å; S94-S97 PolarHBondContact O-N 3.4Å; S97-I99 PolarHBondContact O-N 2.99Å; S97-C100 PolarHBondContact O-N 3.05Å; S97-S101 WeakPolarHBondContact O-CB 3.45Å; S97-S101 PolarHBondContact O-N 3.46Å; S97-S101 PolarHBondContact O-OG 3.45Å; S97-F138 WeakPolarHBondContact OG-CE2 3.43Å; S97-F138 WeakPolarHBondContact OG-CZ 3.28Å
98	N	98.6	Very high	98.4	Very high	102 Å²	102	43.9 Å²	43.9	55%	0.545	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-43.7	178.8	-66.6	-25.6	0	0	0	111.8	S94 E95 C100 S101 D102	S94-N98 PolarHBondContact O-N 3.38Å; S94-N98 PolarHBondContact O-ND2 3.14Å; E95-N98 PolarHBondContact O-N 3.42Å; N98-C100 VanDerWaalsContact C-N 3.33Å; N98-C100 PolarHBondContact O-N 3.24Å; N98-S101 PolarHBondContact O-N 2.92Å; N98-D102 VanDerWaalsContact O-CB 3.26Å; N98-D102 WeakPolarHBondContact O-CB 3.17Å; N98-D102 PolarHBondContact O-N 2.94Å
99	I	98.6	Very high	98.4	Very high	20 Å²	20	42.8 Å²	42.8	10%	0.103	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-45.8	176.1	-66.4	156.8	0	0	0	110.3	Y52 V55 V56 R59 E95 L96 S97 D102 I103 Y131	Y52-I99 HydrophobicContact CD1-CG2 4.36Å; V55-I99 HydrophobicContact CG1-CD1 3.62Å; V55-I99 HydrophobicContact CG1-CG1 3.84Å; V55-I99 HydrophobicContact CG1-CG2 4.1Å; V56-I99 HydrophobicContact CB-CG2 3.97Å; V56-I99 HydrophobicContact CG2-CG2 4.13Å; R59-I99 HydrophobicContact CB-CD1 4.23Å; R59-I99 HydrophobicContact CG-CD1 3.84Å; E95-I99 WeakPolarHBondContact O-CD1 3.41Å; E95-I99 VanDerWaalsContact O-CG1 3.28Å; E95-I99 WeakPolarHBondContact O-CG1 3.04Å; E95-I99 PolarHBondContact O-N 3.39Å; L96-I99 PolarHBondContact O-N 3.36Å; S97-I99 PolarHBondContact O-N 2.99Å; I99-D102 PolarHBondContact O-N 3.05Å; I99-I103 WeakPolarHBondContact O-CG2 3.46Å; I99-I103 PolarHBondContact O-N 3.31Å; I99-Y131 HydrophobicContact CG2-CE1 4.35Å
100	C	98.6	Very high	98.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-49.3	179.6	-62.1	0	0	0	0	111.6	L96 S97 N98 D102 I103 M104 Y131 L135	L96-C100 PolarHBondContact O-N 2.63Å; L96-C100 PolarHBondContact O-SG 3.46Å; S97-C100 PolarHBondContact O-N 3.05Å; N98-C100 VanDerWaalsContact C-N 3.33Å; N98-C100 PolarHBondContact O-N 3.24Å; C100-D102 VanDerWaalsContact C-N 3.26Å; C100-D102 PolarHBondContact O-N 2.87Å; C100-I103 WeakPolarHBondContact O-CG2 3.4Å; C100-I103 PolarHBondContact O-N 3.46Å; C100-M104 VanDerWaalsContact O-CG 3.25Å; C100-M104 WeakPolarHBondContact O-CG 3.24Å; C100-M104 PolarHBondContact O-N 3.46Å; C100-Y131 HydrophobicContact CB-CD1 4.15Å; C100-L135 HydrophobicContact CB-CD1 4.03Å; C100-L135 HydrophobicContact CB-CD2 3.74Å; C100-L135 HydrophobicContact CB-CG 3.77Å
101	S	98.4	Very high	98.4	Very high	63 Å²	63	39.4 Å²	39.4	44%	0.441	21%	0.209	S	C	.	.	H	α-helix	trans	-57.8	-40.3	177	-66	0	0	0	0	112	S97 N98 M104 T105	S97-S101 WeakPolarHBondContact O-CB 3.45Å; S97-S101 PolarHBondContact O-N 3.46Å; S97-S101 PolarHBondContact O-OG 3.45Å; N98-S101 PolarHBondContact O-N 2.92Å; S101-M104 PolarHBondContact O-N 3.05Å; S101-T105 PolarHBondContact O-N 3.01Å; S101-T105 PolarHBondContact O-OG1 3.14Å; S101-T105 VanDerWaalsContact O-OG1 3.12Å
102	D	98.4	Very high	98.3	Very high	49 Å²	49	34.9 Å²	34.9	26%	0.262	19%	0.19	S	C	.	.	H	α-helix	trans	-60.2	-51.6	179.6	-171.8	57.3	0	0	0	112.6	K31 Y52 N98 I99 C100 M104 T105 V106	K31-D102 WeakPolarHBondContact CE-OD1 3.49Å; K31-D102 WeakPolarHBondContact CE-OD2 3.47Å; K31-D102 IonicContact NZ-OD1 3.63Å; K31-D102 PolarHBondContact NZ-OD1 3.44Å; K31-D102 IonicContact NZ-OD2 3.45Å; K31-D102 PolarHBondContact NZ-OD2 2.64Å; Y52-D102 PolarHBondContact OH-OD2 3.35Å; N98-D102 VanDerWaalsContact O-CB 3.26Å; N98-D102 WeakPolarHBondContact O-CB 3.17Å; N98-D102 PolarHBondContact O-N 2.94Å; I99-D102 PolarHBondContact O-N 3.05Å; C100-D102 VanDerWaalsContact C-N 3.26Å; C100-D102 PolarHBondContact O-N 2.87Å; D102-M104 VanDerWaalsContact C-N 3.33Å; D102-M104 PolarHBondContact O-N 3.48Å; D102-T105 PolarHBondContact O-N 2.71Å; D102-V106 WeakPolarHBondContact O-CG2 3.37Å; D102-V106 PolarHBondContact O-N 2.84Å; D102-V106 VanDerWaalsContact O-N 3.07Å
103	I	98.4	Very high	98.2	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-33.9	176.8	178.7	62.5	0	0	0	112	L48 Y52 I99 C100 T105 V106 I107 M127 Y131	L48-I103 HydrophobicContact CD2-CD1 4.46Å; Y52-I103 HydrophobicContact CD1-CB 3.8Å; Y52-I103 HydrophobicContact CD1-CG1 4.46Å; Y52-I103 HydrophobicContact CD1-CG2 4.31Å; Y52-I103 HydrophobicContact CD2-CB 4.45Å; Y52-I103 HydrophobicContact CD2-CD1 3.77Å; Y52-I103 HydrophobicContact CD2-CG1 4.39Å; Y52-I103 HydrophobicContact CE1-CB 3.61Å; Y52-I103 HydrophobicContact CE1-CG2 4.37Å; Y52-I103 HydrophobicContact CE2-CB 4.26Å; Y52-I103 HydrophobicContact CE2-CD1 3.67Å; Y52-I103 HydrophobicContact CE2-CG1 4.43Å; Y52-I103 HydrophobicContact CG-CB 4.21Å; Y52-I103 HydrophobicContact CG-CD1 4.25Å; Y52-I103 HydrophobicContact CG-CG1 4.39Å; I99-I103 WeakPolarHBondContact O-CG2 3.46Å; I99-I103 PolarHBondContact O-N 3.31Å; C100-I103 WeakPolarHBondContact O-CG2 3.4Å; C100-I103 PolarHBondContact O-N 3.46Å; I103-T105 VanDerWaalsContact C-N 3.33Å; I103-T105 PolarHBondContact O-N 3.31Å; I103-V106 HydrophobicContact CD1-CB 4.49Å; I103-V106 PolarHBondContact O-N 3.48Å; I103-I107 HydrophobicContact CD1-CD1 3.96Å; I103-I107 HydrophobicContact CD1-CG1 3.85Å; I103-I107 HydrophobicContact CG1-CD1 3.7Å; I103-I107 HydrophobicContact CG1-CG1 4.08Å; I103-I107 WeakPolarHBondContact O-CB 3.29Å; I103-I107 VanDerWaalsContact O-CG1 3.3Å; I103-I107 WeakPolarHBondContact O-CG1 3.34Å; I103-I107 PolarHBondContact O-N 3.45Å; I103-M127 HydrophobicContact CD1-CE 3.74Å; I103-M127 HydrophobicContact CD1-SD 4.07Å; I103-M127 HydrophobicContact CG1-CE 3.75Å; I103-M127 HydrophobicContact CG1-SD 4.21Å; I103-Y131 HydrophobicContact CG2-CD1 3.36Å; I103-Y131 HydrophobicContact CG2-CD2 4.01Å; I103-Y131 HydrophobicContact CG2-CE1 3.57Å; I103-Y131 HydrophobicContact CG2-CE2 4.23Å; I103-Y131 HydrophobicContact CG2-CG 3.59Å
104	M	98	Very high	98.1	Very high	9 Å²	9	39.2 Å²	39.2	4%	0.044	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-45	176.7	-68	-48.9	85	0	0	110.6	C100 S101 D102 V106 I107 D108 K128 Y131 Y132	C100-M104 VanDerWaalsContact O-CG 3.25Å; C100-M104 WeakPolarHBondContact O-CG 3.24Å; C100-M104 PolarHBondContact O-N 3.46Å; S101-M104 PolarHBondContact O-N 3.05Å; D102-M104 VanDerWaalsContact C-N 3.33Å; D102-M104 PolarHBondContact O-N 3.48Å; M104-V106 PolarHBondContact O-N 3.15Å; M104-I107 HydrophobicContact CE-CD1 3.95Å; M104-I107 PolarHBondContact O-N 2.95Å; M104-D108 WeakPolarHBondContact O-CB 3.32Å; M104-D108 PolarHBondContact O-N 3.08Å; M104-K128 HydrophobicContact CE-CG 4.42Å; M104-K128 HydrophobicContact SD-CB 4.18Å; M104-K128 HydrophobicContact SD-CG 3.48Å; M104-K128 WeakPolarHBondContact SD-CG 3.49Å; M104-Y131 HydrophobicContact CE-CD2 4.18Å; M104-Y131 HydrophobicContact CE-CG 3.85Å; M104-Y132 HydrophobicContact CG-CD2 4.49Å; M104-Y132 HydrophobicContact CG-CE2 3.96Å; M104-Y132 HydrophobicContact SD-CD2 3.66Å; M104-Y132 HydrophobicContact SD-CE2 3.49Å; M104-Y132 WeakPolarHBondContact SD-CE2 3.12Å; M104-Y132 HydrophobicContact SD-CG 4.46Å
105	T	98.3	Very high	98	Very high	65 Å²	65	37.2 Å²	37.2	40%	0.399	21%	0.207	S	C	.	.	H	α-helix	trans	-59.5	-46.5	174.9	-60.6	0	0	0	0	111.2	S101 D102 I103 I107 D108 E109	S101-T105 PolarHBondContact O-N 3.01Å; S101-T105 PolarHBondContact O-OG1 3.14Å; S101-T105 VanDerWaalsContact O-OG1 3.12Å; D102-T105 PolarHBondContact O-N 2.71Å; I103-T105 VanDerWaalsContact C-N 3.33Å; I103-T105 PolarHBondContact O-N 3.31Å; T105-I107 VanDerWaalsContact C-N 3.32Å; T105-I107 PolarHBondContact O-N 3.16Å; T105-D108 PolarHBondContact O-N 2.91Å; T105-E109 VanDerWaalsContact CG2-CD 3.46Å; T105-E109 HydrophobicContact CG2-CG 4.07Å; T105-E109 WeakPolarHBondContact CG2-OE1 3.37Å; T105-E109 VanDerWaalsContact O-CB 3.3Å; T105-E109 WeakPolarHBondContact O-CB 3.46Å; T105-E109 WeakPolarHBondContact O-CG 3.3Å; T105-E109 PolarHBondContact O-N 2.89Å
106	V	98.4	Very high	97.7	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-41.3	179.9	175.9	0	0	0	0	111.7	K31 A34 D102 I103 M104 Y110 L111	K31-V106 HydrophobicContact CG-CG2 4.05Å; A34-V106 HydrophobicContact CB-CG1 3.71Å; D102-V106 WeakPolarHBondContact O-CG2 3.37Å; D102-V106 PolarHBondContact O-N 2.84Å; D102-V106 VanDerWaalsContact O-N 3.07Å; I103-V106 HydrophobicContact CD1-CB 4.49Å; I103-V106 PolarHBondContact O-N 3.48Å; M104-V106 PolarHBondContact O-N 3.15Å; V106-Y110 HydrophobicContact CG1-CD2 4.46Å; V106-Y110 PolarHBondContact O-N 3.27Å; V106-Y110 VanDerWaalsContact O-N 3.15Å; V106-L111 HydrophobicContact CG1-CD1 3.82Å; V106-L111 HydrophobicContact CG1-CG 4.11Å; V106-L111 PolarHBondContact O-N 3.49Å
107	I	98.4	Very high	97.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-62.1	-49.6	177.2	-76.7	173.5	0	0	0	111.1	I103 M104 T105 L111 I112 F124 M127 K128	I103-I107 HydrophobicContact CD1-CD1 3.96Å; I103-I107 HydrophobicContact CD1-CG1 3.85Å; I103-I107 HydrophobicContact CG1-CD1 3.7Å; I103-I107 HydrophobicContact CG1-CG1 4.08Å; I103-I107 WeakPolarHBondContact O-CB 3.29Å; I103-I107 VanDerWaalsContact O-CG1 3.3Å; I103-I107 WeakPolarHBondContact O-CG1 3.34Å; I103-I107 PolarHBondContact O-N 3.45Å; M104-I107 HydrophobicContact CE-CD1 3.95Å; M104-I107 PolarHBondContact O-N 2.95Å; T105-I107 VanDerWaalsContact C-N 3.32Å; T105-I107 PolarHBondContact O-N 3.16Å; I107-L111 HydrophobicContact CG1-CD1 3.97Å; I107-L111 PolarHBondContact O-N 3.22Å; I107-I112 HydrophobicContact CG2-CD1 3.33Å; I107-I112 HydrophobicContact CG2-CG1 3.82Å; I107-I112 PolarHBondContact O-N 3.36Å; I107-F124 HydrophobicContact CG2-CB 4.26Å; I107-M127 HydrophobicContact CD1-CB 4Å; I107-M127 HydrophobicContact CD1-CG 4.01Å; I107-M127 HydrophobicContact CD1-SD 4.18Å; I107-K128 HydrophobicContact CD1-CB 4.38Å; I107-K128 HydrophobicContact CG2-CB 4.36Å; I107-K128 HydrophobicContact CG2-CD 4.41Å
108	D	98	Very high	97.1	Very high	66 Å²	66	41 Å²	41	35%	0.353	24%	0.24	S	C	.	.	I	π-helix	trans	-75.6	-37.3	-172.8	-75.3	-16.8	0	0	0	113.1	M104 T105 P113 K128	M104-D108 WeakPolarHBondContact O-CB 3.32Å; M104-D108 PolarHBondContact O-N 3.08Å; T105-D108 PolarHBondContact O-N 2.91Å; D108-P113 WeakPolarHBondContact O-CD 3.38Å; D108-P113 VanDerWaalsContact O-CG 3.29Å; D108-P113 WeakPolarHBondContact O-CG 3.4Å; D108-K128 WeakPolarHBondContact OD1-CE 3.27Å; D108-K128 IonicContact OD1-NZ 3.85Å; D108-K128 PolarHBondContact OD1-NZ 3.49Å; D108-K128 WeakPolarHBondContact OD2-CE 3.43Å; D108-K128 IonicContact OD2-NZ 2.84Å; D108-K128 PolarHBondContact OD2-NZ 3.38Å
109	E	97.7	Very high	97.1	Very high	105 Å²	105	39 Å²	39	49%	0.491	23%	0.227	S	C	.	.	I	π-helix	trans	-83.1	-35.4	-176.6	-68.3	-174.1	177.1	0	0	113.2	T105	T105-E109 VanDerWaalsContact CG2-CD 3.46Å; T105-E109 HydrophobicContact CG2-CG 4.07Å; T105-E109 WeakPolarHBondContact CG2-OE1 3.37Å; T105-E109 VanDerWaalsContact O-CB 3.3Å; T105-E109 WeakPolarHBondContact O-CB 3.46Å; T105-E109 WeakPolarHBondContact O-CG 3.3Å; T105-E109 PolarHBondContact O-N 2.89Å
110	Y	97.7	Very high	97	Very high	54 Å²	54	38 Å²	38	21%	0.212	22%	0.222	C	C	.	.	I	π-helix	trans	-122.6	-46.9	-168.9	-50.1	-75.4	0	0	0	113.7	A34 N35 N37 V106 S114	A34-Y110 WeakPolarHBondContact O-CB 3.43Å; N35-Y110 VanDerWaalsContact OD1-CE2 3.27Å; N35-Y110 WeakPolarHBondContact OD1-CE2 3.48Å; N37-Y110 WeakPolarHBondContact OD1-CD1 3.37Å; V106-Y110 HydrophobicContact CG1-CD2 4.46Å; V106-Y110 PolarHBondContact O-N 3.27Å; V106-Y110 VanDerWaalsContact O-N 3.15Å; Y110-S114 WeakPolarHBondContact O-CB 3.34Å; Y110-S114 PolarHBondContact O-N 3.45Å; Y110-S114 PolarHBondContact O-OG 2.86Å
111	L	98	Very high	97	Very high	4 Å²	4	39 Å²	39	2%	0.021	23%	0.229	C	C	.	.	I	π-helix	trans	-81	-49.1	-165.7	-58.9	173.5	0	0	0	113.5	A34 L40 L48 V106 I107 S114 S115 F124	A34-L111 HydrophobicContact CB-CD2 3.73Å; A34-L111 HydrophobicContact CB-CG 4.32Å; L40-L111 HydrophobicContact CD1-CD2 3.54Å; L40-L111 HydrophobicContact CG-CD2 3.84Å; L48-L111 HydrophobicContact CD2-CD1 3.38Å; L48-L111 HydrophobicContact CD2-CD2 4.45Å; V106-L111 HydrophobicContact CG1-CD1 3.82Å; V106-L111 HydrophobicContact CG1-CG 4.11Å; V106-L111 PolarHBondContact O-N 3.49Å; I107-L111 HydrophobicContact CG1-CD1 3.97Å; I107-L111 PolarHBondContact O-N 3.22Å; L111-S114 PolarHBondContact O-N 3.2Å; L111-S115 PolarHBondContact O-N 2.81Å; L111-S115 PolarHBondContact O-OG 2.98Å; L111-F124 HydrophobicContact CB-CD1 4.07Å; L111-F124 HydrophobicContact CB-CD2 3.81Å; L111-F124 HydrophobicContact CB-CE1 4.05Å; L111-F124 HydrophobicContact CB-CE2 3.76Å; L111-F124 HydrophobicContact CB-CG 3.97Å; L111-F124 HydrophobicContact CB-CZ 3.87Å; L111-F124 HydrophobicContact CD1-CD1 3.85Å; L111-F124 HydrophobicContact CD1-CE1 3.66Å; L111-F124 HydrophobicContact CD1-CZ 4.16Å; L111-F124 HydrophobicContact CD2-CE1 4.29Å; L111-F124 HydrophobicContact CD2-CZ 3.99Å; L111-F124 HydrophobicContact CG-CE1 4.22Å; L111-F124 HydrophobicContact CG-CZ 4.23Å
112	I	97.6	Very high	97	Very high	29 Å²	29	36 Å²	36	15%	0.149	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-48	175.1	-72.3	167.3	0	0	0	110.5	I107 S114 S115 F124 Y125	I107-I112 HydrophobicContact CG2-CD1 3.33Å; I107-I112 HydrophobicContact CG2-CG1 3.82Å; I107-I112 PolarHBondContact O-N 3.36Å; I112-S114 PolarHBondContact O-N 2.88Å; I112-S115 WeakPolarHBondContact O-CB 3.28Å; I112-S115 PolarHBondContact O-N 3.39Å; I112-F124 HydrophobicContact CG1-CB 3.99Å; I112-Y125 HydrophobicContact CD1-CD1 3.81Å; I112-Y125 HydrophobicContact CD1-CD2 4.47Å; I112-Y125 HydrophobicContact CD1-CE1 3.43Å; I112-Y125 VanDerWaalsContact CD1-CE1 3.43Å; I112-Y125 HydrophobicContact CD1-CE2 4.16Å; I112-Y125 HydrophobicContact CD1-CG 4.29Å; I112-Y125 HydrophobicContact CG1-CE1 4.48Å; I112-Y125 HydrophobicContact CG1-CE2 4.39Å; I112-Y125 HydrophobicContact CG2-CE2 4.24Å
113	P	97.1	Very high	97	Very high	88 Å²	88	35 Å²	35	57%	0.571	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.9	177.6	-27.4	37.5	0	0	0	114.4	D108	D108-P113 WeakPolarHBondContact O-CD 3.38Å; D108-P113 VanDerWaalsContact O-CG 3.29Å; D108-P113 WeakPolarHBondContact O-CG 3.4Å
114	S	96.4	Very high	97	Very high	25 Å²	25	35.1 Å²	35.1	18%	0.175	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-3	177.4	-56	0	0	0	0	113.7	E39 Y110 L111 I112	E39-S114 WeakPolarHBondContact CB-O 3.37Å; Y110-S114 WeakPolarHBondContact O-CB 3.34Å; Y110-S114 PolarHBondContact O-N 3.45Å; Y110-S114 PolarHBondContact O-OG 2.86Å; L111-S114 PolarHBondContact O-N 3.2Å; I112-S114 PolarHBondContact O-N 2.88Å
115	S	95.1	Very high	97	Very high	22 Å²	22	37 Å²	37	15%	0.154	21%	0.209	C	C	.	.			trans	-80.5	118.6	-179.6	-63.4	0	0	0	0	110.5	L111 I112 S121 F124	L111-S115 PolarHBondContact O-N 2.81Å; L111-S115 PolarHBondContact O-OG 2.98Å; I112-S115 WeakPolarHBondContact O-CB 3.28Å; I112-S115 PolarHBondContact O-N 3.39Å; S115-S121 WeakPolarHBondContact CB-OG 3.41Å; S115-F124 WeakPolarHBondContact OG-CD2 3.26Å
116	S	92.3	Very high	97	Very high	101 Å²	101	35.6 Å²	35.6	71%	0.706	20%	0.197	S	C	*	.			trans	-98.2	-12.3	-176.6	71	0	0	0	0	114.1	E39	E39-S116 VanDerWaalsContact CD-OG 3.24Å; E39-S116 PolarHBondContact OE1-OG 2.86Å; E39-S116 WeakPolarHBondContact OE2-CA 3.4Å; E39-S116 VanDerWaalsContact OE2-CB 3.31Å; E39-S116 WeakPolarHBondContact OE2-CB 3.42Å; E39-S116 PolarHBondContact OE2-N 2.71Å; E39-S116 PolarHBondContact OE2-OG 3.18Å
117	S	92.4	Very high	97	Very high	54 Å²	54	35.8 Å²	35.8	38%	0.378	20%	0.198	S	C	.	.	S	Bend	trans	-135.8	166.9	-178.9	53.9	0	0	0	0	112	E119 P120 S121	S117-E119 VanDerWaalsContact C-N 3.35Å; S117-E119 PolarHBondContact O-N 2.8Å; S117-P120 WeakPolarHBondContact O-CD 3.36Å; S117-P120 WeakPolarHBondContact O-CG 3.43Å; S117-P120 WeakPolarHBondContact OG-CD 3.37Å; S117-P120 WeakPolarHBondContact OG-CG 3.13Å; S117-S121 PolarHBondContact O-N 2.9Å; S117-S121 PolarHBondContact O-OG 3.2Å
118	G	93.9	Very high	97	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-37.2	180	0	0	0	0	0	113.7	S121 V122 E165	G118-S121 WeakPolarHBondContact O-CB 3.19Å; G118-S121 PolarHBondContact O-N 2.79Å; G118-V122 WeakPolarHBondContact O-CB 3.29Å; G118-V122 WeakPolarHBondContact O-CG2 3.3Å; G118-V122 PolarHBondContact O-N 3.43Å; G118-E165 VanDerWaalsContact CA-CD 3.49Å; G118-E165 WeakPolarHBondContact CA-OE2 3.42Å; G118-E165 PolarHBondContact N-OE2 3.26Å
119	E	96.7	Very high	97.1	Very high	59 Å²	59	34.1 Å²	34.1	28%	0.276	19%	0.188	S	C	.	.	H	α-helix	trans	-58.2	-56.5	-176.9	-168.5	-169.8	108.1	0	0	114.4	R45 S117 S121 V122 F123 L166 H170 I172	R45-E119 IonicContact CZ-OE1 2.89Å; R45-E119 IonicContact NH1-OE1 3.14Å; R45-E119 IonicContact NH2-OE1 3.91Å; R45-E119 PolarHBondContact NH2-OE1 2.95Å; S117-E119 VanDerWaalsContact C-N 3.35Å; S117-E119 PolarHBondContact O-N 2.8Å; E119-S121 VanDerWaalsContact C-N 3.28Å; E119-S121 PolarHBondContact O-N 3.27Å; E119-V122 PolarHBondContact O-N 2.94Å; E119-F123 WeakPolarHBondContact O-CB 3.37Å; E119-F123 PolarHBondContact O-N 2.88Å; E119-L166 HydrophobicContact CB-CD2 4.03Å; E119-L166 HydrophobicContact CG-CD2 4.31Å; E119-H170 IonicContact OE2-CE1 2.79Å; E119-H170 IonicContact OE2-NE2 2.63Å; E119-H170 PolarHBondContact OE2-NE2 2.86Å; E119-I172 HydrophobicContact CG-CD1 3.59Å
120	P	97.5	Very high	97.1	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-38.9	173.7	19.7	-28.6	0	0	0	112.1	S117 F123 F124	S117-P120 WeakPolarHBondContact O-CD 3.36Å; S117-P120 WeakPolarHBondContact O-CG 3.43Å; S117-P120 WeakPolarHBondContact OG-CD 3.37Å; S117-P120 WeakPolarHBondContact OG-CG 3.13Å; P120-F123 WeakPolarHBondContact O-CB 3.39Å; P120-F123 PolarHBondContact O-N 2.92Å; P120-F124 HydrophobicContact CB-CD2 4.34Å; P120-F124 HydrophobicContact CB-CE2 3.97Å; P120-F124 WeakPolarHBondContact O-CD2 3.4Å; P120-F124 WeakPolarHBondContact O-CG 3.47Å; P120-F124 PolarHBondContact O-N 2.79Å
121	S	97.5	Very high	97.2	Very high	21 Å²	21	27.2 Å²	27.2	15%	0.147	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-50.1	179.9	-58	0	0	0	0	111.5	S115 S117 G118 E119 F123 F124 Y125	S115-S121 WeakPolarHBondContact CB-OG 3.41Å; S117-S121 PolarHBondContact O-N 2.9Å; S117-S121 PolarHBondContact O-OG 3.2Å; G118-S121 WeakPolarHBondContact O-CB 3.19Å; G118-S121 PolarHBondContact O-N 2.79Å; E119-S121 VanDerWaalsContact C-N 3.28Å; E119-S121 PolarHBondContact O-N 3.27Å; S121-F123 VanDerWaalsContact C-N 3.31Å; S121-F123 PolarHBondContact O-N 3.27Å; S121-F124 PolarHBondContact O-N 3.19Å; S121-Y125 WeakPolarHBondContact O-CB 3.49Å; S121-Y125 WeakPolarHBondContact O-CD2 3.27Å; S121-Y125 PolarHBondContact O-N 3.34Å
122	V	98.6	Very high	97.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-43.8	175.6	175.8	0	0	0	0	110.2	G118 E119 F124 K126 A158 T161 A162 L166 I172 L176	G118-V122 WeakPolarHBondContact O-CB 3.29Å; G118-V122 WeakPolarHBondContact O-CG2 3.3Å; G118-V122 PolarHBondContact O-N 3.43Å; E119-V122 PolarHBondContact O-N 2.94Å; V122-F124 PolarHBondContact O-N 3.1Å; V122-K126 WeakPolarHBondContact O-CB 3.25Å; V122-K126 PolarHBondContact O-N 2.94Å; V122-A158 HydrophobicContact CG1-CB 4.4Å; V122-T161 HydrophobicContact CG2-CG2 3.73Å; V122-A162 HydrophobicContact CG1-CB 3.86Å; V122-A162 HydrophobicContact CG2-CB 3.88Å; V122-L166 HydrophobicContact CB-CD1 4.08Å; V122-L166 HydrophobicContact CG1-CD1 4.02Å; V122-L166 HydrophobicContact CG2-CD1 4Å; V122-I172 HydrophobicContact CB-CG2 4.24Å; V122-I172 HydrophobicContact CG1-CG2 3.66Å; V122-L176 HydrophobicContact CG1-CD2 4.09Å
123	F	98.4	Very high	97.3	Very high	26 Å²	26	28 Å²	28	11%	0.114	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-49.8	178.6	-173.3	-86.7	0	0	0	112	R45 E119 P120 S121 M127 I172	R45-F123 HydrophobicContact CB-CD1 4.4Å; R45-F123 HydrophobicContact CB-CE1 4Å; R45-F123 HydrophobicContact CB-CZ 4.19Å; E119-F123 WeakPolarHBondContact O-CB 3.37Å; E119-F123 PolarHBondContact O-N 2.88Å; P120-F123 WeakPolarHBondContact O-CB 3.39Å; P120-F123 PolarHBondContact O-N 2.92Å; S121-F123 VanDerWaalsContact C-N 3.31Å; S121-F123 PolarHBondContact O-N 3.27Å; F123-M127 WeakPolarHBondContact O-CB 3.29Å; F123-M127 PolarHBondContact O-N 2.91Å; F123-I172 HydrophobicContact CB-CD1 4.29Å; F123-I172 HydrophobicContact CB-CG2 4.42Å; F123-I172 HydrophobicContact CD2-CD1 3.86Å; F123-I172 HydrophobicContact CD2-CG1 4.24Å
124	F	98.6	Very high	97.3	Very high	3 Å²	3	25 Å²	25	1%	0.013	14%	0.136	C	C	.	.	H	α-helix	trans	-74.9	-37.2	-177.5	-61.5	-51.9	0	0	0	112.9	L40 R45 L48 I107 L111 I112 S115 P120 S121 V122 M127 K128	L40-F124 HydrophobicContact CD1-CZ 4.21Å; R45-F124 HydrophobicContact CG-CE1 4.16Å; R45-F124 HydrophobicContact CG-CZ 3.68Å; L48-F124 HydrophobicContact CD2-CE1 4.19Å; I107-F124 HydrophobicContact CG2-CB 4.26Å; L111-F124 HydrophobicContact CB-CD1 4.07Å; L111-F124 HydrophobicContact CB-CD2 3.81Å; L111-F124 HydrophobicContact CB-CE1 4.05Å; L111-F124 HydrophobicContact CB-CE2 3.76Å; L111-F124 HydrophobicContact CB-CG 3.97Å; L111-F124 HydrophobicContact CB-CZ 3.87Å; L111-F124 HydrophobicContact CD1-CD1 3.85Å; L111-F124 HydrophobicContact CD1-CE1 3.66Å; L111-F124 HydrophobicContact CD1-CZ 4.16Å; L111-F124 HydrophobicContact CD2-CE1 4.29Å; L111-F124 HydrophobicContact CD2-CZ 3.99Å; L111-F124 HydrophobicContact CG-CE1 4.22Å; L111-F124 HydrophobicContact CG-CZ 4.23Å; I112-F124 HydrophobicContact CG1-CB 3.99Å; S115-F124 WeakPolarHBondContact OG-CD2 3.26Å; P120-F124 HydrophobicContact CB-CD2 4.34Å; P120-F124 HydrophobicContact CB-CE2 3.97Å; P120-F124 WeakPolarHBondContact O-CD2 3.4Å; P120-F124 WeakPolarHBondContact O-CG 3.47Å; P120-F124 PolarHBondContact O-N 2.79Å; S121-F124 PolarHBondContact O-N 3.19Å; V122-F124 PolarHBondContact O-N 3.1Å; F124-M127 PolarHBondContact O-N 3.25Å; F124-K128 WeakPolarHBondContact O-CB 3.42Å; F124-K128 PolarHBondContact O-N 2.92Å
125	Y	98.7	Very high	97.5	Very high	49 Å²	49	24.7 Å²	24.7	19%	0.192	13%	0.132	C	C	.	.	H	α-helix	trans	-66.5	-37.9	173.2	-80.1	-61.3	0	0	0	112.5	I112 S121 K128 G129 L157	I112-Y125 HydrophobicContact CD1-CD1 3.81Å; I112-Y125 HydrophobicContact CD1-CD2 4.47Å; I112-Y125 HydrophobicContact CD1-CE1 3.43Å; I112-Y125 VanDerWaalsContact CD1-CE1 3.43Å; I112-Y125 HydrophobicContact CD1-CE2 4.16Å; I112-Y125 HydrophobicContact CD1-CG 4.29Å; I112-Y125 HydrophobicContact CG1-CE1 4.48Å; I112-Y125 HydrophobicContact CG1-CE2 4.39Å; I112-Y125 HydrophobicContact CG2-CE2 4.24Å; S121-Y125 WeakPolarHBondContact O-CB 3.49Å; S121-Y125 WeakPolarHBondContact O-CD2 3.27Å; S121-Y125 PolarHBondContact O-N 3.34Å; Y125-K128 HydrophobicContact CD1-CD 4.39Å; Y125-K128 WeakPolarHBondContact O-CB 3.39Å; Y125-K128 PolarHBondContact O-N 3.23Å; Y125-G129 PolarHBondContact O-N 2.9Å; Y125-L157 HydrophobicContact CD1-CD2 3.95Å; Y125-L157 HydrophobicContact CD1-CG 4.38Å; Y125-L157 HydrophobicContact CD2-CD2 4.17Å; Y125-L157 HydrophobicContact CD2-CG 4.08Å; Y125-L157 HydrophobicContact CE1-CD2 3.4Å; Y125-L157 VanDerWaalsContact CE1-CD2 3.4Å; Y125-L157 HydrophobicContact CE1-CG 4.26Å; Y125-L157 HydrophobicContact CE2-CD2 3.66Å; Y125-L157 HydrophobicContact CE2-CG 3.94Å; Y125-L157 HydrophobicContact CG-CD2 4.31Å; Y125-L157 HydrophobicContact CG-CG 4.31Å; Y125-L157 WeakPolarHBondContact OH-CD2 3.2Å
126	K	98.7	Very high	97.6	Very high	35 Å²	35	23.7 Å²	23.7	15%	0.152	13%	0.125	C	C	.	.	H	α-helix	trans	-58.3	-49.3	170.4	178	-166.6	169.6	-66	0	110.6	V122 K128 G129 D130 G175 L176 N179	V122-K126 WeakPolarHBondContact O-CB 3.25Å; V122-K126 PolarHBondContact O-N 2.94Å; K126-K128 VanDerWaalsContact C-N 3.3Å; K126-K128 PolarHBondContact O-N 2.96Å; K126-G129 PolarHBondContact O-N 3.33Å; K126-D130 IonicContact NZ-OD2 3.69Å; K126-D130 PolarHBondContact NZ-OD2 3.39Å; K126-D130 PolarHBondContact O-N 2.87Å; K126-G175 WeakPolarHBondContact CE-O 3.32Å; K126-L176 HydrophobicContact CB-CD1 4.04Å; K126-L176 HydrophobicContact CD-CB 4.07Å; K126-L176 HydrophobicContact CG-CB 4.25Å; K126-L176 HydrophobicContact CG-CD1 3.99Å; K126-N179 PolarHBondContact NZ-ND2 3.15Å
127	M	98.5	Very high	97.9	Very high	8 Å²	8	20.5 Å²	20.5	4%	0.039	10%	0.099	C	C	.	.	H	α-helix	trans	-59.7	-42.7	177	-166.6	176.4	-173.8	0	0	110.8	Y52 I103 I107 F123 F124 G129 D130 Y131	Y52-M127 HydrophobicContact CD2-CE 4.45Å; Y52-M127 HydrophobicContact CG-CE 4.35Å; I103-M127 HydrophobicContact CD1-CE 3.74Å; I103-M127 HydrophobicContact CD1-SD 4.07Å; I103-M127 HydrophobicContact CG1-CE 3.75Å; I103-M127 HydrophobicContact CG1-SD 4.21Å; I107-M127 HydrophobicContact CD1-CB 4Å; I107-M127 HydrophobicContact CD1-CG 4.01Å; I107-M127 HydrophobicContact CD1-SD 4.18Å; F123-M127 WeakPolarHBondContact O-CB 3.29Å; F123-M127 PolarHBondContact O-N 2.91Å; F124-M127 PolarHBondContact O-N 3.25Å; M127-G129 VanDerWaalsContact C-N 3.34Å; M127-G129 PolarHBondContact O-N 3.45Å; M127-D130 WeakPolarHBondContact O-CB 3.41Å; M127-D130 PolarHBondContact O-N 2.61Å; M127-D130 VanDerWaalsContact O-N 3.12Å; M127-Y131 HydrophobicContact CE-CE2 3.68Å; M127-Y131 HydrophobicContact CG-CD2 3.95Å; M127-Y131 HydrophobicContact CG-CE2 3.77Å; M127-Y131 VanDerWaalsContact O-CD2 3.29Å; M127-Y131 WeakPolarHBondContact O-CD2 3.31Å; M127-Y131 PolarHBondContact O-N 3.02Å; M127-Y131 VanDerWaalsContact O-N 3.1Å
128	K	98.7	Very high	98.1	Very high	31 Å²	31	18.9 Å²	18.9	14%	0.135	9%	0.086	C	C	.	.	H	α-helix	trans	-54.3	-49.5	173.6	-165.1	177.5	-175.8	166.5	0	111.8	M104 I107 D108 F124 Y125 K126 D130 Y131 Y132 A154	M104-K128 HydrophobicContact CE-CG 4.42Å; M104-K128 HydrophobicContact SD-CB 4.18Å; M104-K128 HydrophobicContact SD-CG 3.48Å; M104-K128 WeakPolarHBondContact SD-CG 3.49Å; I107-K128 HydrophobicContact CD1-CB 4.38Å; I107-K128 HydrophobicContact CG2-CB 4.36Å; I107-K128 HydrophobicContact CG2-CD 4.41Å; D108-K128 WeakPolarHBondContact OD1-CE 3.27Å; D108-K128 IonicContact OD1-NZ 3.85Å; D108-K128 PolarHBondContact OD1-NZ 3.49Å; D108-K128 WeakPolarHBondContact OD2-CE 3.43Å; D108-K128 IonicContact OD2-NZ 2.84Å; D108-K128 PolarHBondContact OD2-NZ 3.38Å; F124-K128 WeakPolarHBondContact O-CB 3.42Å; F124-K128 PolarHBondContact O-N 2.92Å; Y125-K128 HydrophobicContact CD1-CD 4.39Å; Y125-K128 WeakPolarHBondContact O-CB 3.39Å; Y125-K128 PolarHBondContact O-N 3.23Å; K126-K128 VanDerWaalsContact C-N 3.3Å; K126-K128 PolarHBondContact O-N 2.96Å; K128-D130 VanDerWaalsContact C-N 3.34Å; K128-D130 PolarHBondContact O-N 2.83Å; K128-Y131 PolarHBondContact O-N 3.13Å; K128-Y132 HydrophobicContact CD-CE2 4.37Å; K128-Y132 HydrophobicContact CG-CD2 3.98Å; K128-Y132 HydrophobicContact CG-CE2 3.84Å; K128-Y132 VanDerWaalsContact O-CD2 3.31Å; K128-Y132 WeakPolarHBondContact O-CD2 3.35Å; K128-Y132 PolarHBondContact O-N 3.03Å; K128-Y132 VanDerWaalsContact O-N 3.13Å; K128-A154 HydrophobicContact CB-CB 4.03Å; K128-A154 HydrophobicContact CD-CB 4.3Å; K128-A154 HydrophobicContact CG-CB 4.11Å
129	G	98.8	Very high	98.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58	-43.1	174.8	0	0	0	0	0	113	Y125 K126 M127 Y131 R133 S151 Y155	Y125-G129 PolarHBondContact O-N 2.9Å; K126-G129 PolarHBondContact O-N 3.33Å; M127-G129 VanDerWaalsContact C-N 3.34Å; M127-G129 PolarHBondContact O-N 3.45Å; G129-Y131 PolarHBondContact O-N 2.89Å; G129-R133 VanDerWaalsContact O-CB 3.3Å; G129-R133 WeakPolarHBondContact O-CB 3.28Å; G129-R133 PolarHBondContact O-N 3.33Å; G129-S151 PolarHBondContact O-OG 3.47Å; G129-Y155 VanDerWaalsContact C-OH 3.26Å; G129-Y155 PolarHBondContact O-OH 2.69Å
130	D	98.8	Very high	98.3	Very high	8 Å²	8	23 Å²	23	4%	0.043	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-45.8	178.9	-80.5	-48.5	0	0	0	112.8	K126 M127 K128 R133 Y134 Y155 N179	K126-D130 IonicContact NZ-OD2 3.69Å; K126-D130 PolarHBondContact NZ-OD2 3.39Å; K126-D130 PolarHBondContact O-N 2.87Å; M127-D130 WeakPolarHBondContact O-CB 3.41Å; M127-D130 PolarHBondContact O-N 2.61Å; M127-D130 VanDerWaalsContact O-N 3.12Å; K128-D130 VanDerWaalsContact C-N 3.34Å; K128-D130 PolarHBondContact O-N 2.83Å; D130-R133 WeakPolarHBondContact O-CB 3.39Å; D130-R133 PolarHBondContact O-N 2.6Å; D130-R133 IonicContact OD1-CZ 3.84Å; D130-R133 IonicContact OD1-NE 2.68Å; D130-R133 IonicContact OD1-NH2 3.86Å; D130-R133 PolarHBondContact OD1-NH2 3.31Å; D130-Y134 HydrophobicContact CB-CE2 4.31Å; D130-Y134 VanDerWaalsContact O-CD1 3.23Å; D130-Y134 WeakPolarHBondContact O-CD1 3.42Å; D130-Y134 WeakPolarHBondContact O-CD2 3.47Å; D130-Y134 PolarHBondContact O-N 3.34Å; D130-Y155 VanDerWaalsContact CA-OH 3.24Å; D130-Y155 WeakPolarHBondContact CA-OH 3.42Å; D130-Y155 PolarHBondContact N-OH 2.61Å; D130-Y155 VanDerWaalsContact N-OH 3.16Å; D130-Y155 PolarHBondContact OD1-OH 2.8Å; D130-N179 WeakPolarHBondContact OD1-CB 3.27Å; D130-N179 PolarHBondContact OD1-ND2 3.19Å; D130-N179 PolarHBondContact OD2-ND2 3.26Å
131	Y	98.8	Very high	98.3	Very high	7 Å²	7	25.8 Å²	25.8	3%	0.027	14%	0.142	C	C	.	.	H	α-helix	trans	-76.9	-33.2	-177.2	-79.8	-97.2	0	0	0	113.2	Y52 K53 V56 I99 C100 I103 M104 M127 K128 G129 R133 Y134 L135	Y52-Y131 VanDerWaalsContact CB-OH 3.27Å; Y52-Y131 WeakPolarHBondContact CB-OH 3.45Å; Y52-Y131 PolarHBondContact O-OH 3.44Å; K53-Y131 PolarHBondContact N-OH 3.32Å; V56-Y131 HydrophobicContact CB-CE1 3.74Å; V56-Y131 HydrophobicContact CG1-CE1 3.85Å; V56-Y131 WeakPolarHBondContact CG1-OH 3.47Å; V56-Y131 HydrophobicContact CG2-CD1 4.17Å; V56-Y131 HydrophobicContact CG2-CE1 3.7Å; I99-Y131 HydrophobicContact CG2-CE1 4.35Å; C100-Y131 HydrophobicContact CB-CD1 4.15Å; I103-Y131 HydrophobicContact CG2-CD1 3.36Å; I103-Y131 HydrophobicContact CG2-CD2 4.01Å; I103-Y131 HydrophobicContact CG2-CE1 3.57Å; I103-Y131 HydrophobicContact CG2-CE2 4.23Å; I103-Y131 HydrophobicContact CG2-CG 3.59Å; M104-Y131 HydrophobicContact CE-CD2 4.18Å; M104-Y131 HydrophobicContact CE-CG 3.85Å; M127-Y131 HydrophobicContact CE-CE2 3.68Å; M127-Y131 HydrophobicContact CG-CD2 3.95Å; M127-Y131 HydrophobicContact CG-CE2 3.77Å; M127-Y131 VanDerWaalsContact O-CD2 3.29Å; M127-Y131 WeakPolarHBondContact O-CD2 3.31Å; M127-Y131 PolarHBondContact O-N 3.02Å; M127-Y131 VanDerWaalsContact O-N 3.1Å; K128-Y131 PolarHBondContact O-N 3.13Å; G129-Y131 PolarHBondContact O-N 2.89Å; 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 4.37Å; Y131-Y134 HydrophobicContact CD2-CD2 4.49Å; Y131-Y134 HydrophobicContact CD2-CE2 4.26Å; Y131-Y134 HydrophobicContact CE1-CD2 4.33Å; Y131-Y134 HydrophobicContact CE1-CE2 4.43Å; Y131-Y134 HydrophobicContact CE2-CE2 4.28Å; Y131-Y134 HydrophobicContact CG-CD2 4.06Å; Y131-Y134 HydrophobicContact CG-CE2 4.29Å; Y131-Y134 WeakPolarHBondContact O-CB 3.43Å; Y131-Y134 PolarHBondContact O-N 3.2Å; Y131-L135 PolarHBondContact O-N 2.88Å
132	Y	98.8	Very high	98.3	Very high	38 Å²	38	30.7 Å²	30.7	15%	0.149	17%	0.167	C	C	.	.	H	α-helix	trans	-65.6	-37.5	168.1	-83.3	-65.4	0	0	0	112.1	M104 K128 Y134 L135 A136 H150	M104-Y132 HydrophobicContact CG-CD2 4.49Å; M104-Y132 HydrophobicContact CG-CE2 3.96Å; M104-Y132 HydrophobicContact SD-CD2 3.66Å; M104-Y132 HydrophobicContact SD-CE2 3.49Å; M104-Y132 WeakPolarHBondContact SD-CE2 3.12Å; M104-Y132 HydrophobicContact SD-CG 4.46Å; K128-Y132 HydrophobicContact CD-CE2 4.37Å; K128-Y132 HydrophobicContact CG-CD2 3.98Å; K128-Y132 HydrophobicContact CG-CE2 3.84Å; K128-Y132 VanDerWaalsContact O-CD2 3.31Å; K128-Y132 WeakPolarHBondContact O-CD2 3.35Å; K128-Y132 PolarHBondContact O-N 3.03Å; K128-Y132 VanDerWaalsContact O-N 3.13Å; Y132-Y134 VanDerWaalsContact C-N 3.31Å; Y132-Y134 PolarHBondContact O-N 2.87Å; Y132-L135 HydrophobicContact CD1-CD1 3.99Å; Y132-L135 HydrophobicContact CE1-CD1 4.36Å; Y132-L135 WeakPolarHBondContact O-CB 3.28Å; Y132-L135 PolarHBondContact O-N 3.49Å; Y132-A136 PolarHBondContact O-N 3.48Å; Y132-H150 HydrophobicContact CD1-CB 3.57Å; Y132-H150 HydrophobicContact CD2-CB 3.71Å; Y132-H150 HydrophobicContact CE1-CB 3.6Å; Y132-H150 AromaticContact CE1-CG 3.88Å; Y132-H150 HydrophobicContact CE2-CB 3.75Å; Y132-H150 HydrophobicContact CG-CB 3.62Å; Y132-H150 AromaticContact CZ-CG 3.92Å
133	R	98.7	Very high	98.3	Very high	12 Å²	12	35.6 Å²	35.6	5%	0.045	19%	0.19	C	C	.	.	H	α-helix	trans	-58.2	-44.5	170.4	170	170.6	69.4	88.2	0.6	111.1	G129 D130 Y131 L135 A136 E137 Y155 F183 E186 I187	G129-R133 VanDerWaalsContact O-CB 3.3Å; G129-R133 WeakPolarHBondContact O-CB 3.28Å; G129-R133 PolarHBondContact O-N 3.33Å; D130-R133 WeakPolarHBondContact O-CB 3.39Å; D130-R133 PolarHBondContact O-N 2.6Å; D130-R133 IonicContact OD1-CZ 3.84Å; D130-R133 IonicContact OD1-NE 2.68Å; D130-R133 IonicContact OD1-NH2 3.86Å; D130-R133 PolarHBondContact OD1-NH2 3.31Å; Y131-R133 VanDerWaalsContact C-N 3.33Å; R133-L135 VanDerWaalsContact C-N 3.31Å; R133-L135 PolarHBondContact O-N 3.32Å; R133-A136 WeakPolarHBondContact O-CB 3.25Å; R133-A136 PolarHBondContact O-N 3.1Å; R133-A136 VanDerWaalsContact O-N 3.08Å; R133-E137 IonicContact NH1-OE1 3.77Å; R133-E137 PolarHBondContact O-N 3.12Å; R133-Y155 PolarHBondContact NE-OH 2.92Å; R133-F183 HydrophobicContact CB-CD2 4.18Å; R133-F183 HydrophobicContact CG-CD2 4.24Å; R133-E186 IonicContact NH1-OE2 2.61Å; R133-I187 HydrophobicContact CG-CD1 4.2Å; R133-I187 HydrophobicContact CG-CG1 3.77Å
134	Y	98.6	Very high	98.3	Very high	25 Å²	25	39.6 Å²	39.6	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-38.3	176.2	-56.8	-25.9	0	0	0	112.6	V56 R60 D130 Y131 Y132 E137 F138	V56-Y134 HydrophobicContact CG1-CD2 4.29Å; V56-Y134 HydrophobicContact CG1-CE2 3.98Å; V56-Y134 HydrophobicContact CG2-CD2 3.9Å; V56-Y134 HydrophobicContact CG2-CE2 4.41Å; R60-Y134 VanDerWaalsContact CZ-CD1 3.43Å; R60-Y134 VanDerWaalsContact NE-CD1 3.34Å; D130-Y134 HydrophobicContact CB-CE2 4.31Å; D130-Y134 VanDerWaalsContact O-CD1 3.23Å; D130-Y134 WeakPolarHBondContact O-CD1 3.42Å; D130-Y134 WeakPolarHBondContact O-CD2 3.47Å; D130-Y134 PolarHBondContact O-N 3.34Å; Y131-Y134 AromaticContact CD1-CD2 3.97Å; Y131-Y134 HydrophobicContact CD1-CD2 3.97Å; Y131-Y134 HydrophobicContact CD1-CE2 4.37Å; Y131-Y134 HydrophobicContact CD2-CD2 4.49Å; Y131-Y134 HydrophobicContact CD2-CE2 4.26Å; Y131-Y134 HydrophobicContact CE1-CD2 4.33Å; Y131-Y134 HydrophobicContact CE1-CE2 4.43Å; Y131-Y134 HydrophobicContact CE2-CE2 4.28Å; Y131-Y134 HydrophobicContact CG-CD2 4.06Å; Y131-Y134 HydrophobicContact CG-CE2 4.29Å; Y131-Y134 WeakPolarHBondContact O-CB 3.43Å; Y131-Y134 PolarHBondContact O-N 3.2Å; Y132-Y134 VanDerWaalsContact C-N 3.31Å; Y132-Y134 PolarHBondContact O-N 2.87Å; Y134-E137 WeakPolarHBondContact CD1-OE1 3.16Å; Y134-E137 WeakPolarHBondContact O-CB 3.49Å; Y134-E137 PolarHBondContact O-N 2.55Å; Y134-F138 WeakPolarHBondContact O-CD1 3.48Å; Y134-F138 VanDerWaalsContact O-CE1 3.27Å; Y134-F138 WeakPolarHBondContact O-CE1 3.46Å
135	L	98.7	Very high	98.3	Very high	17 Å²	17	45.8 Å²	45.8	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-44.9	171.7	-69.4	174.9	0	0	0	111.4	C100 Y131 Y132 R133 E137 F138 K139 A147	C100-L135 HydrophobicContact CB-CD1 4.03Å; C100-L135 HydrophobicContact CB-CD2 3.74Å; C100-L135 HydrophobicContact CB-CG 3.77Å; Y131-L135 PolarHBondContact O-N 2.88Å; Y132-L135 HydrophobicContact CD1-CD1 3.99Å; Y132-L135 HydrophobicContact CE1-CD1 4.36Å; Y132-L135 WeakPolarHBondContact O-CB 3.28Å; Y132-L135 PolarHBondContact O-N 3.49Å; R133-L135 VanDerWaalsContact C-N 3.31Å; R133-L135 PolarHBondContact O-N 3.32Å; L135-E137 PolarHBondContact O-N 3.21Å; L135-E137 VanDerWaalsContact O-N 3.17Å; L135-F138 HydrophobicContact CD2-CE1 4.06Å; L135-F138 HydrophobicContact CD2-CZ 3.68Å; L135-F138 PolarHBondContact O-N 3.34Å; L135-K139 HydrophobicContact CB-CG 4.46Å; L135-K139 VanDerWaalsContact O-CB 3.27Å; L135-K139 WeakPolarHBondContact O-CB 3.29Å; L135-K139 WeakPolarHBondContact O-CG 3.43Å; L135-K139 PolarHBondContact O-N 3.01Å; L135-A147 HydrophobicContact CB-CB 3.9Å
136	A	98.6	Very high	98.3	Very high	1 Å²	1	49 Å²	49	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-16.9	-179.7	0	0	0	0	0	114.3	Y132 R133 A147 I187	Y132-A136 PolarHBondContact O-N 3.48Å; R133-A136 WeakPolarHBondContact O-CB 3.25Å; R133-A136 PolarHBondContact O-N 3.1Å; R133-A136 VanDerWaalsContact O-N 3.08Å; A136-A147 HydrophobicContact CB-CB 4Å; A136-I187 HydrophobicContact CB-CD1 4.15Å; A136-I187 HydrophobicContact CB-CG1 4.43Å; A136-I187 HydrophobicContact CB-CG2 3.78Å
137	E	98	Very high	98.3	Very high	34 Å²	34	47.6 Å²	47.6	16%	0.159	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-36.4	176	-71.5	171.7	-154.7	0	0	112.8	R60 W63 R64 R133 Y134 L135 I187	R60-E137 IonicContact CZ-OE1 2.66Å; R60-E137 IonicContact CZ-OE2 2.8Å; R60-E137 IonicContact NE-OE1 3.7Å; R60-E137 PolarHBondContact NE-OE1 3.05Å; R60-E137 IonicContact NE-OE2 3.37Å; R60-E137 PolarHBondContact NE-OE2 3.23Å; R60-E137 VanDerWaalsContact NH2-CD 3.34Å; R60-E137 IonicContact NH2-OE1 3.26Å; R60-E137 PolarHBondContact NH2-OE1 3.39Å; R60-E137 IonicContact NH2-OE2 3.46Å; R60-E137 PolarHBondContact NH2-OE2 3.01Å; R60-E137 VanDerWaalsContact NH2-OE2 3.14Å; W63-E137 HydrophobicContact CH2-CB 4.05Å; W63-E137 WeakPolarHBondContact CH2-O 3.34Å; W63-E137 HydrophobicContact CZ3-CB 4.15Å; R64-E137 IonicContact CZ-OE2 3.01Å; R64-E137 IonicContact NH2-OE1 2.83Å; R64-E137 IonicContact NH2-OE2 3.87Å; R64-E137 PolarHBondContact NH2-OE2 3.02Å; R133-E137 IonicContact NH1-OE1 3.77Å; R133-E137 PolarHBondContact O-N 3.12Å; Y134-E137 WeakPolarHBondContact CD1-OE1 3.16Å; Y134-E137 WeakPolarHBondContact O-CB 3.49Å; Y134-E137 PolarHBondContact O-N 2.55Å; L135-E137 PolarHBondContact O-N 3.21Å; L135-E137 VanDerWaalsContact O-N 3.17Å; E137-I187 HydrophobicContact CG-CD1 4.06Å
138	F	97.2	Very high	98.3	Very high	21 Å²	21	47.8 Å²	47.8	9%	0.092	25%	0.246	C	C	.	.	H	α-helix	trans	-122.2	-18.4	-171.5	68.2	-91.7	0	0	0	114.3	W63 E93 L96 S97 Y134 L135	W63-F138 HydrophobicContact CD2-CB 4.26Å; W63-F138 VanDerWaalsContact CE2-CB 3.42Å; W63-F138 HydrophobicContact CH2-CB 4.18Å; W63-F138 HydrophobicContact CZ2-CB 3.4Å; E93-F138 HydrophobicContact CB-CD2 3.69Å; E93-F138 HydrophobicContact CB-CE2 3.78Å; E93-F138 HydrophobicContact CG-CB 4.19Å; E93-F138 HydrophobicContact CG-CD2 3.52Å; E93-F138 HydrophobicContact CG-CE2 4.12Å; E93-F138 HydrophobicContact CG-CG 4.01Å; L96-F138 HydrophobicContact CB-CE1 4.26Å; L96-F138 HydrophobicContact CB-CZ 4.27Å; L96-F138 HydrophobicContact CD2-CD1 3.57Å; L96-F138 HydrophobicContact CD2-CE1 3.31Å; L96-F138 HydrophobicContact CD2-CZ 4.12Å; L96-F138 HydrophobicContact CG-CD1 4.37Å; L96-F138 HydrophobicContact CG-CE1 3.61Å; L96-F138 HydrophobicContact CG-CZ 4.08Å; S97-F138 WeakPolarHBondContact OG-CE2 3.43Å; S97-F138 WeakPolarHBondContact OG-CZ 3.28Å; Y134-F138 WeakPolarHBondContact O-CD1 3.48Å; Y134-F138 VanDerWaalsContact O-CE1 3.27Å; Y134-F138 WeakPolarHBondContact O-CE1 3.46Å; L135-F138 HydrophobicContact CD2-CE1 4.06Å; L135-F138 HydrophobicContact CD2-CZ 3.68Å; L135-F138 PolarHBondContact O-N 3.34Å
139	K	98.1	Very high	98.3	Very high	56 Å²	56	50 Å²	50	24%	0.243	26%	0.259	C	S	.	.			trans	-67.5	160.2	173.5	-69.6	-60.3	-157.8	159.5	0	111.3	L135 E143 R144	L135-K139 HydrophobicContact CB-CG 4.46Å; L135-K139 VanDerWaalsContact O-CB 3.27Å; L135-K139 WeakPolarHBondContact O-CB 3.29Å; L135-K139 WeakPolarHBondContact O-CG 3.43Å; L135-K139 PolarHBondContact O-N 3.01Å; K139-E143 HydrophobicContact CB-CB 4.2Å; K139-E143 HydrophobicContact CD-CB 4.29Å; K139-E143 VanDerWaalsContact CD-OE2 3.3Å; K139-E143 WeakPolarHBondContact CD-OE2 3.24Å; K139-E143 HydrophobicContact CG-CB 4.44Å; K139-E143 IonicContact NZ-OE1 3.91Å; K139-E143 PolarHBondContact NZ-OE1 3.41Å; K139-E143 IonicContact NZ-OE2 3.29Å; K139-E143 PolarHBondContact NZ-OE2 3Å; K139-R144 HydrophobicContact CB-CB 4.23Å; K139-R144 WeakPolarHBondContact O-CB 3.41Å; K139-R144 WeakPolarHBondContact O-CD 3.38Å
140	S	96.6	Very high	98.3	Very high	90 Å²	90	53.4 Å²	53.4	63%	0.629	28%	0.275	S	S	*	.			trans	-133.5	159.3	-178.4	62.1	0	0	0	0	112.2	E143	S140-E143 PolarHBondContact O-N 2.9Å
141	G	97.2	Very high	98.3	Very high	59 Å²	59	53 Å²	53	61%	0.608	27%	0.273	S	S	*	.	H	α-helix	trans	59.9	-136.3	176.2	0	0	0	0	0	112.7	E143 R144 K145	G141-E143 VanDerWaalsContact C-N 3.35Å; G141-E143 PolarHBondContact O-N 3.48Å; G141-R144 WeakPolarHBondContact O-CB 3.3Å; G141-R144 PolarHBondContact O-N 3.01Å; G141-K145 PolarHBondContact O-N 3.01Å
142	D	98.2	Very high	98.3	Very high	124 Å²	124	54.2 Å²	54.2	66%	0.663	28%	0.279	S	S	*	.	H	α-helix	trans	-63.4	-38	-177.6	-65.3	-29.9	0	0	0	112.4	R144 K145 E146	D142-R144 VanDerWaalsContact C-N 3.27Å; D142-R144 PolarHBondContact O-N 3.43Å; D142-K145 WeakPolarHBondContact O-CB 3.41Å; D142-K145 PolarHBondContact O-N 3.32Å; D142-K145 VanDerWaalsContact O-N 3.09Å; D142-E146 WeakPolarHBondContact O-CG 3.21Å; D142-E146 PolarHBondContact O-N 3.29Å
143	E	98	Very high	98.3	Very high	103 Å²	103	58.6 Å²	58.6	48%	0.481	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-37.8	177.2	-63	-169	137	0	0	112	K139 S140 G141 A147	K139-E143 HydrophobicContact CB-CB 4.2Å; K139-E143 HydrophobicContact CD-CB 4.29Å; K139-E143 VanDerWaalsContact CD-OE2 3.3Å; K139-E143 WeakPolarHBondContact CD-OE2 3.24Å; K139-E143 HydrophobicContact CG-CB 4.44Å; K139-E143 IonicContact NZ-OE1 3.91Å; K139-E143 PolarHBondContact NZ-OE1 3.41Å; K139-E143 IonicContact NZ-OE2 3.29Å; K139-E143 PolarHBondContact NZ-OE2 3Å; S140-E143 PolarHBondContact O-N 2.9Å; G141-E143 VanDerWaalsContact C-N 3.35Å; G141-E143 PolarHBondContact O-N 3.48Å; E143-A147 WeakPolarHBondContact O-CB 3.23Å; E143-A147 PolarHBondContact O-N 3.31Å
144	R	98.4	Very high	98.3	Very high	111 Å²	111	58.3 Å²	58.3	42%	0.419	30%	0.299	S	S	.	.	H	α-helix	trans	-65.7	-44.1	175.7	-174.7	179.6	173.5	-115.9	-4	111	K139 G141 D142 A147 A148 I187	K139-R144 HydrophobicContact CB-CB 4.23Å; K139-R144 WeakPolarHBondContact O-CB 3.41Å; K139-R144 WeakPolarHBondContact O-CD 3.38Å; G141-R144 WeakPolarHBondContact O-CB 3.3Å; G141-R144 PolarHBondContact O-N 3.01Å; D142-R144 VanDerWaalsContact C-N 3.27Å; D142-R144 PolarHBondContact O-N 3.43Å; R144-A147 PolarHBondContact O-N 3.37Å; R144-A148 WeakPolarHBondContact O-CB 3.49Å; R144-A148 PolarHBondContact O-N 3.41Å; R144-I187 PolarHBondContact NH2-O 3.17Å
145	K	98.5	Very high	98.3	Very high	133 Å²	133	57.1 Å²	57.1	58%	0.578	29%	0.294	S	S	*	.	H	α-helix	trans	-63.9	-46.5	-179.8	-176.4	-178.9	175.5	-175.1	0	110.7	G141 D142 A147 A148 D149	G141-K145 PolarHBondContact O-N 3.01Å; D142-K145 WeakPolarHBondContact O-CB 3.41Å; D142-K145 PolarHBondContact O-N 3.32Å; D142-K145 VanDerWaalsContact O-N 3.09Å; K145-A147 PolarHBondContact O-N 3.03Å; K145-A148 PolarHBondContact O-N 3.43Å; K145-D149 WeakPolarHBondContact O-CB 3.34Å; K145-D149 PolarHBondContact O-N 2.81Å
146	E	98.5	Very high	98.3	Very high	116 Å²	116	60.8 Å²	60.8	54%	0.542	31%	0.311	S	S	.	.	H	α-helix	trans	-59.9	-45	175.9	-72.2	177.9	-177.5	0	0	111.6	D142 A148 D149 H150	D142-E146 WeakPolarHBondContact O-CG 3.21Å; D142-E146 PolarHBondContact O-N 3.29Å; E146-A148 PolarHBondContact O-N 3.12Å; E146-D149 PolarHBondContact O-N 2.9Å; E146-H150 PolarHBondContact O-N 3.46Å; E146-H150 PolarHBondContact O-ND1 2.89Å
147	A	98.7	Very high	98.3	Very high	6 Å²	6	64.3 Å²	64.3	5%	0.05	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-44.5	175.8	0	0	0	0	0	111.8	L135 A136 E143 R144 K145 D149 H150 S151	L135-A147 HydrophobicContact CB-CB 3.9Å; A136-A147 HydrophobicContact CB-CB 4Å; E143-A147 WeakPolarHBondContact O-CB 3.23Å; E143-A147 PolarHBondContact O-N 3.31Å; R144-A147 PolarHBondContact O-N 3.37Å; K145-A147 PolarHBondContact O-N 3.03Å; A147-D149 PolarHBondContact O-N 3.16Å; A147-H150 PolarHBondContact O-N 3.4Å; A147-S151 WeakPolarHBondContact O-CB 3.31Å; A147-S151 PolarHBondContact O-N 3.14Å
148	A	98.8	Very high	98.3	Very high	12 Å²	12	62.7 Å²	62.7	10%	0.099	32%	0.322	C	S	.	.	H	α-helix	trans	-62.9	-41.6	176.4	0	0	0	0	0	112.4	R144 K145 E146 S151 M152 F183 I187	R144-A148 WeakPolarHBondContact O-CB 3.49Å; R144-A148 PolarHBondContact O-N 3.41Å; K145-A148 PolarHBondContact O-N 3.43Å; E146-A148 PolarHBondContact O-N 3.12Å; A148-S151 WeakPolarHBondContact O-CB 3.49Å; A148-S151 PolarHBondContact O-N 3.17Å; A148-M152 WeakPolarHBondContact O-CB 3.48Å; A148-M152 PolarHBondContact O-N 3.06Å; A148-F183 HydrophobicContact CB-CE2 4.42Å; A148-F183 HydrophobicContact CB-CZ 4.47Å; A148-F183 WeakPolarHBondContact O-CZ 3.43Å; A148-I187 HydrophobicContact CB-CG2 3.95Å
149	D	98.7	Very high	98.4	Very high	76 Å²	76	62.6 Å²	62.6	41%	0.406	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-41.6	178.2	-73.6	-17.1	0	0	0	111.7	K145 E146 A147 K153	K145-D149 WeakPolarHBondContact O-CB 3.34Å; K145-D149 PolarHBondContact O-N 2.81Å; E146-D149 PolarHBondContact O-N 2.9Å; A147-D149 PolarHBondContact O-N 3.16Å; D149-K153 VanDerWaalsContact O-CG 3.27Å; D149-K153 WeakPolarHBondContact O-CG 3.34Å; D149-K153 PolarHBondContact O-N 2.68Å
150	H	98.7	Very high	98.4	Very high	73 Å²	73	64.3 Å²	64.3	34%	0.338	34%	0.339	S	S	.	.	H	α-helix	trans	-67.4	-40.8	175.1	-73	94.7	0	0	0	112.1	Y132 E146 A147 K153 A154	Y132-H150 HydrophobicContact CD1-CB 3.57Å; Y132-H150 HydrophobicContact CD2-CB 3.71Å; Y132-H150 HydrophobicContact CE1-CB 3.6Å; Y132-H150 AromaticContact CE1-CG 3.88Å; Y132-H150 HydrophobicContact CE2-CB 3.75Å; Y132-H150 HydrophobicContact CG-CB 3.62Å; Y132-H150 AromaticContact CZ-CG 3.92Å; E146-H150 PolarHBondContact O-N 3.46Å; E146-H150 PolarHBondContact O-ND1 2.89Å; A147-H150 PolarHBondContact O-N 3.4Å; H150-K153 PolarHBondContact O-N 3.47Å; H150-A154 WeakPolarHBondContact O-CB 3.25Å; H150-A154 PolarHBondContact O-N 2.95Å
151	S	98.8	Very high	98.5	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.1	-50.5	173.6	175.6	0	0	0	0	111.1	G129 A147 A148 K153 A154 Y155 F183	G129-S151 PolarHBondContact O-OG 3.47Å; A147-S151 WeakPolarHBondContact O-CB 3.31Å; A147-S151 PolarHBondContact O-N 3.14Å; A148-S151 WeakPolarHBondContact O-CB 3.49Å; A148-S151 PolarHBondContact O-N 3.17Å; S151-K153 PolarHBondContact O-N 3.25Å; S151-A154 PolarHBondContact O-N 3.46Å; S151-Y155 WeakPolarHBondContact O-CD2 3.45Å; S151-Y155 PolarHBondContact O-N 3.35Å; S151-Y155 WeakPolarHBondContact OG-CE2 3.41Å; S151-F183 WeakPolarHBondContact OG-CD2 3.41Å; S151-F183 WeakPolarHBondContact OG-CE2 3.48Å
152	M	98.8	Very high	98.5	Very high	32 Å²	32	58.5 Å²	58.5	16%	0.158	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-51.6	177.2	178	62.8	84.1	0	0	111.8	A148 A154 Y155 Q156 F180 F183 Y184 L188	A148-M152 WeakPolarHBondContact O-CB 3.48Å; A148-M152 PolarHBondContact O-N 3.06Å; M152-A154 VanDerWaalsContact C-N 3.31Å; M152-A154 PolarHBondContact O-N 3.03Å; M152-Y155 PolarHBondContact O-N 3.13Å; M152-Q156 HydrophobicContact CG-CG 4.33Å; M152-Q156 WeakPolarHBondContact O-CB 3.39Å; M152-Q156 VanDerWaalsContact O-CG 3.29Å; M152-Q156 WeakPolarHBondContact O-CG 3.35Å; M152-Q156 PolarHBondContact O-N 2.89Å; M152-Q156 HydrophobicContact SD-CG 3.92Å; M152-F180 HydrophobicContact SD-CE2 3.72Å; M152-F180 HydrophobicContact SD-CZ 3.66Å; M152-F183 HydrophobicContact CB-CE1 4Å; M152-F183 HydrophobicContact CB-CZ 4.09Å; M152-F183 HydrophobicContact CE-CE1 3.71Å; M152-F183 HydrophobicContact SD-CE1 4.14Å; M152-Y184 HydrophobicContact CE-CE1 3.62Å; M152-L188 HydrophobicContact CE-CD1 3.32Å
153	K	98.7	Very high	98.5	Very high	129 Å²	129	58.3 Å²	58.3	56%	0.561	28%	0.283	S	S	*	.	H	α-helix	trans	-58.6	-43.4	-179.5	-72.9	168.9	-174	172.2	0	112	D149 H150 S151 Q156 L157	D149-K153 VanDerWaalsContact O-CG 3.27Å; D149-K153 WeakPolarHBondContact O-CG 3.34Å; D149-K153 PolarHBondContact O-N 2.68Å; H150-K153 PolarHBondContact O-N 3.47Å; S151-K153 PolarHBondContact O-N 3.25Å; K153-Q156 PolarHBondContact O-N 3.33Å; K153-L157 WeakPolarHBondContact O-CB 3.44Å; K153-L157 PolarHBondContact O-N 3.33Å
154	A	98.8	Very high	98.5	Very high	6 Å²	6	57.4 Å²	57.4	5%	0.05	29%	0.293	C	S	.	.	H	α-helix	trans	-64.7	-46.1	179.6	0	0	0	0	0	111.7	K128 H150 S151 M152 L157 A158	K128-A154 HydrophobicContact CB-CB 4.03Å; K128-A154 HydrophobicContact CD-CB 4.3Å; K128-A154 HydrophobicContact CG-CB 4.11Å; H150-A154 WeakPolarHBondContact O-CB 3.25Å; H150-A154 PolarHBondContact O-N 2.95Å; S151-A154 PolarHBondContact O-N 3.46Å; M152-A154 VanDerWaalsContact C-N 3.31Å; M152-A154 PolarHBondContact O-N 3.03Å; A154-L157 PolarHBondContact O-N 3.39Å; A154-A158 WeakPolarHBondContact O-CB 3.44Å; A154-A158 PolarHBondContact O-N 3.01Å
155	Y	98.9	Very high	98.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-39.2	176.5	-73.2	-52.5	0	0	0	113.3	G129 D130 R133 S151 M152 A158 S159 L176 N179 F180 F183	G129-Y155 VanDerWaalsContact C-OH 3.26Å; G129-Y155 PolarHBondContact O-OH 2.69Å; D130-Y155 VanDerWaalsContact CA-OH 3.24Å; D130-Y155 WeakPolarHBondContact CA-OH 3.42Å; D130-Y155 PolarHBondContact N-OH 2.61Å; D130-Y155 VanDerWaalsContact N-OH 3.16Å; D130-Y155 PolarHBondContact OD1-OH 2.8Å; R133-Y155 PolarHBondContact NE-OH 2.92Å; S151-Y155 WeakPolarHBondContact O-CD2 3.45Å; S151-Y155 PolarHBondContact O-N 3.35Å; S151-Y155 WeakPolarHBondContact OG-CE2 3.41Å; M152-Y155 PolarHBondContact O-N 3.13Å; Y155-A158 PolarHBondContact O-N 3.4Å; Y155-S159 WeakPolarHBondContact O-CB 3.32Å; Y155-S159 PolarHBondContact O-N 3.49Å; Y155-S159 PolarHBondContact O-OG 3.48Å; Y155-L176 HydrophobicContact CD1-CD1 3.6Å; Y155-L176 HydrophobicContact CE1-CD1 4.31Å; Y155-N179 HydrophobicContact CE1-CB 4.24Å; Y155-F180 VanDerWaalsContact CB-CD2 3.45Å; Y155-F180 HydrophobicContact CD1-CB 4.02Å; Y155-F180 HydrophobicContact CD1-CD2 4.42Å; Y155-F180 HydrophobicContact CD1-CG 4.25Å; Y155-F180 HydrophobicContact CD2-CB 4.44Å; Y155-F180 AromaticContact CD2-CD2 3.49Å; Y155-F180 HydrophobicContact CD2-CD2 3.49Å; Y155-F180 VanDerWaalsContact CD2-CD2 3.49Å; Y155-F180 AromaticContact CD2-CE2 3.93Å; Y155-F180 HydrophobicContact CD2-CE2 3.93Å; Y155-F180 HydrophobicContact CD2-CG 4.14Å; Y155-F180 HydrophobicContact CE1-CB 4.44Å; Y155-F180 HydrophobicContact CE2-CD2 4.31Å; Y155-F180 HydrophobicContact CG-CB 4.01Å; Y155-F180 HydrophobicContact CG-CD1 4.37Å; Y155-F180 AromaticContact CG-CD2 3.56Å; Y155-F180 HydrophobicContact CG-CD2 3.56Å; Y155-F180 HydrophobicContact CG-CE2 4.05Å; Y155-F180 AromaticContact CG-CG 3.76Å; Y155-F180 HydrophobicContact CG-CG 3.76Å; Y155-F183 HydrophobicContact CD2-CB 4.2Å; Y155-F183 HydrophobicContact CD2-CD1 4.16Å; Y155-F183 HydrophobicContact CD2-CG 4.11Å; Y155-F183 HydrophobicContact CE2-CB 3.68Å; Y155-F183 HydrophobicContact CE2-CD1 4.37Å; Y155-F183 HydrophobicContact CE2-CD2 4.28Å; Y155-F183 AromaticContact CE2-CG 3.86Å; Y155-F183 HydrophobicContact CE2-CG 3.86Å
156	Q	98.7	Very high	98.3	Very high	95 Å²	95	52.3 Å²	52.3	44%	0.444	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-45.7	176.5	-75.1	177.1	-30.8	0	0	111.4	M152 K153 A158 S159 T160 F180	M152-Q156 HydrophobicContact CG-CG 4.33Å; M152-Q156 WeakPolarHBondContact O-CB 3.39Å; M152-Q156 VanDerWaalsContact O-CG 3.29Å; M152-Q156 WeakPolarHBondContact O-CG 3.35Å; M152-Q156 PolarHBondContact O-N 2.89Å; M152-Q156 HydrophobicContact SD-CG 3.92Å; K153-Q156 PolarHBondContact O-N 3.33Å; Q156-A158 PolarHBondContact O-N 2.95Å; Q156-S159 PolarHBondContact O-N 3.26Å; Q156-S159 VanDerWaalsContact O-N 3.14Å; Q156-T160 PolarHBondContact O-N 3.36Å; Q156-T160 PolarHBondContact O-OG1 3.14Å; Q156-T160 VanDerWaalsContact O-OG1 3.12Å; Q156-F180 HydrophobicContact CG-CE1 4.47Å; Q156-F180 HydrophobicContact CG-CZ 4.04Å
157	L	98.1	Very high	98.2	Very high	75 Å²	75	49.3 Å²	49.3	39%	0.393	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-40.6	177.4	-176.6	53	0	0	0	112.1	Y125 K153 A154 S159 T161	Y125-L157 HydrophobicContact CD1-CD2 3.95Å; Y125-L157 HydrophobicContact CD1-CG 4.38Å; Y125-L157 HydrophobicContact CD2-CD2 4.17Å; Y125-L157 HydrophobicContact CD2-CG 4.08Å; Y125-L157 HydrophobicContact CE1-CD2 3.4Å; Y125-L157 VanDerWaalsContact CE1-CD2 3.4Å; Y125-L157 HydrophobicContact CE1-CG 4.26Å; Y125-L157 HydrophobicContact CE2-CD2 3.66Å; Y125-L157 HydrophobicContact CE2-CG 3.94Å; Y125-L157 HydrophobicContact CG-CD2 4.31Å; Y125-L157 HydrophobicContact CG-CG 4.31Å; Y125-L157 WeakPolarHBondContact OH-CD2 3.2Å; K153-L157 WeakPolarHBondContact O-CB 3.44Å; K153-L157 PolarHBondContact O-N 3.33Å; A154-L157 PolarHBondContact O-N 3.39Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 3.07Å; L157-T161 WeakPolarHBondContact O-CB 3.46Å; L157-T161 PolarHBondContact O-N 2.97Å; L157-T161 VanDerWaalsContact O-N 3.15Å; L157-T161 PolarHBondContact O-OG1 3.28Å
158	A	98.6	Very high	98.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-41.3	172	0	0	0	0	0	111.6	V122 A154 Y155 Q156 T161 A162 L176	V122-A158 HydrophobicContact CG1-CB 4.4Å; A154-A158 WeakPolarHBondContact O-CB 3.44Å; A154-A158 PolarHBondContact O-N 3.01Å; Y155-A158 PolarHBondContact O-N 3.4Å; Q156-A158 PolarHBondContact O-N 2.95Å; A158-T161 PolarHBondContact O-N 3.45Å; A158-A162 WeakPolarHBondContact O-CB 3.42Å; A158-A162 PolarHBondContact O-N 3.25Å; A158-L176 VanDerWaalsContact C-CD2 3.44Å; A158-L176 HydrophobicContact CB-CD1 3.74Å; A158-L176 HydrophobicContact CB-CD2 3.63Å; A158-L176 HydrophobicContact CB-CG 4.35Å
159	S	98.6	Very high	97.9	Very high	19 Å²	19	49.2 Å²	49.2	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-67.9	-48.9	-176.7	-56.8	0	0	0	0	110.9	Y155 Q156 L157 T161 A162 E163	Y155-S159 WeakPolarHBondContact O-CB 3.32Å; Y155-S159 PolarHBondContact O-N 3.49Å; Y155-S159 PolarHBondContact O-OG 3.48Å; Q156-S159 PolarHBondContact O-N 3.26Å; Q156-S159 VanDerWaalsContact O-N 3.14Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 3.07Å; S159-T161 VanDerWaalsContact C-N 3.29Å; S159-T161 PolarHBondContact O-N 3.12Å; S159-A162 PolarHBondContact O-N 3.33Å; S159-A162 VanDerWaalsContact O-N 3.16Å; S159-E163 WeakPolarHBondContact O-CB 3.3Å; S159-E163 WeakPolarHBondContact O-CG 3.33Å; S159-E163 PolarHBondContact O-N 3.37Å
160	T	98.3	Very high	97.8	Very high	92 Å²	92	47.5 Å²	47.5	56%	0.564	26%	0.259	S	S	*	.	H	α-helix	trans	-56.4	-43.7	175.7	-56	0	0	0	0	111.9	Q156 A164	Q156-T160 PolarHBondContact O-N 3.36Å; Q156-T160 PolarHBondContact O-OG1 3.14Å; Q156-T160 VanDerWaalsContact O-OG1 3.12Å; T160-A164 PolarHBondContact O-N 3.07Å
161	T	98.3	Very high	97.7	Very high	25 Å²	25	45.1 Å²	45.1	15%	0.153	25%	0.25	C	S	.	.	H	α-helix	trans	-69.8	-40.4	179.7	-49.6	0	0	0	0	111.1	V122 L157 A158 S159 A164 E165	V122-T161 HydrophobicContact CG2-CG2 3.73Å; L157-T161 WeakPolarHBondContact O-CB 3.46Å; L157-T161 PolarHBondContact O-N 2.97Å; L157-T161 VanDerWaalsContact O-N 3.15Å; L157-T161 PolarHBondContact O-OG1 3.28Å; A158-T161 PolarHBondContact O-N 3.45Å; S159-T161 VanDerWaalsContact C-N 3.29Å; S159-T161 PolarHBondContact O-N 3.12Å; T161-A164 PolarHBondContact O-N 3.46Å; T161-E165 WeakPolarHBondContact O-CB 3.41Å; T161-E165 PolarHBondContact O-N 2.86Å
162	A	98.4	Very high	97.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-39.2	178.5	0	0	0	0	0	112.4	V122 A158 S159 A164 L166 R173 L176	V122-A162 HydrophobicContact CG1-CB 3.86Å; V122-A162 HydrophobicContact CG2-CB 3.88Å; A158-A162 WeakPolarHBondContact O-CB 3.42Å; A158-A162 PolarHBondContact O-N 3.25Å; S159-A162 PolarHBondContact O-N 3.33Å; S159-A162 VanDerWaalsContact O-N 3.16Å; A162-A164 VanDerWaalsContact C-N 3.29Å; A162-A164 PolarHBondContact O-N 3.46Å; A162-L166 HydrophobicContact CB-CD1 4.14Å; A162-L166 WeakPolarHBondContact O-CA 3.47Å; A162-L166 WeakPolarHBondContact O-CB 3.41Å; A162-L166 PolarHBondContact O-N 3.05Å; A162-R173 HydrophobicContact CB-CB 4.26Å; A162-R173 HydrophobicContact CB-CG 4.04Å; A162-L176 HydrophobicContact CB-CD2 4.06Å
163	E	97.6	Very high	97.6	Very high	121 Å²	121	46.9 Å²	46.9	57%	0.565	26%	0.256	S	S	*	.	H	α-helix	trans	-63.3	-36	175.7	-75.1	168.1	-161.7	0	0	112.2	S159	S159-E163 WeakPolarHBondContact O-CB 3.3Å; S159-E163 WeakPolarHBondContact O-CG 3.33Å; S159-E163 PolarHBondContact O-N 3.37Å
164	A	97.1	Very high	97.6	Very high	84 Å²	84	40.8 Å²	40.8	69%	0.694	23%	0.23	S	C	*	.	H	α-helix	trans	-79.8	-35.8	-179.4	0	0	0	0	0	113.6	T160 T161 A162	T160-A164 PolarHBondContact O-N 3.07Å; T161-A164 PolarHBondContact O-N 3.46Å; A162-A164 VanDerWaalsContact C-N 3.29Å; A162-A164 PolarHBondContact O-N 3.46Å
165	E	97.2	Very high	97.6	Very high	119 Å²	119	40.9 Å²	40.9	56%	0.556	23%	0.232	S	C	*	.	H	α-helix	trans	-119.1	-15.1	-166.2	-63.7	-169.4	-133.7	0	0	114.9	G118 T161	G118-E165 VanDerWaalsContact CA-CD 3.49Å; G118-E165 WeakPolarHBondContact CA-OE2 3.42Å; G118-E165 PolarHBondContact N-OE2 3.26Å; T161-E165 WeakPolarHBondContact O-CB 3.41Å; T161-E165 PolarHBondContact O-N 2.86Å
166	L	96.2	Very high	97.6	Very high	17 Å²	17	41.1 Å²	41.1	9%	0.089	23%	0.233	C	C	.	.	S	Bend	trans	-119.5	136	-176.3	-54.1	-179.6	0	0	0	111.6	E119 V122 A162 H170 I172 R173	E119-L166 HydrophobicContact CB-CD2 4.03Å; E119-L166 HydrophobicContact CG-CD2 4.31Å; V122-L166 HydrophobicContact CB-CD1 4.08Å; V122-L166 HydrophobicContact CG1-CD1 4.02Å; V122-L166 HydrophobicContact CG2-CD1 4Å; A162-L166 HydrophobicContact CB-CD1 4.14Å; A162-L166 WeakPolarHBondContact O-CA 3.47Å; A162-L166 WeakPolarHBondContact O-CB 3.41Å; A162-L166 PolarHBondContact O-N 3.05Å; L166-H170 HydrophobicContact CB-CB 4.09Å; L166-I172 HydrophobicContact CD1-CB 4.42Å; L166-I172 HydrophobicContact CD1-CG2 4.38Å; L166-R173 HydrophobicContact CB-CB 4.28Å; L166-R173 HydrophobicContact CD1-CB 4.38Å; L166-R173 PolarHBondContact O-NH1 3.25Å
167	A	95.6	Very high	97.6	Very high	54 Å²	54	37 Å²	37	45%	0.446	22%	0.216	S	C	.	.			trans	-57.3	149.8	172.3	0	0	0	0	0	111.4	T169 H170 R173	A167-T169 PolarHBondContact O-N 3.35Å; A167-T169 VanDerWaalsContact O-N 3.13Å; A167-H170 WeakPolarHBondContact O-CB 3.42Å; A167-H170 PolarHBondContact O-N 3.49Å; A167-R173 WeakPolarHBondContact O-CD 3.28Å
168	S	96.7	Very high	97.6	Very high	8 Å²	8	34.4 Å²	34.4	6%	0.056	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.8	-179.7	71.1	0	0	0	0	112.7	E204 E208	S168-E204 PolarHBondContact OG-O 3.01Å; S168-E208 VanDerWaalsContact OG-CD 3.28Å; S168-E208 PolarHBondContact OG-OE2 2.94Å
169	T	96.1	Very high	97.6	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.043	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-2.7	179	55.9	0	0	0	0	114.1	A167 A205 E208 L212 S220	A167-T169 PolarHBondContact O-N 3.35Å; A167-T169 VanDerWaalsContact O-N 3.13Å; T169-A205 HydrophobicContact CG2-CB 4.24Å; T169-A205 WeakPolarHBondContact CG2-O 3.49Å; T169-E208 HydrophobicContact CG2-CB 3.72Å; T169-L212 HydrophobicContact CG2-CD1 4.34Å; T169-L212 HydrophobicContact CG2-CD2 4.45Å; T169-L212 HydrophobicContact CG2-CG 4.17Å; T169-L212 WeakPolarHBondContact OG1-CD2 3.15Å; T169-S220 WeakPolarHBondContact O-CB 3.26Å; T169-S220 PolarHBondContact O-OG 3.45Å
170	H	95.7	Very high	97.6	Very high	41 Å²	41	35.4 Å²	35.4	19%	0.19	21%	0.205	C	C	.	.			trans	-67	129.7	-176.6	-168.1	-87.1	0	0	0	111.4	E119 L166 A167 I172 R173 L174	E119-H170 IonicContact OE2-CE1 2.79Å; E119-H170 IonicContact OE2-NE2 2.63Å; E119-H170 PolarHBondContact OE2-NE2 2.86Å; L166-H170 HydrophobicContact CB-CB 4.09Å; A167-H170 WeakPolarHBondContact O-CB 3.42Å; A167-H170 PolarHBondContact O-N 3.49Å; H170-I172 VanDerWaalsContact C-N 3.27Å; H170-I172 PolarHBondContact ND1-N 2.99Å; H170-I172 PolarHBondContact O-N 2.99Å; H170-I172 VanDerWaalsContact O-N 3.13Å; H170-R173 HydrophobicContact CB-CB 4.29Å; H170-R173 PolarHBondContact O-N 2.89Å; H170-L174 PolarHBondContact O-N 3.3Å
171	P	96.3	Very high	97.6	Very high	23 Å²	23	31 Å²	31	15%	0.149	18%	0.178	C	C	.	.	H	α-helix	trans	-54.6	-38.1	-175.5	-27.1	32	0	0	0	114.4	G175 D219 S220 I223	P171-G175 PolarHBondContact O-N 3.31Å; P171-D219 HydrophobicContact CB-CB 4.19Å; P171-D219 HydrophobicContact CG-CB 4.09Å; P171-S220 WeakPolarHBondContact CD-OG 3.45Å; P171-S220 WeakPolarHBondContact CG-OG 3.36Å; P171-I223 HydrophobicContact CB-CD1 4.11Å; P171-I223 VanDerWaalsContact O-CD1 3.27Å; P171-I223 WeakPolarHBondContact O-CD1 3.43Å
172	I	97.4	Very high	97.6	Very high	25 Å²	25	30.7 Å²	30.7	13%	0.128	18%	0.176	C	C	.	.	H	α-helix	trans	-67.8	-39.4	178.5	-62.7	176.7	0	0	0	111.6	E119 V122 F123 L166 H170 G175 L176	E119-I172 HydrophobicContact CG-CD1 3.59Å; V122-I172 HydrophobicContact CB-CG2 4.24Å; V122-I172 HydrophobicContact CG1-CG2 3.66Å; F123-I172 HydrophobicContact CB-CD1 4.29Å; F123-I172 HydrophobicContact CB-CG2 4.42Å; F123-I172 HydrophobicContact CD2-CD1 3.86Å; F123-I172 HydrophobicContact CD2-CG1 4.24Å; L166-I172 HydrophobicContact CD1-CB 4.42Å; L166-I172 HydrophobicContact CD1-CG2 4.38Å; H170-I172 VanDerWaalsContact C-N 3.27Å; H170-I172 PolarHBondContact ND1-N 2.99Å; H170-I172 PolarHBondContact O-N 2.99Å; H170-I172 VanDerWaalsContact O-N 3.13Å; I172-G175 PolarHBondContact O-N 3.48Å; I172-L176 WeakPolarHBondContact O-CB 3.44Å; I172-L176 PolarHBondContact O-N 3.46Å
173	R	98	Very high	97.6	Very high	43 Å²	43	30.6 Å²	30.6	16%	0.162	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-44.8	178.3	178	173.2	169.7	172.5	-4.5	110.7	A162 L166 A167 H170 G175 L176 A177 E204	A162-R173 HydrophobicContact CB-CB 4.26Å; A162-R173 HydrophobicContact CB-CG 4.04Å; L166-R173 HydrophobicContact CB-CB 4.28Å; L166-R173 HydrophobicContact CD1-CB 4.38Å; L166-R173 PolarHBondContact O-NH1 3.25Å; A167-R173 WeakPolarHBondContact O-CD 3.28Å; H170-R173 HydrophobicContact CB-CB 4.29Å; H170-R173 PolarHBondContact O-N 2.89Å; R173-G175 PolarHBondContact O-N 3.39Å; R173-L176 WeakPolarHBondContact O-CB 3.4Å; R173-L176 PolarHBondContact O-N 2.78Å; R173-A177 PolarHBondContact O-N 3.45Å; R173-E204 IonicContact CZ-OE2 3.51Å; R173-E204 IonicContact NH2-OE2 3.06Å; R173-E204 PolarHBondContact NH2-OE2 2.72Å
174	L	98.4	Very high	97.7	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-60.1	-45.4	173.4	-73.9	171.7	0	0	0	111.9	H170 L176 A177 L178 A205 I223 M224 L227	H170-L174 PolarHBondContact O-N 3.3Å; L174-L176 VanDerWaalsContact C-N 3.29Å; L174-L176 PolarHBondContact O-N 2.86Å; L174-A177 PolarHBondContact O-N 3.01Å; L174-L178 PolarHBondContact O-N 3.43Å; L174-A205 HydrophobicContact CD1-CB 4.47Å; L174-A205 HydrophobicContact CD2-CB 3.69Å; L174-I223 HydrophobicContact CB-CB 4.18Å; L174-I223 HydrophobicContact CB-CD1 4.45Å; L174-I223 HydrophobicContact CB-CG2 3.65Å; L174-M224 HydrophobicContact CD1-CG 3.94Å; L174-M224 HydrophobicContact CD1-SD 4.38Å; L174-M224 HydrophobicContact CD2-CG 4.04Å; L174-L227 HydrophobicContact CD2-CD1 4.05Å
175	G	98.4	Very high	97.8	Very high	9 Å²	9	25.3 Å²	25.3	9%	0.093	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-32.9	178.3	0	0	0	0	0	112.8	K126 P171 I172 R173 N179	K126-G175 WeakPolarHBondContact CE-O 3.32Å; P171-G175 PolarHBondContact O-N 3.31Å; I172-G175 PolarHBondContact O-N 3.48Å; R173-G175 PolarHBondContact O-N 3.39Å; G175-N179 PolarHBondContact O-N 2.91Å; G175-N179 VanDerWaalsContact O-N 3.12Å
176	L	98.8	Very high	97.8	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-50.7	171.2	168	63.8	0	0	0	111	V122 K126 Y155 A158 A162 I172 R173 L174 L178 N179 F180	V122-L176 HydrophobicContact CG1-CD2 4.09Å; K126-L176 HydrophobicContact CB-CD1 4.04Å; K126-L176 HydrophobicContact CD-CB 4.07Å; K126-L176 HydrophobicContact CG-CB 4.25Å; K126-L176 HydrophobicContact CG-CD1 3.99Å; Y155-L176 HydrophobicContact CD1-CD1 3.6Å; Y155-L176 HydrophobicContact CE1-CD1 4.31Å; A158-L176 VanDerWaalsContact C-CD2 3.44Å; A158-L176 HydrophobicContact CB-CD1 3.74Å; A158-L176 HydrophobicContact CB-CD2 3.63Å; A158-L176 HydrophobicContact CB-CG 4.35Å; A162-L176 HydrophobicContact CB-CD2 4.06Å; I172-L176 WeakPolarHBondContact O-CB 3.44Å; I172-L176 PolarHBondContact O-N 3.46Å; R173-L176 WeakPolarHBondContact O-CB 3.4Å; R173-L176 PolarHBondContact O-N 2.78Å; L174-L176 VanDerWaalsContact C-N 3.29Å; L174-L176 PolarHBondContact O-N 2.86Å; L176-L178 VanDerWaalsContact C-N 3.29Å; L176-L178 PolarHBondContact O-N 3.29Å; L176-N179 PolarHBondContact O-N 2.91Å; L176-F180 VanDerWaalsContact O-CB 3.26Å; L176-F180 WeakPolarHBondContact O-CB 3.4Å; L176-F180 PolarHBondContact O-N 3.39Å
177	A	98.8	Very high	97.9	Very high	10 Å²	10	24.1 Å²	24.1	8%	0.083	13%	0.128	C	C	.	.	H	α-helix	trans	-57.6	-43.4	178.2	0	0	0	0	0	111.7	R173 L174 N179 F180 S181 A201	R173-A177 PolarHBondContact O-N 3.45Å; L174-A177 PolarHBondContact O-N 3.01Å; A177-N179 PolarHBondContact O-N 3.25Å; A177-F180 PolarHBondContact O-N 3.26Å; A177-S181 WeakPolarHBondContact O-CB 3.18Å; A177-S181 PolarHBondContact O-N 3.19Å; A177-S181 PolarHBondContact O-OG 3.01Å; A177-A201 HydrophobicContact CB-CB 3.39Å
178	L	98.7	Very high	98	Very high	20 Å²	20	24.3 Å²	24.3	11%	0.105	12%	0.121	C	C	.	.	H	α-helix	trans	-57.5	-49.5	176	177	65.7	0	0	0	112.2	L174 L176 S181 V182 I223 L226 L227 N230	L174-L178 PolarHBondContact O-N 3.43Å; L176-L178 VanDerWaalsContact C-N 3.29Å; L176-L178 PolarHBondContact O-N 3.29Å; L178-S181 PolarHBondContact O-OG 3.04Å; L178-V182 VanDerWaalsContact O-CG2 3.28Å; L178-V182 WeakPolarHBondContact O-CG2 3.37Å; L178-V182 PolarHBondContact O-N 3.18Å; L178-I223 HydrophobicContact CB-CG2 4.32Å; L178-I223 HydrophobicContact CD2-CG2 4.18Å; L178-L226 HydrophobicContact CD1-CB 4.06Å; L178-L226 HydrophobicContact CD2-CB 3.94Å; L178-L226 HydrophobicContact CD2-CD1 3.89Å; L178-L227 HydrophobicContact CB-CD2 3.89Å; L178-L227 HydrophobicContact CB-CG 4.22Å; L178-L227 HydrophobicContact CD1-CD2 3.98Å; L178-L227 HydrophobicContact CD1-CG 4.18Å; L178-N230 WeakPolarHBondContact CD1-ND2 3.42Å
179	N	98.6	Very high	98	Very high	30 Å²	30	30.5 Å²	30.5	16%	0.16	15%	0.153	C	C	.	.	H	α-helix	trans	-75	-33.5	-176.2	-75.6	10.3	0	0	0	112.3	K126 D130 Y155 G175 L176 A177 V182 F183	K126-N179 PolarHBondContact NZ-ND2 3.15Å; D130-N179 WeakPolarHBondContact OD1-CB 3.27Å; D130-N179 PolarHBondContact OD1-ND2 3.19Å; D130-N179 PolarHBondContact OD2-ND2 3.26Å; Y155-N179 HydrophobicContact CE1-CB 4.24Å; G175-N179 PolarHBondContact O-N 2.91Å; G175-N179 VanDerWaalsContact O-N 3.12Å; L176-N179 PolarHBondContact O-N 2.91Å; A177-N179 PolarHBondContact O-N 3.25Å; N179-V182 PolarHBondContact O-N 3.4Å; N179-F183 PolarHBondContact O-N 2.89Å
180	F	98.8	Very high	98	Very high	9 Å²	9	31.4 Å²	31.4	4%	0.039	16%	0.16	C	C	.	.	H	α-helix	trans	-72.4	-34.4	177.4	-167.6	-168.2	0	0	0	111.6	M152 Y155 Q156 L176 A177 F183 Y184 L197	M152-F180 HydrophobicContact SD-CE2 3.72Å; M152-F180 HydrophobicContact SD-CZ 3.66Å; Y155-F180 VanDerWaalsContact CB-CD2 3.45Å; Y155-F180 HydrophobicContact CD1-CB 4.02Å; Y155-F180 HydrophobicContact CD1-CD2 4.42Å; Y155-F180 HydrophobicContact CD1-CG 4.25Å; Y155-F180 HydrophobicContact CD2-CB 4.44Å; Y155-F180 AromaticContact CD2-CD2 3.49Å; Y155-F180 HydrophobicContact CD2-CD2 3.49Å; Y155-F180 VanDerWaalsContact CD2-CD2 3.49Å; Y155-F180 AromaticContact CD2-CE2 3.93Å; Y155-F180 HydrophobicContact CD2-CE2 3.93Å; Y155-F180 HydrophobicContact CD2-CG 4.14Å; Y155-F180 HydrophobicContact CE1-CB 4.44Å; Y155-F180 HydrophobicContact CE2-CD2 4.31Å; Y155-F180 HydrophobicContact CG-CB 4.01Å; Y155-F180 HydrophobicContact CG-CD1 4.37Å; Y155-F180 AromaticContact CG-CD2 3.56Å; Y155-F180 HydrophobicContact CG-CD2 3.56Å; Y155-F180 HydrophobicContact CG-CE2 4.05Å; Y155-F180 AromaticContact CG-CG 3.76Å; Y155-F180 HydrophobicContact CG-CG 3.76Å; Q156-F180 HydrophobicContact CG-CE1 4.47Å; Q156-F180 HydrophobicContact CG-CZ 4.04Å; L176-F180 VanDerWaalsContact O-CB 3.26Å; L176-F180 WeakPolarHBondContact O-CB 3.4Å; L176-F180 PolarHBondContact O-N 3.39Å; A177-F180 PolarHBondContact O-N 3.26Å; F180-F183 HydrophobicContact CD2-CB 4.29Å; F180-F183 AromaticContact CD2-CD1 3.79Å; F180-F183 HydrophobicContact CD2-CD1 3.79Å; F180-F183 HydrophobicContact CD2-CG 4.46Å; F180-F183 AromaticContact CE2-CD1 3.72Å; F180-F183 HydrophobicContact CE2-CD1 3.72Å; F180-F183 HydrophobicContact CE2-CE1 4.18Å; F180-F183 WeakPolarHBondContact O-CB 3.47Å; F180-F183 PolarHBondContact O-N 3.36Å; F180-Y184 HydrophobicContact CD1-CE2 4.29Å; F180-Y184 AromaticContact CD2-CD2 3.94Å; F180-Y184 HydrophobicContact CD2-CD2 3.94Å; F180-Y184 AromaticContact CD2-CE2 3.67Å; F180-Y184 HydrophobicContact CD2-CE2 3.67Å; F180-Y184 HydrophobicContact CE1-CE2 4.01Å; F180-Y184 AromaticContact CE2-CD2 4Å; F180-Y184 HydrophobicContact CE2-CD2 4Å; F180-Y184 AromaticContact CE2-CE2 3.33Å; F180-Y184 HydrophobicContact CE2-CE2 3.33Å; F180-Y184 AromaticContact CE2-CZ 3.7Å; F180-Y184 HydrophobicContact CG-CD2 4.45Å; F180-Y184 HydrophobicContact CG-CE2 4.14Å; F180-Y184 AromaticContact CZ-CE2 3.52Å; F180-Y184 HydrophobicContact CZ-CE2 3.52Å; F180-Y184 AromaticContact CZ-CZ 3.75Å; F180-Y184 WeakPolarHBondContact CZ-OH 3.18Å; F180-Y184 VanDerWaalsContact O-CD2 3.28Å; F180-Y184 WeakPolarHBondContact O-CD2 3.49Å; F180-Y184 PolarHBondContact O-N 2.96Å; F180-L197 HydrophobicContact CB-CD2 3.78Å; F180-L197 HydrophobicContact CD1-CD2 3.61Å; F180-L197 HydrophobicContact CE1-CD2 4.39Å; F180-L197 HydrophobicContact CG-CD2 3.7Å
181	S	98.7	Very high	98.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.5	-40.7	172	71.8	0	0	0	0	111.5	A177 L178 F183 Y184 Y185 A194 W234	A177-S181 WeakPolarHBondContact O-CB 3.18Å; A177-S181 PolarHBondContact O-N 3.19Å; A177-S181 PolarHBondContact O-OG 3.01Å; L178-S181 PolarHBondContact O-OG 3.04Å; S181-F183 VanDerWaalsContact C-N 3.29Å; S181-F183 PolarHBondContact O-N 2.91Å; S181-Y184 PolarHBondContact O-N 3.49Å; S181-Y185 PolarHBondContact O-N 3.33Å; S181-A194 WeakPolarHBondContact CB-O 3.48Å; S181-A194 VanDerWaalsContact O-CB 3.25Å; S181-A194 WeakPolarHBondContact O-CB 3.45Å; S181-W234 WeakPolarHBondContact OG-CZ3 3.46Å
182	V	98.5	Very high	98.1	Very high	18 Å²	18	33.9 Å²	33.9	11%	0.109	17%	0.171	C	C	.	.	H	α-helix	trans	-59.5	-40	172.4	173.6	0	0	0	0	111.1	L178 N179 Y185 E186 W234	L178-V182 VanDerWaalsContact O-CG2 3.28Å; L178-V182 WeakPolarHBondContact O-CG2 3.37Å; L178-V182 PolarHBondContact O-N 3.18Å; N179-V182 PolarHBondContact O-N 3.4Å; V182-Y185 PolarHBondContact O-N 3.18Å; V182-E186 VanDerWaalsContact CG1-CD 3.41Å; V182-E186 HydrophobicContact CG1-CG 3.9Å; V182-E186 VanDerWaalsContact CG1-OE2 3.28Å; V182-E186 WeakPolarHBondContact CG1-OE2 3.33Å; V182-E186 WeakPolarHBondContact O-CB 3.18Å; V182-E186 PolarHBondContact O-N 3.47Å; V182-W234 HydrophobicContact CB-CH2 4.37Å; V182-W234 HydrophobicContact CG2-CH2 3.71Å; V182-W234 HydrophobicContact CG2-CZ2 3.92Å
183	F	98.8	Very high	98.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-47.9	174	171.4	-107.3	0	0	0	112.7	R133 A148 S151 M152 Y155 N179 F180 S181 Y185 I187 L188	R133-F183 HydrophobicContact CB-CD2 4.18Å; R133-F183 HydrophobicContact CG-CD2 4.24Å; A148-F183 HydrophobicContact CB-CE2 4.42Å; A148-F183 HydrophobicContact CB-CZ 4.47Å; A148-F183 WeakPolarHBondContact O-CZ 3.43Å; S151-F183 WeakPolarHBondContact OG-CD2 3.41Å; S151-F183 WeakPolarHBondContact OG-CE2 3.48Å; M152-F183 HydrophobicContact CB-CE1 4Å; M152-F183 HydrophobicContact CB-CZ 4.09Å; M152-F183 HydrophobicContact CE-CE1 3.71Å; M152-F183 HydrophobicContact SD-CE1 4.14Å; Y155-F183 HydrophobicContact CD2-CB 4.2Å; Y155-F183 HydrophobicContact CD2-CD1 4.16Å; Y155-F183 HydrophobicContact CD2-CG 4.11Å; Y155-F183 HydrophobicContact CE2-CB 3.68Å; Y155-F183 HydrophobicContact CE2-CD1 4.37Å; Y155-F183 HydrophobicContact CE2-CD2 4.28Å; Y155-F183 AromaticContact CE2-CG 3.86Å; Y155-F183 HydrophobicContact CE2-CG 3.86Å; N179-F183 PolarHBondContact O-N 2.89Å; F180-F183 HydrophobicContact CD2-CB 4.29Å; F180-F183 AromaticContact CD2-CD1 3.79Å; F180-F183 HydrophobicContact CD2-CD1 3.79Å; F180-F183 HydrophobicContact CD2-CG 4.46Å; F180-F183 AromaticContact CE2-CD1 3.72Å; F180-F183 HydrophobicContact CE2-CD1 3.72Å; F180-F183 HydrophobicContact CE2-CE1 4.18Å; F180-F183 WeakPolarHBondContact O-CB 3.47Å; F180-F183 PolarHBondContact O-N 3.36Å; S181-F183 VanDerWaalsContact C-N 3.29Å; S181-F183 PolarHBondContact O-N 2.91Å; F183-Y185 VanDerWaalsContact C-N 3.27Å; F183-Y185 PolarHBondContact O-N 3.35Å; F183-I187 HydrophobicContact CD2-CB 3.73Å; F183-I187 HydrophobicContact CD2-CG1 3.73Å; F183-I187 HydrophobicContact CD2-CG2 4.19Å; F183-I187 HydrophobicContact CE2-CB 3.77Å; F183-I187 HydrophobicContact CE2-CG1 4.13Å; F183-I187 HydrophobicContact CE2-CG2 3.72Å; F183-I187 WeakPolarHBondContact O-CB 3.32Å; F183-I187 PolarHBondContact O-N 3.42Å; F183-L188 HydrophobicContact CD1-CD1 4.1Å; F183-L188 HydrophobicContact CD1-CG 4.39Å; F183-L188 HydrophobicContact CE1-CD1 3.41Å; F183-L188 VanDerWaalsContact CE1-CD1 3.41Å; F183-L188 HydrophobicContact CE1-CD2 4.42Å; F183-L188 HydrophobicContact CE1-CG 3.8Å; F183-L188 HydrophobicContact CE2-CG 4.44Å; F183-L188 HydrophobicContact CZ-CD1 3.85Å; F183-L188 HydrophobicContact CZ-CD2 4Å; F183-L188 HydrophobicContact CZ-CG 3.81Å; F183-L188 PolarHBondContact O-N 3.08Å
184	Y	98.6	Very high	98.1	Very high	30 Å²	30	37.9 Å²	37.9	12%	0.118	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-41.3	177	-83.2	-66.1	0	0	0	111.9	M152 F180 S181 L188 N189 S190 R193 L197	M152-Y184 HydrophobicContact CE-CE1 3.62Å; F180-Y184 HydrophobicContact CD1-CE2 4.29Å; F180-Y184 AromaticContact CD2-CD2 3.94Å; F180-Y184 HydrophobicContact CD2-CD2 3.94Å; F180-Y184 AromaticContact CD2-CE2 3.67Å; F180-Y184 HydrophobicContact CD2-CE2 3.67Å; F180-Y184 HydrophobicContact CE1-CE2 4.01Å; F180-Y184 AromaticContact CE2-CD2 4Å; F180-Y184 HydrophobicContact CE2-CD2 4Å; F180-Y184 AromaticContact CE2-CE2 3.33Å; F180-Y184 HydrophobicContact CE2-CE2 3.33Å; F180-Y184 AromaticContact CE2-CZ 3.7Å; F180-Y184 HydrophobicContact CG-CD2 4.45Å; F180-Y184 HydrophobicContact CG-CE2 4.14Å; F180-Y184 AromaticContact CZ-CE2 3.52Å; F180-Y184 HydrophobicContact CZ-CE2 3.52Å; F180-Y184 AromaticContact CZ-CZ 3.75Å; F180-Y184 WeakPolarHBondContact CZ-OH 3.18Å; F180-Y184 VanDerWaalsContact O-CD2 3.28Å; F180-Y184 WeakPolarHBondContact O-CD2 3.49Å; F180-Y184 PolarHBondContact O-N 2.96Å; S181-Y184 PolarHBondContact O-N 3.49Å; Y184-L188 HydrophobicContact CD1-CD1 3.68Å; Y184-L188 HydrophobicContact CE1-CD1 3.84Å; Y184-L188 CarbonylContact O-C 3.46Å; Y184-N189 PolarHBondContact O-N 3.4Å; Y184-S190 PolarHBondContact O-N 3.22Å; Y184-R193 HydrophobicContact CD1-CB 3.84Å; Y184-R193 HydrophobicContact CE1-CB 4.28Å; Y184-R193 HydrophobicContact CG-CB 4.07Å; Y184-L197 HydrophobicContact CD2-CD2 4.03Å; Y184-L197 HydrophobicContact CE2-CD2 3.99Å
185	Y	98.4	Very high	98.1	Very high	63 Å²	63	38.4 Å²	38.4	25%	0.247	19%	0.188	C	C	.	.	H	α-helix	trans	-71	-61.7	179.5	-176	-97.1	0	0	0	111.7	S181 V182 F183 N189 P191 W234 D237	S181-Y185 PolarHBondContact O-N 3.33Å; V182-Y185 PolarHBondContact O-N 3.18Å; F183-Y185 VanDerWaalsContact C-N 3.27Å; F183-Y185 PolarHBondContact O-N 3.35Å; Y185-N189 VanDerWaalsContact O-CA 3.32Å; Y185-N189 WeakPolarHBondContact O-CA 3.27Å; Y185-N189 PolarHBondContact O-N 2.98Å; Y185-P191 HydrophobicContact CD2-CB 3.98Å; Y185-P191 HydrophobicContact CE2-CB 4.16Å; Y185-W234 AromaticContact CD1-CD1 3.9Å; Y185-W234 AromaticContact CD1-CE2 3.83Å; Y185-W234 HydrophobicContact CD1-CZ2 4.27Å; Y185-W234 AromaticContact CD1-NE1 3.41Å; Y185-W234 HydrophobicContact CD2-CB 3.99Å; Y185-W234 AromaticContact CD2-CD1 3.47Å; Y185-W234 VanDerWaalsContact CD2-CD1 3.47Å; Y185-W234 AromaticContact CD2-CD2 3.84Å; Y185-W234 HydrophobicContact CD2-CD2 3.84Å; Y185-W234 AromaticContact CD2-CE2 4Å; Y185-W234 AromaticContact CD2-CG 3.51Å; Y185-W234 HydrophobicContact CD2-CG 3.51Å; Y185-W234 AromaticContact CD2-NE1 3.76Å; Y185-W234 AromaticContact CE1-CD1 3.64Å; Y185-W234 AromaticContact CE1-NE1 3.42Å; Y185-W234 HydrophobicContact CE2-CB 3.89Å; Y185-W234 AromaticContact CE2-CD1 3.19Å; Y185-W234 HydrophobicContact CE2-CD2 4.32Å; Y185-W234 AromaticContact CE2-CG 3.55Å; Y185-W234 HydrophobicContact CE2-CG 3.55Å; Y185-W234 AromaticContact CE2-NE1 3.78Å; Y185-W234 AromaticContact CG-CD1 3.83Å; Y185-W234 AromaticContact CG-CD2 3.95Å; Y185-W234 HydrophobicContact CG-CD2 3.95Å; Y185-W234 AromaticContact CG-CE2 3.67Å; Y185-W234 HydrophobicContact CG-CG 4.04Å; Y185-W234 HydrophobicContact CG-CZ2 4.19Å; Y185-W234 AromaticContact CG-NE1 3.59Å; Y185-W234 AromaticContact CZ-CD1 3.27Å; Y185-W234 AromaticContact CZ-NE1 3.6Å; Y185-D237 WeakPolarHBondContact CE2-OD2 3.36Å; Y185-D237 PolarHBondContact OH-OD2 3.35Å
186	E	97.3	Very high	98.1	Very high	100 Å²	100	44 Å²	44	47%	0.467	21%	0.212	S	C	.	.	H	α-helix	trans	-76.1	-34.7	-168.9	-63.5	-175.5	158.6	0	0	113.8	R133 V182	R133-E186 IonicContact NH1-OE2 2.61Å; V182-E186 VanDerWaalsContact CG1-CD 3.41Å; V182-E186 HydrophobicContact CG1-CG 3.9Å; V182-E186 VanDerWaalsContact CG1-OE2 3.28Å; V182-E186 WeakPolarHBondContact CG1-OE2 3.33Å; V182-E186 WeakPolarHBondContact O-CB 3.18Å; V182-E186 PolarHBondContact O-N 3.47Å
187	I	98.5	Very high	98.1	Very high	12 Å²	12	45.6 Å²	45.6	6%	0.062	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-45.3	-173	-54.1	-53.7	0	0	0	111.8	R133 A136 E137 R144 A148 F183	R133-I187 HydrophobicContact CG-CD1 4.2Å; R133-I187 HydrophobicContact CG-CG1 3.77Å; A136-I187 HydrophobicContact CB-CD1 4.15Å; A136-I187 HydrophobicContact CB-CG1 4.43Å; A136-I187 HydrophobicContact CB-CG2 3.78Å; E137-I187 HydrophobicContact CG-CD1 4.06Å; R144-I187 PolarHBondContact NH2-O 3.17Å; A148-I187 HydrophobicContact CB-CG2 3.95Å; F183-I187 HydrophobicContact CD2-CB 3.73Å; F183-I187 HydrophobicContact CD2-CG1 3.73Å; F183-I187 HydrophobicContact CD2-CG2 4.19Å; F183-I187 HydrophobicContact CE2-CB 3.77Å; F183-I187 HydrophobicContact CE2-CG1 4.13Å; F183-I187 HydrophobicContact CE2-CG2 3.72Å; F183-I187 WeakPolarHBondContact O-CB 3.32Å; F183-I187 PolarHBondContact O-N 3.42Å
188	L	98	Very high	98	Very high	58 Å²	58	45.1 Å²	45.1	30%	0.304	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-3.4	-177.8	-59.6	-175.4	0	0	0	113.6	M152 F183 Y184 S190	M152-L188 HydrophobicContact CE-CD1 3.32Å; F183-L188 HydrophobicContact CD1-CD1 4.1Å; F183-L188 HydrophobicContact CD1-CG 4.39Å; F183-L188 HydrophobicContact CE1-CD1 3.41Å; F183-L188 VanDerWaalsContact CE1-CD1 3.41Å; F183-L188 HydrophobicContact CE1-CD2 4.42Å; F183-L188 HydrophobicContact CE1-CG 3.8Å; F183-L188 HydrophobicContact CE2-CG 4.44Å; F183-L188 HydrophobicContact CZ-CD1 3.85Å; F183-L188 HydrophobicContact CZ-CD2 4Å; F183-L188 HydrophobicContact CZ-CG 3.81Å; F183-L188 PolarHBondContact O-N 3.08Å; Y184-L188 HydrophobicContact CD1-CD1 3.68Å; Y184-L188 HydrophobicContact CE1-CD1 3.84Å; Y184-L188 CarbonylContact O-C 3.46Å; L188-S190 PolarHBondContact O-N 2.84Å; L188-S190 PolarHBondContact O-OG 3.19Å
189	N	96.9	Very high	98	Very high	137 Å²	137	50 Å²	50	73%	0.733	24%	0.236	S	C	*	.			trans	48.8	44.9	179.8	-166.3	67.7	0	0	0	111.7	Y184 Y185 P191	Y184-N189 PolarHBondContact O-N 3.4Å; Y185-N189 VanDerWaalsContact O-CA 3.32Å; Y185-N189 WeakPolarHBondContact O-CA 3.27Å; Y185-N189 PolarHBondContact O-N 2.98Å; N189-P191 VanDerWaalsContact C-CD 3.49Å; N189-P191 WeakPolarHBondContact O-CD 3.31Å
190	S	97.4	Very high	98	Very high	27 Å²	27	52.2 Å²	52.2	19%	0.189	25%	0.246	C	C	.	.			trans	-123	70.7	-174.8	-62.5	0	0	0	0	109.9	Y184 L188 E192 R193 A194	Y184-S190 PolarHBondContact O-N 3.22Å; L188-S190 PolarHBondContact O-N 2.84Å; L188-S190 PolarHBondContact O-OG 3.19Å; S190-E192 VanDerWaalsContact C-N 3.25Å; S190-E192 PolarHBondContact O-N 3.22Å; S190-R193 PolarHBondContact O-N 2.92Å; S190-A194 PolarHBondContact O-N 3.17Å
191	P	96.8	Very high	97.9	Very high	17 Å²	17	52.4 Å²	52.4	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-32.7	-175.2	24.5	-33.1	0	0	0	113	Y185 N189 R193 A194 C195 I238	Y185-P191 HydrophobicContact CD2-CB 3.98Å; Y185-P191 HydrophobicContact CE2-CB 4.16Å; N189-P191 VanDerWaalsContact C-CD 3.49Å; N189-P191 WeakPolarHBondContact O-CD 3.31Å; P191-R193 PolarHBondContact O-N 2.87Å; P191-A194 PolarHBondContact O-N 3.45Å; P191-C195 WeakPolarHBondContact O-CB 3.29Å; P191-C195 PolarHBondContact O-N 3.41Å; P191-C195 PolarHBondContact O-SG 3.48Å; P191-I238 HydrophobicContact CB-CG1 4.22Å
192	E	96.8	Very high	97.9	Very high	98 Å²	98	54.4 Å²	54.4	46%	0.458	26%	0.258	S	S	.	.	H	α-helix	trans	-64.3	-43.9	178	-55.5	74.1	-161	0	0	110.9	S190 H196 I238	S190-E192 VanDerWaalsContact C-N 3.25Å; S190-E192 PolarHBondContact O-N 3.22Å; E192-H196 VanDerWaalsContact O-CB 3.28Å; E192-H196 WeakPolarHBondContact O-CB 3.5Å; E192-H196 PolarHBondContact O-N 2.88Å; E192-I238 HydrophobicContact CG-CD1 4.47Å; E192-I238 HydrophobicContact CG-CG1 4.44Å; E192-I238 HydrophobicContact CG-CG2 4.24Å
193	R	97.5	Very high	97.8	Very high	152 Å²	152	57.3 Å²	57.3	57%	0.574	27%	0.273	S	S	*	.	H	α-helix	trans	-68.6	-40.1	176.7	-71	-174.2	174.5	178.1	-1.8	111.7	Y184 S190 P191 H196 L197	Y184-R193 HydrophobicContact CD1-CB 3.84Å; Y184-R193 HydrophobicContact CE1-CB 4.28Å; Y184-R193 HydrophobicContact CG-CB 4.07Å; S190-R193 PolarHBondContact O-N 2.92Å; P191-R193 PolarHBondContact O-N 2.87Å; R193-H196 PolarHBondContact O-N 2.85Å; R193-L197 WeakPolarHBondContact O-CB 3.3Å; R193-L197 PolarHBondContact O-N 3.2Å
194	A	98.1	Very high	97.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-48.3	175.7	0	0	0	0	0	111.2	S181 S190 P191 A198 W234	S181-A194 WeakPolarHBondContact CB-O 3.48Å; S181-A194 VanDerWaalsContact O-CB 3.25Å; S181-A194 WeakPolarHBondContact O-CB 3.45Å; S190-A194 PolarHBondContact O-N 3.17Å; P191-A194 PolarHBondContact O-N 3.45Å; A194-A198 WeakPolarHBondContact O-CB 3.49Å; A194-A198 PolarHBondContact O-N 2.96Å; A194-W234 HydrophobicContact CB-CE3 3.94Å; A194-W234 HydrophobicContact CB-CZ3 4.02Å
195	C	98	Very high	97.6	Very high	12 Å²	12	58.7 Å²	58.7	8%	0.081	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-42.2	178.4	-66.9	0	0	0	0	112	P191 L197 A198 K199 L231 W234 I238	P191-C195 WeakPolarHBondContact O-CB 3.29Å; P191-C195 PolarHBondContact O-N 3.41Å; P191-C195 PolarHBondContact O-SG 3.48Å; C195-L197 PolarHBondContact O-N 3.2Å; C195-A198 PolarHBondContact O-N 3.02Å; C195-K199 WeakPolarHBondContact O-CB 3.29Å; C195-K199 PolarHBondContact O-N 3.07Å; C195-L231 HydrophobicContact CB-CD2 4.01Å; C195-L231 VanDerWaalsContact O-CD2 3.29Å; C195-L231 WeakPolarHBondContact O-CD2 3.17Å; C195-W234 VanDerWaalsContact SG-CB 3.58Å; C195-I238 HydrophobicContact CB-CD1 4.2Å
196	H	97.8	Very high	97.5	Very high	127 Å²	127	59.7 Å²	59.7	59%	0.588	29%	0.289	S	S	*	.	H	α-helix	trans	-57.6	-49.9	177.1	-179.2	69.1	0	0	0	111.6	E192 R193 K199 Q200	E192-H196 VanDerWaalsContact O-CB 3.28Å; E192-H196 WeakPolarHBondContact O-CB 3.5Å; E192-H196 PolarHBondContact O-N 2.88Å; R193-H196 PolarHBondContact O-N 2.85Å; H196-K199 PolarHBondContact O-N 3.44Å; H196-Q200 WeakPolarHBondContact O-CB 3.32Å; H196-Q200 PolarHBondContact O-N 3.32Å
197	L	98.3	Very high	97.4	Very high	37 Å²	37	59.3 Å²	59.3	19%	0.194	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-47.4	179.7	179.9	62.6	0	0	0	112.2	F180 Y184 R193 C195 K199 Q200 A201	F180-L197 HydrophobicContact CB-CD2 3.78Å; F180-L197 HydrophobicContact CD1-CD2 3.61Å; F180-L197 HydrophobicContact CE1-CD2 4.39Å; F180-L197 HydrophobicContact CG-CD2 3.7Å; Y184-L197 HydrophobicContact CD2-CD2 4.03Å; Y184-L197 HydrophobicContact CE2-CD2 3.99Å; R193-L197 WeakPolarHBondContact O-CB 3.3Å; R193-L197 PolarHBondContact O-N 3.2Å; C195-L197 PolarHBondContact O-N 3.2Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 2.87Å; L197-Q200 PolarHBondContact O-N 2.84Å; L197-A201 PolarHBondContact O-N 3.26Å
198	A	98.1	Very high	97.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-39.5	-179.6	0	0	0	0	0	111.9	A194 C195 F202 L227 L231	A194-A198 WeakPolarHBondContact O-CB 3.49Å; A194-A198 PolarHBondContact O-N 2.96Å; C195-A198 PolarHBondContact O-N 3.02Å; A198-F202 WeakPolarHBondContact O-CB 3.5Å; A198-F202 PolarHBondContact O-N 3.42Å; A198-L227 HydrophobicContact CB-CD2 3.84Å; A198-L231 HydrophobicContact CB-CD1 4.4Å; A198-L231 HydrophobicContact CB-CD2 3.8Å; A198-L231 HydrophobicContact CB-CG 3.91Å
199	K	97.8	Very high	96.8	Very high	122 Å²	122	61 Å²	61	53%	0.53	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-46.8	177.6	-177	175.1	-179.8	-179	0	111.5	C195 H196 L197 A201 F202 D203 L231	C195-K199 WeakPolarHBondContact O-CB 3.29Å; C195-K199 PolarHBondContact O-N 3.07Å; H196-K199 PolarHBondContact O-N 3.44Å; L197-K199 VanDerWaalsContact C-N 3.33Å; L197-K199 PolarHBondContact O-N 2.87Å; K199-A201 VanDerWaalsContact C-N 3.34Å; K199-A201 PolarHBondContact O-N 2.84Å; K199-F202 PolarHBondContact O-N 3.46Å; K199-D203 WeakPolarHBondContact CE-OD2 3.36Å; K199-D203 WeakPolarHBondContact CG-OD2 3.48Å; K199-D203 WeakPolarHBondContact O-CB 3.42Å; K199-D203 VanDerWaalsContact O-CG 3.29Å; K199-D203 PolarHBondContact O-N 3.5Å; K199-L231 HydrophobicContact CB-CD1 4.15Å; K199-L231 HydrophobicContact CB-CD2 3.96Å
200	Q	98.2	Very high	96.4	Very high	77 Å²	77	62.7 Å²	62.7	36%	0.36	31%	0.313	S	S	.	.	H	α-helix	trans	-56.6	-49.2	177.2	-178.8	-175.6	-20.4	0	0	111.1	H196 L197 F202 D203 E204	H196-Q200 WeakPolarHBondContact O-CB 3.32Å; H196-Q200 PolarHBondContact O-N 3.32Å; L197-Q200 PolarHBondContact O-N 2.84Å; Q200-F202 VanDerWaalsContact C-N 3.32Å; Q200-F202 PolarHBondContact O-N 3.48Å; Q200-D203 PolarHBondContact O-N 3.23Å; Q200-E204 HydrophobicContact CG-CG 4.41Å; Q200-E204 VanDerWaalsContact CG-OE1 3.29Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.44Å; Q200-E204 PolarHBondContact NE2-OE1 3.21Å; Q200-E204 WeakPolarHBondContact O-CB 3.49Å; Q200-E204 WeakPolarHBondContact O-CG 3.29Å; Q200-E204 PolarHBondContact O-N 2.94Å
201	A	98.1	Very high	96	Very high	13 Å²	13	66.5 Å²	66.5	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-63	-38.2	179.2	0	0	0	0	0	112.8	A177 L197 K199 A205 L227	A177-A201 HydrophobicContact CB-CB 3.39Å; L197-A201 PolarHBondContact O-N 3.26Å; K199-A201 VanDerWaalsContact C-N 3.34Å; K199-A201 PolarHBondContact O-N 2.84Å; A201-A205 WeakPolarHBondContact O-CB 3.49Å; A201-A205 PolarHBondContact O-N 3.13Å; A201-A205 VanDerWaalsContact O-N 3.13Å; A201-L227 HydrophobicContact CB-CD1 4.37Å
202	F	97.6	Very high	95.5	Very high	42 Å²	42	67.2 Å²	67.2	18%	0.184	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-46.4	175.7	-174.2	-86.3	0	0	0	111.8	A198 K199 Q200 A205 I206 M224 L227 R228	A198-F202 WeakPolarHBondContact O-CB 3.5Å; A198-F202 PolarHBondContact O-N 3.42Å; K199-F202 PolarHBondContact O-N 3.46Å; Q200-F202 VanDerWaalsContact C-N 3.32Å; Q200-F202 PolarHBondContact O-N 3.48Å; F202-A205 PolarHBondContact O-N 3.04Å; F202-I206 HydrophobicContact CE1-CB 4.48Å; F202-I206 WeakPolarHBondContact O-CB 3.5Å; F202-I206 WeakPolarHBondContact O-CG2 3.45Å; F202-I206 PolarHBondContact O-N 3.45Å; F202-M224 HydrophobicContact CD2-CB 4.09Å; F202-M224 HydrophobicContact CD2-CE 4.41Å; F202-M224 WeakPolarHBondContact CD2-O 3.44Å; F202-M224 HydrophobicContact CE2-CB 4.03Å; F202-M224 HydrophobicContact CE2-CE 4.29Å; F202-M224 WeakPolarHBondContact CE2-O 3.39Å; F202-L227 HydrophobicContact CD2-CB 4.45Å; F202-R228 HydrophobicContact CD2-CB 4.35Å; F202-R228 HydrophobicContact CE2-CB 3.95Å
203	D	97.5	Very high	95.1	Very high	79 Å²	79	65.5 Å²	65.5	42%	0.422	34%	0.337	S	S	.	.	H	α-helix	trans	-69.3	-35.2	-177.8	-70.7	-14	0	0	0	112.2	K199 Q200 I206 S207	K199-D203 WeakPolarHBondContact CE-OD2 3.36Å; K199-D203 WeakPolarHBondContact CG-OD2 3.48Å; K199-D203 WeakPolarHBondContact O-CB 3.42Å; K199-D203 VanDerWaalsContact O-CG 3.29Å; K199-D203 PolarHBondContact O-N 3.5Å; Q200-D203 PolarHBondContact O-N 3.23Å; D203-I206 VanDerWaalsContact O-CG2 3.28Å; D203-I206 WeakPolarHBondContact O-CG2 3.39Å; D203-S207 PolarHBondContact O-N 2.99Å
204	E	96.7	Very high	94.5	Very high	60 Å²	60	67.3 Å²	67.3	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-51.4	172	-73.4	174.7	-170.7	0	0	110.6	S168 R173 Q200 I206 S207	S168-E204 PolarHBondContact OG-O 3.01Å; R173-E204 IonicContact CZ-OE2 3.51Å; R173-E204 IonicContact NH2-OE2 3.06Å; R173-E204 PolarHBondContact NH2-OE2 2.72Å; Q200-E204 HydrophobicContact CG-CG 4.41Å; Q200-E204 VanDerWaalsContact CG-OE1 3.29Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.44Å; Q200-E204 PolarHBondContact NE2-OE1 3.21Å; Q200-E204 WeakPolarHBondContact O-CB 3.49Å; Q200-E204 WeakPolarHBondContact O-CG 3.29Å; Q200-E204 PolarHBondContact O-N 2.94Å; E204-I206 PolarHBondContact O-N 2.75Å; E204-S207 PolarHBondContact O-N 3.07Å; E204-S207 PolarHBondContact O-OG 3.23Å
205	A	96.4	Very high	93.8	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-68.6	-34.9	-176.5	0	0	0	0	0	113.5	T169 L174 A201 F202 S207 E208 L209 M224	T169-A205 HydrophobicContact CG2-CB 4.24Å; T169-A205 WeakPolarHBondContact CG2-O 3.49Å; L174-A205 HydrophobicContact CD1-CB 4.47Å; L174-A205 HydrophobicContact CD2-CB 3.69Å; A201-A205 WeakPolarHBondContact O-CB 3.49Å; A201-A205 PolarHBondContact O-N 3.13Å; A201-A205 VanDerWaalsContact O-N 3.13Å; F202-A205 PolarHBondContact O-N 3.04Å; A205-S207 PolarHBondContact O-N 3.01Å; A205-E208 PolarHBondContact O-N 3.17Å; A205-L209 PolarHBondContact O-N 3.48Å; A205-M224 HydrophobicContact CB-CE 3.92Å; A205-M224 HydrophobicContact CB-CG 4.39Å; A205-M224 HydrophobicContact CB-SD 3.89Å
206	I	95.3	Very high	93.4	Very high	83 Å²	83	76.7 Å²	76.7	43%	0.426	40%	0.398	S	S	.	.	H	α-helix	trans	-64.6	-32.3	176.5	-163.7	67.1	0	0	0	111.4	F202 D203 E204 E208 L209 M224	F202-I206 HydrophobicContact CE1-CB 4.48Å; F202-I206 WeakPolarHBondContact O-CB 3.5Å; F202-I206 WeakPolarHBondContact O-CG2 3.45Å; F202-I206 PolarHBondContact O-N 3.45Å; D203-I206 VanDerWaalsContact O-CG2 3.28Å; D203-I206 WeakPolarHBondContact O-CG2 3.39Å; E204-I206 PolarHBondContact O-N 2.75Å; I206-E208 VanDerWaalsContact C-N 3.27Å; I206-E208 PolarHBondContact O-N 2.77Å; I206-L209 HydrophobicContact CD1-CD2 4.08Å; I206-M224 HydrophobicContact CB-CE 3.97Å; I206-M224 HydrophobicContact CD1-CE 3.96Å
207	S	94.6	Very high	93.1	Very high	92 Å²	92	76.2 Å²	76.2	64%	0.643	39%	0.392	S	S	*	.	H	α-helix	trans	-70.4	-22.6	179.8	77.5	0	0	0	0	113.7	D203 E204 A205	D203-S207 PolarHBondContact O-N 2.99Å; E204-S207 PolarHBondContact O-N 3.07Å; E204-S207 PolarHBondContact O-OG 3.23Å; A205-S207 PolarHBondContact O-N 3.01Å
208	E	93.4	Very high	92.8	Very high	84 Å²	84	82 Å²	82	39%	0.393	42%	0.415	S	S	.	.	H	α-helix	trans	-113.2	3.4	-178.4	-69.3	-179.7	-179.3	0	0	112.7	S168 T169 A205 I206 D210 T211	S168-E208 VanDerWaalsContact OG-CD 3.28Å; S168-E208 PolarHBondContact OG-OE2 2.94Å; T169-E208 HydrophobicContact CG2-CB 3.72Å; A205-E208 PolarHBondContact O-N 3.17Å; I206-E208 VanDerWaalsContact C-N 3.27Å; I206-E208 PolarHBondContact O-N 2.77Å; E208-D210 VanDerWaalsContact C-N 3.27Å; E208-D210 PolarHBondContact O-N 3.41Å; E208-T211 WeakPolarHBondContact O-CB 3.48Å; E208-T211 PolarHBondContact O-N 2.74Å; E208-T211 PolarHBondContact O-OG1 3.31Å
209	L	90.8	Very high	92.6	Very high	23 Å²	23	86 Å²	86	12%	0.12	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-59.1	-36.7	-170.6	-167.4	72.9	0	0	0	113	A205 I206 T211 L212 Y217 T221 M224	A205-L209 PolarHBondContact O-N 3.48Å; I206-L209 HydrophobicContact CD1-CD2 4.08Å; L209-T211 PolarHBondContact O-N 3.46Å; L209-T211 VanDerWaalsContact O-N 3.09Å; L209-L212 HydrophobicContact CD1-CD1 3.56Å; L209-L212 HydrophobicContact CG-CD1 4.46Å; L209-L212 WeakPolarHBondContact O-CB 3.35Å; L209-L212 PolarHBondContact O-N 2.87Å; L209-L212 VanDerWaalsContact O-N 3.17Å; L209-Y217 HydrophobicContact CD2-CE2 4.47Å; L209-Y217 HydrophobicContact CG-CE2 4.28Å; L209-T221 HydrophobicContact CD1-CG2 4.11Å; L209-T221 HydrophobicContact CD2-CG2 4.45Å; L209-M224 HydrophobicContact CD1-CE 4.25Å; L209-M224 HydrophobicContact CD1-SD 3.68Å
210	D	89.8	Confident	92.5	Very high	171 Å²	171	80.2 Å²	80.2	91%	0.914	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-65.1	-12.1	179.7	-67.8	-25.1	0	0	0	113.4	E208	E208-D210 VanDerWaalsContact C-N 3.27Å; E208-D210 PolarHBondContact O-N 3.41Å
211	T	88	Confident	92.4	Very high	107 Å²	107	78.6 Å²	78.6	66%	0.656	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-92.4	-6.2	179.4	72.3	0	0	0	0	113.6	E208 L209	E208-T211 WeakPolarHBondContact O-CB 3.48Å; E208-T211 PolarHBondContact O-N 2.74Å; E208-T211 PolarHBondContact O-OG1 3.31Å; L209-T211 PolarHBondContact O-N 3.46Å; L209-T211 VanDerWaalsContact O-N 3.09Å
212	L	87.3	Confident	92.3	Very high	32 Å²	32	82.9 Å²	82.9	17%	0.168	43%	0.428	C	S	.	.			trans	-68.7	144.5	-176.6	-82.8	176.6	0	0	0	113.1	T169 L209 Y217	T169-L212 HydrophobicContact CG2-CD1 4.34Å; T169-L212 HydrophobicContact CG2-CD2 4.45Å; T169-L212 HydrophobicContact CG2-CG 4.17Å; T169-L212 WeakPolarHBondContact OG1-CD2 3.15Å; L209-L212 HydrophobicContact CD1-CD1 3.56Å; L209-L212 HydrophobicContact CG-CD1 4.46Å; L209-L212 WeakPolarHBondContact O-CB 3.35Å; L209-L212 PolarHBondContact O-N 2.87Å; L209-L212 VanDerWaalsContact O-N 3.17Å; L212-Y217 HydrophobicContact CB-CD2 4.22Å; L212-Y217 HydrophobicContact CD1-CD2 4.34Å
213	S	86.9	Confident	92.3	Very high	63 Å²	63	82.2 Å²	82.2	44%	0.441	43%	0.426	S	S	.	.			trans	-71.1	154.6	166.1	67.4	0	0	0	0	111	E215 S216 Y217	S213-E215 PolarHBondContact O-N 2.85Å; S213-S216 PolarHBondContact O-N 3.01Å; S213-S216 PolarHBondContact OG-N 3.02Å; S213-Y217 WeakPolarHBondContact O-CB 3.27Å; S213-Y217 PolarHBondContact O-N 2.8Å
214	E	85.6	Confident	92.3	Very high	190 Å²	190	78.8 Å²	78.8	89%	0.888	41%	0.407	S	S	*	.	H	α-helix	trans	-56.8	-32.9	175.2	-69.2	-172.3	166	0	0	112.6
215	E	84.1	Confident	92.4	Very high	176 Å²	176	78.9 Å²	78.9	82%	0.822	41%	0.408	S	S	*	.	H	α-helix	trans	-65.6	-44	-179.1	-173.9	175	-170.8	0	0	112.3	S213	S213-E215 PolarHBondContact O-N 2.85Å
216	S	88.6	Confident	92.5	Very high	32 Å²	32	82.6 Å²	82.6	22%	0.224	43%	0.427	C	S	.	.	H	α-helix	trans	-86.7	-21.8	-179.9	-57.8	0	0	0	0	113.4	S213 K218 D219 S220	S213-S216 PolarHBondContact O-N 3.01Å; S213-S216 PolarHBondContact OG-N 3.02Å; S216-K218 VanDerWaalsContact C-N 3.32Å; S216-K218 PolarHBondContact O-N 3.37Å; S216-D219 PolarHBondContact O-N 3.3Å; S216-S220 WeakPolarHBondContact O-CB 3.38Å; S216-S220 PolarHBondContact O-N 3.5Å; S216-S220 PolarHBondContact O-OG 3.18Å
217	Y	91	Very high	92.6	Very high	117 Å²	117	78.6 Å²	78.6	46%	0.459	41%	0.407	S	S	.	.	H	α-helix	trans	-54.3	-45.6	-173.6	-171.9	-90.9	0	0	0	113	L209 L212 S213 T221	L209-Y217 HydrophobicContact CD2-CE2 4.47Å; L209-Y217 HydrophobicContact CG-CE2 4.28Å; L212-Y217 HydrophobicContact CB-CD2 4.22Å; L212-Y217 HydrophobicContact CD1-CD2 4.34Å; S213-Y217 WeakPolarHBondContact O-CB 3.27Å; S213-Y217 PolarHBondContact O-N 2.8Å; Y217-T221 HydrophobicContact CD1-CG2 4.12Å; Y217-T221 HydrophobicContact CD2-CG2 4.43Å; Y217-T221 HydrophobicContact CE1-CG2 3.82Å; Y217-T221 HydrophobicContact CE2-CG2 4.16Å; Y217-T221 HydrophobicContact CG-CG2 4.41Å; Y217-T221 WeakPolarHBondContact O-CB 3.41Å; Y217-T221 VanDerWaalsContact O-CG2 3.25Å; Y217-T221 WeakPolarHBondContact O-CG2 3.47Å; Y217-T221 PolarHBondContact O-N 2.96Å; Y217-T221 PolarHBondContact O-OG1 3.21Å
218	K	93.1	Very high	92.7	Very high	158 Å²	158	80 Å²	80	69%	0.687	40%	0.398	S	S	*	.	H	α-helix	trans	-63.6	-45.7	-177.8	-176.4	-176.4	173.3	-170.5	0	112.3	S216 T221 L222	S216-K218 VanDerWaalsContact C-N 3.32Å; S216-K218 PolarHBondContact O-N 3.37Å; K218-T221 PolarHBondContact O-OG1 3.01Å; K218-L222 WeakPolarHBondContact O-CB 3.37Å; K218-L222 PolarHBondContact O-N 3.48Å
219	D	93.7	Very high	92.9	Very high	85 Å²	85	79.3 Å²	79.3	46%	0.455	40%	0.397	S	S	.	.	H	α-helix	trans	-73.4	-43.3	-176.4	-70.2	-16.4	0	0	0	111.1	P171 S216 L222 I223	P171-D219 HydrophobicContact CB-CB 4.19Å; P171-D219 HydrophobicContact CG-CB 4.09Å; S216-D219 PolarHBondContact O-N 3.3Å; D219-L222 PolarHBondContact O-N 3.16Å; D219-I223 VanDerWaalsContact O-CG1 3.3Å; D219-I223 WeakPolarHBondContact O-CG1 3.3Å; D219-I223 PolarHBondContact O-N 3.01Å; D219-I223 VanDerWaalsContact O-N 3.09Å
220	S	95.6	Very high	93.2	Very high	0 Å²	0	79.9 Å²	79.9	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-61.9	-46.3	177.5	-62.2	0	0	0	0	112	T169 P171 S216 L222 I223 M224	T169-S220 WeakPolarHBondContact O-CB 3.26Å; T169-S220 PolarHBondContact O-OG 3.45Å; P171-S220 WeakPolarHBondContact CD-OG 3.45Å; P171-S220 WeakPolarHBondContact CG-OG 3.36Å; S216-S220 WeakPolarHBondContact O-CB 3.38Å; S216-S220 PolarHBondContact O-N 3.5Å; S216-S220 PolarHBondContact O-OG 3.18Å; S220-L222 PolarHBondContact O-N 2.88Å; S220-I223 PolarHBondContact O-N 2.66Å; S220-M224 VanDerWaalsContact O-CG 3.29Å; S220-M224 WeakPolarHBondContact O-CG 3.31Å; S220-M224 PolarHBondContact O-N 2.67Å
221	T	95.9	Very high	93.5	Very high	43 Å²	43	72.9 Å²	72.9	26%	0.264	36%	0.363	S	S	.	.	H	α-helix	trans	-66.3	-35.6	179.7	53	0	0	0	0	112.7	L209 Y217 K218 M224 Q225	L209-T221 HydrophobicContact CD1-CG2 4.11Å; L209-T221 HydrophobicContact CD2-CG2 4.45Å; Y217-T221 HydrophobicContact CD1-CG2 4.12Å; Y217-T221 HydrophobicContact CD2-CG2 4.43Å; Y217-T221 HydrophobicContact CE1-CG2 3.82Å; Y217-T221 HydrophobicContact CE2-CG2 4.16Å; Y217-T221 HydrophobicContact CG-CG2 4.41Å; Y217-T221 WeakPolarHBondContact O-CB 3.41Å; Y217-T221 VanDerWaalsContact O-CG2 3.25Å; Y217-T221 WeakPolarHBondContact O-CG2 3.47Å; Y217-T221 PolarHBondContact O-N 2.96Å; Y217-T221 PolarHBondContact O-OG1 3.21Å; K218-T221 PolarHBondContact O-OG1 3.01Å; T221-M224 PolarHBondContact O-N 3.33Å; T221-Q225 WeakPolarHBondContact O-CB 3.09Å; T221-Q225 PolarHBondContact O-N 3.29Å
222	L	96.8	Very high	93.8	Very high	104 Å²	104	72.7 Å²	72.7	55%	0.545	36%	0.362	S	S	.	.	H	α-helix	trans	-61.9	-42.7	172.7	178.2	62.1	0	0	0	111.6	K218 D219 S220 Q225 L226	K218-L222 WeakPolarHBondContact O-CB 3.37Å; K218-L222 PolarHBondContact O-N 3.48Å; D219-L222 PolarHBondContact O-N 3.16Å; S220-L222 PolarHBondContact O-N 2.88Å; L222-Q225 WeakPolarHBondContact O-CB 3.48Å; L222-Q225 PolarHBondContact O-N 2.9Å; L222-L226 WeakPolarHBondContact O-CG 3.47Å; L222-L226 PolarHBondContact O-N 2.93Å
223	I	97.7	Very high	94.1	Very high	27 Å²	27	76.1 Å²	76.1	14%	0.138	38%	0.379	C	S	.	.	H	α-helix	trans	-70.3	-40.8	179.1	-61.6	165.5	0	0	0	111.1	P171 L174 L178 D219 S220 Q225 L226 L227	P171-I223 HydrophobicContact CB-CD1 4.11Å; P171-I223 VanDerWaalsContact O-CD1 3.27Å; P171-I223 WeakPolarHBondContact O-CD1 3.43Å; L174-I223 HydrophobicContact CB-CB 4.18Å; L174-I223 HydrophobicContact CB-CD1 4.45Å; L174-I223 HydrophobicContact CB-CG2 3.65Å; L178-I223 HydrophobicContact CB-CG2 4.32Å; L178-I223 HydrophobicContact CD2-CG2 4.18Å; D219-I223 VanDerWaalsContact O-CG1 3.3Å; D219-I223 WeakPolarHBondContact O-CG1 3.3Å; D219-I223 PolarHBondContact O-N 3.01Å; D219-I223 VanDerWaalsContact O-N 3.09Å; S220-I223 PolarHBondContact O-N 2.66Å; I223-Q225 VanDerWaalsContact C-N 3.26Å; I223-Q225 PolarHBondContact O-N 3.28Å; I223-L226 WeakPolarHBondContact O-CB 3.46Å; I223-L226 PolarHBondContact O-N 3.43Å; I223-L226 VanDerWaalsContact O-N 3.12Å; I223-L227 PolarHBondContact O-N 3.48Å
224	M	97.6	Very high	94.6	Very high	7 Å²	7	73.4 Å²	73.4	3%	0.034	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-37.7	174.4	-71.1	172.9	72.8	0	0	112	L174 F202 A205 I206 L209 S220 T221 L227 R228	L174-M224 HydrophobicContact CD1-CG 3.94Å; L174-M224 HydrophobicContact CD1-SD 4.38Å; L174-M224 HydrophobicContact CD2-CG 4.04Å; F202-M224 HydrophobicContact CD2-CB 4.09Å; F202-M224 HydrophobicContact CD2-CE 4.41Å; F202-M224 WeakPolarHBondContact CD2-O 3.44Å; F202-M224 HydrophobicContact CE2-CB 4.03Å; F202-M224 HydrophobicContact CE2-CE 4.29Å; F202-M224 WeakPolarHBondContact CE2-O 3.39Å; A205-M224 HydrophobicContact CB-CE 3.92Å; A205-M224 HydrophobicContact CB-CG 4.39Å; A205-M224 HydrophobicContact CB-SD 3.89Å; I206-M224 HydrophobicContact CB-CE 3.97Å; I206-M224 HydrophobicContact CD1-CE 3.96Å; L209-M224 HydrophobicContact CD1-CE 4.25Å; L209-M224 HydrophobicContact CD1-SD 3.68Å; S220-M224 VanDerWaalsContact O-CG 3.29Å; S220-M224 WeakPolarHBondContact O-CG 3.31Å; S220-M224 PolarHBondContact O-N 2.67Å; T221-M224 PolarHBondContact O-N 3.33Å; M224-L227 WeakPolarHBondContact O-CB 3.27Å; M224-L227 PolarHBondContact O-N 2.74Å; M224-R228 PolarHBondContact O-N 2.73Å
225	Q	97.7	Very high	94.9	Very high	63 Å²	63	68.1 Å²	68.1	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-60.1	-45.8	172.9	177.1	55.1	42.1	0	0	111.5	T221 L222 I223 L227 R228 D229	T221-Q225 WeakPolarHBondContact O-CB 3.09Å; T221-Q225 PolarHBondContact O-N 3.29Å; L222-Q225 WeakPolarHBondContact O-CB 3.48Å; L222-Q225 PolarHBondContact O-N 2.9Å; I223-Q225 VanDerWaalsContact C-N 3.26Å; I223-Q225 PolarHBondContact O-N 3.28Å; Q225-L227 PolarHBondContact O-N 2.79Å; Q225-R228 PolarHBondContact O-N 3.25Å; Q225-D229 PolarHBondContact NE2-OD1 3.17Å; Q225-D229 PolarHBondContact NE2-OD2 3.1Å; Q225-D229 PolarHBondContact O-N 3.39Å
226	L	98.2	Very high	95.1	Very high	77 Å²	77	64.2 Å²	64.2	40%	0.403	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-39.5	176.4	-65.5	172.9	0	0	0	112.6	L178 L222 I223 D229 N230	L178-L226 HydrophobicContact CD1-CB 4.06Å; L178-L226 HydrophobicContact CD2-CB 3.94Å; L178-L226 HydrophobicContact CD2-CD1 3.89Å; L222-L226 WeakPolarHBondContact O-CG 3.47Å; L222-L226 PolarHBondContact O-N 2.93Å; I223-L226 WeakPolarHBondContact O-CB 3.46Å; I223-L226 PolarHBondContact O-N 3.43Å; I223-L226 VanDerWaalsContact O-N 3.12Å; L226-D229 PolarHBondContact O-N 2.95Å; L226-N230 PolarHBondContact O-N 3.09Å
227	L	98.2	Very high	95	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-46.7	173.9	-78.2	167.9	0	0	0	111.4	L174 L178 A198 A201 F202 I223 M224 Q225 D229 N230 L231	L174-L227 HydrophobicContact CD2-CD1 4.05Å; L178-L227 HydrophobicContact CB-CD2 3.89Å; L178-L227 HydrophobicContact CB-CG 4.22Å; L178-L227 HydrophobicContact CD1-CD2 3.98Å; L178-L227 HydrophobicContact CD1-CG 4.18Å; A198-L227 HydrophobicContact CB-CD2 3.84Å; A201-L227 HydrophobicContact CB-CD1 4.37Å; F202-L227 HydrophobicContact CD2-CB 4.45Å; I223-L227 PolarHBondContact O-N 3.48Å; M224-L227 WeakPolarHBondContact O-CB 3.27Å; M224-L227 PolarHBondContact O-N 2.74Å; Q225-L227 PolarHBondContact O-N 2.79Å; L227-D229 VanDerWaalsContact C-N 3.35Å; L227-D229 PolarHBondContact O-N 2.86Å; L227-N230 PolarHBondContact O-N 3.49Å; L227-L231 WeakPolarHBondContact O-CG 3.4Å; L227-L231 PolarHBondContact O-N 3.31Å
228	R	97.3	Very high	94.6	Very high	120 Å²	120	63.4 Å²	63.4	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-62.2	-41.3	177.5	-171.2	-172	74.2	-168.8	4.9	112.5	F202 M224 Q225 L231 T232	F202-R228 HydrophobicContact CD2-CB 4.35Å; F202-R228 HydrophobicContact CE2-CB 3.95Å; M224-R228 PolarHBondContact O-N 2.73Å; Q225-R228 PolarHBondContact O-N 3.25Å; R228-L231 PolarHBondContact O-N 2.77Å; R228-T232 PolarHBondContact O-N 2.8Å; R228-T232 PolarHBondContact O-OG1 3.12Å
229	D	97.4	Very high	93.8	Very high	70 Å²	70	60.2 Å²	60.2	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-66.6	-40.8	-179.7	-65.2	-14	0	0	0	110.7	Q225 L226 L227 T232 L233	Q225-D229 PolarHBondContact NE2-OD1 3.17Å; Q225-D229 PolarHBondContact NE2-OD2 3.1Å; Q225-D229 PolarHBondContact O-N 3.39Å; L226-D229 PolarHBondContact O-N 2.95Å; L227-D229 VanDerWaalsContact C-N 3.35Å; L227-D229 PolarHBondContact O-N 2.86Å; D229-T232 WeakPolarHBondContact O-CB 3.49Å; D229-T232 PolarHBondContact O-N 3.45Å; D229-L233 PolarHBondContact O-N 3.17Å; D229-L233 VanDerWaalsContact O-N 3.08Å
230	N	96.2	Very high	92.6	Very high	35 Å²	35	65.3 Å²	65.3	19%	0.187	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-44.3	172.4	-78.5	-6.4	0	0	0	112.6	L178 L226 L227 T232 L233 W234	L178-N230 WeakPolarHBondContact CD1-ND2 3.42Å; L226-N230 PolarHBondContact O-N 3.09Å; L227-N230 PolarHBondContact O-N 3.49Å; N230-T232 VanDerWaalsContact C-N 3.26Å; N230-T232 PolarHBondContact O-N 3.47Å; N230-L233 PolarHBondContact O-N 2.94Å; N230-L233 VanDerWaalsContact O-N 3.16Å; N230-W234 HydrophobicContact CB-CD2 4.17Å; N230-W234 HydrophobicContact CB-CE3 3.97Å; N230-W234 HydrophobicContact CB-CH2 3.63Å; N230-W234 HydrophobicContact CB-CZ2 3.83Å; N230-W234 HydrophobicContact CB-CZ3 3.7Å; N230-W234 WeakPolarHBondContact ND2-CH2 3.41Å; N230-W234 VanDerWaalsContact O-CG 3.25Å; N230-W234 PolarHBondContact O-N 3.24Å
231	L	96.3	Very high	90.7	Very high	25 Å²	25	73.5 Å²	73.5	13%	0.131	39%	0.393	C	S	.	.	H	α-helix	trans	-57.2	-42.5	175.6	-76.5	168.2	0	0	0	111.8	C195 A198 K199 L227 R228 L233 T235	C195-L231 HydrophobicContact CB-CD2 4.01Å; C195-L231 VanDerWaalsContact O-CD2 3.29Å; C195-L231 WeakPolarHBondContact O-CD2 3.17Å; A198-L231 HydrophobicContact CB-CD1 4.4Å; A198-L231 HydrophobicContact CB-CD2 3.8Å; A198-L231 HydrophobicContact CB-CG 3.91Å; K199-L231 HydrophobicContact CB-CD1 4.15Å; K199-L231 HydrophobicContact CB-CD2 3.96Å; L227-L231 WeakPolarHBondContact O-CG 3.4Å; L227-L231 PolarHBondContact O-N 3.31Å; R228-L231 PolarHBondContact O-N 2.77Å; L231-L233 VanDerWaalsContact C-N 3.33Å; L231-L233 PolarHBondContact O-N 3.29Å; L231-T235 VanDerWaalsContact O-CB 3.3Å; L231-T235 WeakPolarHBondContact O-CB 3.29Å; L231-T235 PolarHBondContact O-N 3.24Å; L231-T235 PolarHBondContact O-OG1 3.06Å
232	T	95.1	Very high	88.2	Confident	102 Å²	102	74.2 Å²	74.2	63%	0.626	41%	0.41	S	S	*	.	H	α-helix	trans	-62.9	-41.9	178.1	-54.7	0	0	0	0	111.2	R228 D229 N230	R228-T232 PolarHBondContact O-N 2.8Å; R228-T232 PolarHBondContact O-OG1 3.12Å; D229-T232 WeakPolarHBondContact O-CB 3.49Å; D229-T232 PolarHBondContact O-N 3.45Å; N230-T232 VanDerWaalsContact C-N 3.26Å; N230-T232 PolarHBondContact O-N 3.47Å
233	L	93.9	Very high	85.3	Confident	104 Å²	104	77.7 Å²	77.7	55%	0.545	42%	0.423	S	S	.	.	H	α-helix	trans	-69.7	-41.7	-180	-177.9	64.8	0	0	0	112.9	D229 N230 L231 S236	D229-L233 PolarHBondContact O-N 3.17Å; D229-L233 VanDerWaalsContact O-N 3.08Å; N230-L233 PolarHBondContact O-N 2.94Å; N230-L233 VanDerWaalsContact O-N 3.16Å; L231-L233 VanDerWaalsContact C-N 3.33Å; L231-L233 PolarHBondContact O-N 3.29Å; L233-S236 PolarHBondContact O-OG 3.09Å
234	W	95.9	Very high	82.3	Confident	7 Å²	7	85.4 Å²	85.4	3%	0.027	46%	0.458	C	S	.	.	H	α-helix	trans	-88.2	-23	-171.4	-57.5	-27.2	0	0	0	113.7	S181 V182 Y185 A194 C195 N230 S236 D237	S181-W234 WeakPolarHBondContact OG-CZ3 3.46Å; V182-W234 HydrophobicContact CB-CH2 4.37Å; V182-W234 HydrophobicContact CG2-CH2 3.71Å; V182-W234 HydrophobicContact CG2-CZ2 3.92Å; Y185-W234 AromaticContact CD1-CD1 3.9Å; Y185-W234 AromaticContact CD1-CE2 3.83Å; Y185-W234 HydrophobicContact CD1-CZ2 4.27Å; Y185-W234 AromaticContact CD1-NE1 3.41Å; Y185-W234 HydrophobicContact CD2-CB 3.99Å; Y185-W234 AromaticContact CD2-CD1 3.47Å; Y185-W234 VanDerWaalsContact CD2-CD1 3.47Å; Y185-W234 AromaticContact CD2-CD2 3.84Å; Y185-W234 HydrophobicContact CD2-CD2 3.84Å; Y185-W234 AromaticContact CD2-CE2 4Å; Y185-W234 AromaticContact CD2-CG 3.51Å; Y185-W234 HydrophobicContact CD2-CG 3.51Å; Y185-W234 AromaticContact CD2-NE1 3.76Å; Y185-W234 AromaticContact CE1-CD1 3.64Å; Y185-W234 AromaticContact CE1-NE1 3.42Å; Y185-W234 HydrophobicContact CE2-CB 3.89Å; Y185-W234 AromaticContact CE2-CD1 3.19Å; Y185-W234 HydrophobicContact CE2-CD2 4.32Å; Y185-W234 AromaticContact CE2-CG 3.55Å; Y185-W234 HydrophobicContact CE2-CG 3.55Å; Y185-W234 AromaticContact CE2-NE1 3.78Å; Y185-W234 AromaticContact CG-CD1 3.83Å; Y185-W234 AromaticContact CG-CD2 3.95Å; Y185-W234 HydrophobicContact CG-CD2 3.95Å; Y185-W234 AromaticContact CG-CE2 3.67Å; Y185-W234 HydrophobicContact CG-CG 4.04Å; Y185-W234 HydrophobicContact CG-CZ2 4.19Å; Y185-W234 AromaticContact CG-NE1 3.59Å; Y185-W234 AromaticContact CZ-CD1 3.27Å; Y185-W234 AromaticContact CZ-NE1 3.6Å; A194-W234 HydrophobicContact CB-CE3 3.94Å; A194-W234 HydrophobicContact CB-CZ3 4.02Å; C195-W234 VanDerWaalsContact SG-CB 3.58Å; N230-W234 HydrophobicContact CB-CD2 4.17Å; N230-W234 HydrophobicContact CB-CE3 3.97Å; N230-W234 HydrophobicContact CB-CH2 3.63Å; N230-W234 HydrophobicContact CB-CZ2 3.83Å; N230-W234 HydrophobicContact CB-CZ3 3.7Å; N230-W234 WeakPolarHBondContact ND2-CH2 3.41Å; N230-W234 VanDerWaalsContact O-CG 3.25Å; N230-W234 PolarHBondContact O-N 3.24Å; W234-S236 PolarHBondContact O-N 3.29Å; W234-D237 PolarHBondContact O-N 2.9Å; W234-D237 VanDerWaalsContact O-N 3.1Å
235	T	92.2	Very high	79.3	Confident	79 Å²	79	93.3 Å²	93.3	49%	0.485	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-29.1	177.9	-58.4	0	0	0	0	111.7	L231 D237 I238	L231-T235 VanDerWaalsContact O-CB 3.3Å; L231-T235 WeakPolarHBondContact O-CB 3.29Å; L231-T235 PolarHBondContact O-N 3.24Å; L231-T235 PolarHBondContact O-OG1 3.06Å; T235-D237 PolarHBondContact O-N 2.95Å; T235-I238 PolarHBondContact O-N 3.19Å
236	S	88.9	Confident	76.2	Confident	93 Å²	93	99.3 Å²	99.3	65%	0.65	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-17.5	176	57	0	0	0	0	114.3	L233 W234	L233-S236 PolarHBondContact O-OG 3.09Å; W234-S236 PolarHBondContact O-N 3.29Å
237	D	86	Confident	73.1	Confident	82 Å²	82	101.1 Å²	101.1	44%	0.439	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-12.1	179.8	-63.1	-17.6	0	0	0	112.4	Y185 W234 T235 P239	Y185-D237 WeakPolarHBondContact CE2-OD2 3.36Å; Y185-D237 PolarHBondContact OH-OD2 3.35Å; W234-D237 PolarHBondContact O-N 2.9Å; W234-D237 VanDerWaalsContact O-N 3.1Å; T235-D237 PolarHBondContact O-N 2.95Å; D237-P239 WeakPolarHBondContact O-CD 3.41Å
238	I	82.9	Confident	70.3	Confident	51 Å²	51	108.8 Å²	108.8	26%	0.262	58%	0.575	S	S	.	*	S	Bend	trans	-78.9	119.9	174.7	-57.2	174.5	0	0	0	107	P191 E192 C195 T235 E240	P191-I238 HydrophobicContact CB-CG1 4.22Å; E192-I238 HydrophobicContact CG-CD1 4.47Å; E192-I238 HydrophobicContact CG-CG1 4.44Å; E192-I238 HydrophobicContact CG-CG2 4.24Å; C195-I238 HydrophobicContact CB-CD1 4.2Å; T235-I238 PolarHBondContact O-N 3.19Å; I238-E240 PolarHBondContact O-N 3Å
239	P	75.5	Confident	67.5	Low	90 Å²	90	108 Å²	108	58%	0.584	59%	0.589	S	S	*	*			trans	-56.2	129	174.2	-21	31.9	0	0	0	109.9	D237 D241	D237-P239 WeakPolarHBondContact O-CD 3.41Å; P239-D241 VanDerWaalsContact C-N 3.29Å; P239-D241 PolarHBondContact O-N 3.39Å
240	E	68.5	Low	64.7	Low	193 Å²	193	108.1 Å²	108.1	90%	0.902	60%	0.599	S	S	*	*			trans	-64.7	93.6	166.5	-72.7	-176.3	168.9	0	0	107.6	I238 G242	I238-E240 PolarHBondContact O-N 3Å; E240-G242 PolarHBondContact O-N 3.45Å
241	D	56.1	Low	61.8	Low	171 Å²	171	117.8 Å²	117.8	91%	0.914	63%	0.633	S	S	*	*			trans	-68.1	80.1	166.3	-83.9	-22.2	0	0	0	107.9	P239	P239-D241 VanDerWaalsContact C-N 3.29Å; P239-D241 PolarHBondContact O-N 3.39Å
242	G	43.4	Very low	59	Low	59 Å²	59	121.1 Å²	121.1	61%	0.608	66%	0.664	S	S	*	*			trans	-142.6	22.8	-168.8	0	0	0	0	0	114.3	E240	E240-G242 PolarHBondContact O-N 3.45Å
243	E	36.8	Very low	56.3	Low	177 Å²	177	124.3 Å²	124.3	83%	0.827	68%	0.677	S	S	*	*			trans	-115	82.3	152.2	-74.3	-169.7	178.2	0	0	108	Q245	E243-Q245 PolarHBondContact O-N 3.12Å
244	E	35	Very low	53.7	Low	188 Å²	188	122.8 Å²	122.8	88%	0.879	69%	0.686	S	S	*	*			trans	-49.9	94	146.3	-71.9	-177.8	162	0	0	106.5	K246	E244-K246 PolarHBondContact O-N 3Å
245	Q	33	Very low	50.8	Low	173 Å²	173	125.3 Å²	125.3	81%	0.808	71%	0.714	S	S	*	*			trans	-58.3	98.8	163.6	-85.5	-175.6	-3.9	0	0	105.3	E243 V247	E243-Q245 PolarHBondContact O-N 3.12Å; Q245-V247 PolarHBondContact O-N 3.47Å
246	K	32.6	Very low	48.3	Very low	189 Å²	189	128.5 Å²	128.5	82%	0.822	73%	0.729	S	S	*	*			trans	-39.9	115.4	167.8	-77.3	179.5	177.8	173.8	0	106.3	E244 D248	E244-K246 PolarHBondContact O-N 3Å; K246-D248 VanDerWaalsContact C-N 3.32Å; K246-D248 PolarHBondContact O-N 3.3Å
247	V	34.8	Very low	45.9	Very low	115 Å²	115	131.2 Å²	131.2	70%	0.697	74%	0.736	S	S	*	*			trans	-43.7	102.5	168.3	-177.1	0	0	0	0	106.7	Q245 S249	Q245-V247 PolarHBondContact O-N 3.47Å; V247-S249 WeakPolarHBondContact CG1-OG 3.18Å; V247-S249 PolarHBondContact O-N 3.18Å
248	D	37.8	Very low	44.2	Very low	162 Å²	162	136 Å²	136	87%	0.866	79%	0.786	S	S	*	*			trans	-69.7	64.9	161.1	-90.4	-25.1	0	0	0	107	K246 A250	K246-D248 VanDerWaalsContact C-N 3.32Å; K246-D248 PolarHBondContact O-N 3.3Å; D248-A250 PolarHBondContact O-N 3.06Å
249	S	38.3	Very low	42.2	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	81%	0.812	S	S	*	*			trans	-80.9	75.6	156.9	-82.1	0	0	0	0	106.5	V247	V247-S249 WeakPolarHBondContact CG1-OG 3.18Å; V247-S249 PolarHBondContact O-N 3.18Å
250	A	38.6	Very low	40.5	Very low	71 Å²	71	142.8 Å²	142.8	59%	0.587	82%	0.824	S	S	*	*			trans	-142.3	88.5	167.8	0	0	0	0	0	110.7	D248	D248-A250 PolarHBondContact O-N 3.06Å
251	R	36.6	Very low	38.9	Very low	238 Å²	238	140.1 Å²	140.1	90%	0.898	82%	0.82	S	S	*	*			trans	81.3	101.5	141.2	-60.1	171.2	178.7	177.8	-1.3	115
252	A	37.8	Very low	37.9	Very low	95 Å²	95	138.2 Å²	138.2	79%	0.785	82%	0.815	S	S	*	*				76.6	121	72.1	0	0	0	0	0	112.8
253	D	36.8	Very low	37.6	Very low	170 Å²	170	143.2 Å²	143.2	91%	0.909	83%	0.828	S	S	*	*			trans	97.4	134.8	136.2	-143.1	13.5	0	0	0	118.4
254	G	39.9	Very low	37.6	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	83%	0.828	S	S	*	*			trans	120.2	77.4	-173.7	0	0	0	0	0	110.7
255	G	34.5	Very low	37.8	Very low	60 Å²	60	137.6 Å²	137.6	62%	0.619	82%	0.824	S	S	*	*			cis	99.3	104.7	35.7	0	0	0	0	0	109.2
256	D	39.7	Very low	38.2	Very low	147 Å²	147	134.8 Å²	134.8	79%	0.786	83%	0.825	S	S	*	*			trans	67.5	119.9	144.2	-60.4	-10.5	0	0	0	122.5
257	D	39.3	Very low	38.6	Very low	150 Å²	150	130.3 Å²	130.3	80%	0.802	83%	0.825	S	S	*	*				59.7	106.6	122.6	-61.5	-17.1	0	0	0	120.5
258	A	49.5	Very low	39	Very low	181 Å²	181	131.7 Å²	131.7	100%	1.496	84%	0.837	S	S	*	*				-172.4	0	123.2	0	0	0	0	0	111.3

Retrieved 258 of 258 residues in 555.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).