1433B_XENTR Loading...

14-3-3 protein beta/alpha

Adapter protein implicated in the regulation of a large spectrum of both general and specialized signaling pathways. Binds to a large number of partners, usually by recognition of a phosphoserine or phosphothreonine motif. Binding generally results in the modulation of the activity of the binding partner (By similarity).

AlphaFold DB , UniProt , Accession Q5XGC8, Species XENTR (Xenopus tropicalis, Western clawed frog), Gene ywhab, Length 244 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	68	Low	94.3	Very high	141 Å²	141	67.6 Å²	67.6	70%	0.695	34%	0.338	S	S	*	.				0	126.4	0	-162.1	170.4	-73.8	0	0	105.7	E5 L6	M1-E5 WeakPolarHBondContact CA-OE2 3.26Å; M1-E5 HydrophobicContact CG-CB 3.32Å; M1-E5 HydrophobicContact CG-CG 4.3Å; M1-E5 WeakPolarHBondContact CG-OE2 3.32Å; M1-E5 HydrophobicContact SD-CB 4.1Å; M1-L6 HydrophobicContact CB-CD2 4.33Å; M1-L6 HydrophobicContact CB-CG 4.16Å; M1-L6 HydrophobicContact CG-CD2 4.08Å; M1-L6 HydrophobicContact CG-CG 3.84Å; M1-L6 HydrophobicContact SD-CD2 3.41Å; M1-L6 WeakPolarHBondContact SD-CD2 3.31Å; M1-L6 HydrophobicContact SD-CG 3.77Å
2	D	90.8	Very high	94.7	Very high	82 Å²	82	70 Å²	70	44%	0.439	35%	0.351	S	S	.	.			trans	-76.5	171.2	176	68.7	30.4	0	0	0	111.1	S4 E5 L6	D2-S4 VanDerWaalsContact C-N 3.29Å; D2-S4 VanDerWaalsContact CG-OG 3.23Å; D2-S4 PolarHBondContact O-N 3.16Å; D2-S4 PolarHBondContact OD1-N 3.35Å; D2-S4 VanDerWaalsContact OD1-N 3.12Å; D2-S4 PolarHBondContact OD1-OG 2.95Å; D2-S4 PolarHBondContact OD2-OG 3.11Å; D2-E5 PolarHBondContact N-OE2 3.15Å; D2-E5 VanDerWaalsContact N-OE2 3.07Å; D2-E5 PolarHBondContact O-N 2.88Å; D2-E5 WeakPolarHBondContact OD1-CB 3.46Å; D2-E5 VanDerWaalsContact OD1-CG 3.31Å; D2-E5 WeakPolarHBondContact OD1-CG 3.36Å; D2-E5 PolarHBondContact OD1-N 2.96Å; D2-L6 PolarHBondContact O-N 3.06Å
3	K	95.7	Very high	95	Very high	61 Å²	61	65.3 Å²	65.3	27%	0.265	33%	0.329	S	S	.	.	H	α-helix	trans	-57.9	-42	-179.1	-170.5	179.4	-177.7	-161.7	0	111.5	L6 V7 V29 L32 E40	K3-L6 PolarHBondContact O-N 2.99Å; K3-V7 WeakPolarHBondContact O-CG2 3.37Å; K3-V7 PolarHBondContact O-N 2.82Å; K3-V29 HydrophobicContact CD-CG1 4.46Å; K3-V29 HydrophobicContact CG-CG1 4.03Å; K3-L32 HydrophobicContact CB-CD1 3.69Å; K3-L32 HydrophobicContact CD-CD1 4.49Å; K3-L32 HydrophobicContact CG-CD1 3.94Å; K3-E40 WeakPolarHBondContact CE-OE1 3.5Å; K3-E40 VanDerWaalsContact CE-OE2 3.27Å; K3-E40 WeakPolarHBondContact CE-OE2 3.31Å; K3-E40 IonicContact NZ-OE1 3.97Å; K3-E40 PolarHBondContact NZ-OE1 3.25Å; K3-E40 IonicContact NZ-OE2 2.64Å; K3-E40 PolarHBondContact NZ-OE2 3Å
4	S	96.3	Very high	95.2	Very high	80 Å²	80	65.6 Å²	65.6	56%	0.559	33%	0.329	S	S	*	.	H	α-helix	trans	-64.9	-42.7	-178.7	33.7	0	0	0	0	113.2	D2 L6 V7 Q8	D2-S4 VanDerWaalsContact C-N 3.29Å; D2-S4 VanDerWaalsContact CG-OG 3.23Å; D2-S4 PolarHBondContact O-N 3.16Å; D2-S4 PolarHBondContact OD1-N 3.35Å; D2-S4 VanDerWaalsContact OD1-N 3.12Å; D2-S4 PolarHBondContact OD1-OG 2.95Å; D2-S4 PolarHBondContact OD2-OG 3.11Å; S4-L6 VanDerWaalsContact C-N 3.34Å; S4-L6 PolarHBondContact O-N 3.3Å; S4-V7 PolarHBondContact O-N 3.08Å; S4-Q8 WeakPolarHBondContact O-CB 3.46Å; S4-Q8 PolarHBondContact O-N 2.97Å
5	E	97.1	Very high	95.4	Very high	105 Å²	105	71.7 Å²	71.7	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-41.4	176	-74.5	175.7	155.5	0	0	111.4	M1 D2 Q8 K9	M1-E5 WeakPolarHBondContact CA-OE2 3.26Å; M1-E5 HydrophobicContact CG-CB 3.32Å; M1-E5 HydrophobicContact CG-CG 4.3Å; M1-E5 WeakPolarHBondContact CG-OE2 3.32Å; M1-E5 HydrophobicContact SD-CB 4.1Å; D2-E5 PolarHBondContact N-OE2 3.15Å; D2-E5 VanDerWaalsContact N-OE2 3.07Å; D2-E5 PolarHBondContact O-N 2.88Å; D2-E5 WeakPolarHBondContact OD1-CB 3.46Å; D2-E5 VanDerWaalsContact OD1-CG 3.31Å; D2-E5 WeakPolarHBondContact OD1-CG 3.36Å; D2-E5 PolarHBondContact OD1-N 2.96Å; E5-Q8 PolarHBondContact O-N 2.89Å; E5-K9 WeakPolarHBondContact O-CB 3.21Å; E5-K9 PolarHBondContact O-N 3.39Å
6	L	98	Very high	95.5	Very high	18 Å²	18	71.1 Å²	71.1	9%	0.094	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-43.8	176.7	-72.7	167.7	0	0	0	112.3	M1 D2 K3 S4 Q8 K9 A10 A28 V29	M1-L6 HydrophobicContact CB-CD2 4.33Å; M1-L6 HydrophobicContact CB-CG 4.16Å; M1-L6 HydrophobicContact CG-CD2 4.08Å; M1-L6 HydrophobicContact CG-CG 3.84Å; M1-L6 HydrophobicContact SD-CD2 3.41Å; M1-L6 WeakPolarHBondContact SD-CD2 3.31Å; M1-L6 HydrophobicContact SD-CG 3.77Å; D2-L6 PolarHBondContact O-N 3.06Å; K3-L6 PolarHBondContact O-N 2.99Å; S4-L6 VanDerWaalsContact C-N 3.34Å; S4-L6 PolarHBondContact O-N 3.3Å; L6-Q8 VanDerWaalsContact C-N 3.34Å; L6-K9 WeakPolarHBondContact O-CB 3.47Å; L6-K9 PolarHBondContact O-N 3.21Å; L6-A10 PolarHBondContact O-N 3.04Å; L6-A28 HydrophobicContact CD1-CB 3.82Å; L6-A28 HydrophobicContact CD2-CB 3.91Å; L6-V29 HydrophobicContact CB-CG2 3.41Å; L6-V29 VanDerWaalsContact CB-CG2 3.41Å; L6-V29 HydrophobicContact CD1-CG2 4.11Å; L6-V29 HydrophobicContact CG-CG2 4.38Å
7	V	98.3	Very high	95.7	Very high	12 Å²	12	75.4 Å²	75.4	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-63.5	-42.2	176	171.2	0	0	0	0	110.6	K3 S4 K9 A10 K11 V29 E40 L43	K3-V7 WeakPolarHBondContact O-CG2 3.37Å; K3-V7 PolarHBondContact O-N 2.82Å; S4-V7 PolarHBondContact O-N 3.08Å; V7-K9 VanDerWaalsContact C-N 3.32Å; V7-K9 PolarHBondContact O-N 3.26Å; V7-A10 WeakPolarHBondContact O-CB 3.24Å; V7-A10 PolarHBondContact O-N 3.14Å; V7-K11 HydrophobicContact CG1-CD 4.45Å; V7-K11 WeakPolarHBondContact O-CG 3.46Å; V7-K11 PolarHBondContact O-N 3.28Å; V7-V29 HydrophobicContact CG2-CG1 4.27Å; V7-V29 HydrophobicContact CG2-CG2 3.87Å; V7-E40 HydrophobicContact CG2-CG 3.97Å; V7-L43 HydrophobicContact CG1-CD1 3.97Å
8	Q	98.1	Very high	95.8	Very high	101 Å²	101	79.2 Å²	79.2	47%	0.472	39%	0.392	S	S	.	.	H	α-helix	trans	-63.6	-39.7	176.3	-173.8	60.7	19.6	0	0	111.7	S4 E5 L6 K11 L12	S4-Q8 WeakPolarHBondContact O-CB 3.46Å; S4-Q8 PolarHBondContact O-N 2.97Å; E5-Q8 PolarHBondContact O-N 2.89Å; L6-Q8 VanDerWaalsContact C-N 3.34Å; Q8-K11 PolarHBondContact O-N 3.4Å; Q8-L12 WeakPolarHBondContact O-CG 3.39Å; Q8-L12 PolarHBondContact O-N 3.43Å
9	K	98.2	Very high	96	Very high	97 Å²	97	77.8 Å²	77.8	42%	0.422	38%	0.383	S	S	.	.	H	α-helix	trans	-61.9	-42.7	173.5	-172.5	179.6	175.7	-171.2	0	111.5	E5 L6 V7 K11 L12 S13 S25	E5-K9 WeakPolarHBondContact O-CB 3.21Å; E5-K9 PolarHBondContact O-N 3.39Å; L6-K9 WeakPolarHBondContact O-CB 3.47Å; L6-K9 PolarHBondContact O-N 3.21Å; V7-K9 VanDerWaalsContact C-N 3.32Å; V7-K9 PolarHBondContact O-N 3.26Å; K9-K11 VanDerWaalsContact C-N 3.35Å; K9-K11 PolarHBondContact O-N 2.89Å; K9-L12 PolarHBondContact O-N 3.27Å; K9-S13 PolarHBondContact O-N 2.83Å; K9-S13 PolarHBondContact O-OG 3.47Å; K9-S13 VanDerWaalsContact O-OG 3.08Å; K9-S25 WeakPolarHBondContact CD-OG 3.47Å
10	A	98.5	Very high	96.1	Very high	0 Å²	0	78.2 Å²	78.2	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-60.1	-43.4	175.8	0	0	0	0	0	112.1	L6 V7 L12 S13 E14 M22 M26	L6-A10 PolarHBondContact O-N 3.04Å; V7-A10 WeakPolarHBondContact O-CB 3.24Å; V7-A10 PolarHBondContact O-N 3.14Å; A10-L12 PolarHBondContact O-N 3.18Å; A10-S13 WeakPolarHBondContact O-CB 3.29Å; A10-S13 PolarHBondContact O-N 3.43Å; A10-E14 PolarHBondContact O-N 2.83Å; A10-M22 HydrophobicContact CB-CG 4.09Å; A10-M26 HydrophobicContact CB-CG 3.74Å; A10-M26 HydrophobicContact CB-SD 3.54Å; A10-M26 VanDerWaalsContact CB-SD 3.54Å
11	K	98.5	Very high	96.2	Very high	47 Å²	47	76.7 Å²	76.7	20%	0.204	38%	0.38	C	S	.	.	H	α-helix	trans	-62.6	-39.8	175.8	-69.4	176.2	177.3	-176	0	112.8	V7 Q8 K9 E14 Q15 E39 L43	V7-K11 HydrophobicContact CG1-CD 4.45Å; V7-K11 WeakPolarHBondContact O-CG 3.46Å; V7-K11 PolarHBondContact O-N 3.28Å; Q8-K11 PolarHBondContact O-N 3.4Å; K9-K11 VanDerWaalsContact C-N 3.35Å; K9-K11 PolarHBondContact O-N 2.89Å; K11-E14 PolarHBondContact O-N 3.2Å; K11-Q15 WeakPolarHBondContact O-CG 3.41Å; K11-Q15 PolarHBondContact O-N 2.97Å; K11-Q15 VanDerWaalsContact O-N 3.15Å; K11-E39 WeakPolarHBondContact CE-OE1 3.48Å; K11-E39 IonicContact NZ-OE1 2.64Å; K11-E39 PolarHBondContact NZ-OE1 2.84Å; K11-E39 IonicContact NZ-OE2 2.96Å; K11-E39 PolarHBondContact NZ-OE2 3.37Å; K11-L43 HydrophobicContact CG-CD1 4.04Å; K11-L43 HydrophobicContact CG-CD2 4.18Å
12	L	98.5	Very high	97.6	Very high	96 Å²	96	70 Å²	70	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-65.8	-41.3	174.2	-70.8	171.3	0	0	0	111.5	Q8 K9 A10 E14 Q15 A16	Q8-L12 WeakPolarHBondContact O-CG 3.39Å; Q8-L12 PolarHBondContact O-N 3.43Å; K9-L12 PolarHBondContact O-N 3.27Å; A10-L12 PolarHBondContact O-N 3.18Å; L12-E14 VanDerWaalsContact C-N 3.35Å; L12-Q15 PolarHBondContact O-N 3.49Å; L12-A16 WeakPolarHBondContact O-CB 3.39Å; L12-A16 PolarHBondContact O-N 2.95Å; L12-A16 VanDerWaalsContact O-N 3.14Å
13	S	98.5	Very high	98	Very high	9 Å²	9	66.4 Å²	66.4	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-38.9	175.6	-63	0	0	0	0	112.3	K9 A10 A16 E17 R18 D21	K9-S13 PolarHBondContact O-N 2.83Å; K9-S13 PolarHBondContact O-OG 3.47Å; K9-S13 VanDerWaalsContact O-OG 3.08Å; A10-S13 WeakPolarHBondContact O-CB 3.29Å; A10-S13 PolarHBondContact O-N 3.43Å; S13-A16 CarbonylContact O-C 3.46Å; S13-A16 PolarHBondContact O-N 3.11Å; S13-E17 PolarHBondContact O-N 3.39Å; S13-R18 PolarHBondContact O-N 3.03Å; S13-D21 WeakPolarHBondContact OG-CB 3.38Å
14	E	98.2	Very high	98.1	Very high	70 Å²	70	66.5 Å²	66.5	33%	0.327	34%	0.341	S	S	.	.	H	α-helix	trans	-59.9	-49.4	174.4	-176.4	-179.6	-154.3	0	0	111.5	A10 K11 L12 A16 E17 M22 L43	A10-E14 PolarHBondContact O-N 2.83Å; K11-E14 PolarHBondContact O-N 3.2Å; L12-E14 VanDerWaalsContact C-N 3.35Å; E14-A16 PolarHBondContact O-N 3.29Å; E14-E17 PolarHBondContact O-N 3.32Å; E14-M22 HydrophobicContact CB-CE 3.89Å; E14-M22 HydrophobicContact CB-SD 3.91Å; E14-M22 HydrophobicContact CG-CE 4.1Å; E14-M22 HydrophobicContact CG-SD 4.32Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.35Å
15	Q	97.9	Very high	98.2	Very high	156 Å²	156	62.8 Å²	62.8	73%	0.729	32%	0.315	S	S	*	.	H	α-helix	trans	-62.1	-26.7	177.9	-69.9	174.8	34.7	0	0	113.2	K11 L12	K11-Q15 WeakPolarHBondContact O-CG 3.41Å; K11-Q15 PolarHBondContact O-N 2.97Å; K11-Q15 VanDerWaalsContact O-N 3.15Å; L12-Q15 PolarHBondContact O-N 3.49Å
16	A	98	Very high	98.3	Very high	62 Å²	62	57.8 Å²	57.8	51%	0.512	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	5	176.1	0	0	0	0	0	113.3	L12 S13 E14 R18	L12-A16 WeakPolarHBondContact O-CB 3.39Å; L12-A16 PolarHBondContact O-N 2.95Å; L12-A16 VanDerWaalsContact O-N 3.14Å; S13-A16 CarbonylContact O-C 3.46Å; S13-A16 PolarHBondContact O-N 3.11Å; E14-A16 PolarHBondContact O-N 3.29Å; A16-R18 HydrophobicContact CB-CG 4.09Å; A16-R18 PolarHBondContact O-N 3.14Å; A16-R18 VanDerWaalsContact O-N 3.09Å
17	E	97.8	Very high	98.3	Very high	145 Å²	145	59.8 Å²	59.8	68%	0.678	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	27.2	-175	-56.6	-173.2	151.9	0	0	113.8	S13 E14 Y19	S13-E17 PolarHBondContact O-N 3.39Å; E14-E17 PolarHBondContact O-N 3.32Å; E17-Y19 VanDerWaalsContact C-N 3.34Å; E17-Y19 HydrophobicContact CB-CE2 3.91Å; E17-Y19 HydrophobicContact CG-CE2 4.49Å; E17-Y19 WeakPolarHBondContact O-CD2 3.33Å; E17-Y19 PolarHBondContact O-N 3.2Å
18	R	98.3	Very high	98.3	Very high	143 Å²	143	60.7 Å²	60.7	54%	0.54	31%	0.309	S	S	.	.			trans	-91.1	68.1	177.5	-66.5	-160.3	64.1	-178.1	-11.9	110.5	S13 A16 D20 D21 M22	S13-R18 PolarHBondContact O-N 3.03Å; A16-R18 HydrophobicContact CB-CG 4.09Å; A16-R18 PolarHBondContact O-N 3.14Å; A16-R18 VanDerWaalsContact O-N 3.09Å; R18-D20 VanDerWaalsContact C-N 3.3Å; R18-D20 PolarHBondContact O-N 2.83Å; R18-D21 HydrophobicContact CB-CB 4.16Å; R18-D21 IonicContact CZ-OD1 3.65Å; R18-D21 IonicContact CZ-OD2 2.87Å; R18-D21 IonicContact NE-OD1 3.81Å; R18-D21 IonicContact NE-OD2 3.02Å; R18-D21 PolarHBondContact NE-OD2 3.44Å; R18-D21 IonicContact NH1-OD2 3.48Å; R18-D21 PolarHBondContact NH1-OD2 3.4Å; R18-D21 VanDerWaalsContact NH2-CG 3.3Å; R18-D21 IonicContact NH2-OD1 2.94Å; R18-D21 PolarHBondContact NH2-OD1 3.14Å; R18-D21 IonicContact NH2-OD2 2.91Å; R18-D21 PolarHBondContact NH2-OD2 3.47Å; R18-D21 WeakPolarHBondContact O-CB 3.36Å; R18-D21 PolarHBondContact O-N 3.02Å; R18-D21 VanDerWaalsContact O-N 3.08Å; R18-M22 PolarHBondContact O-N 3.17Å
19	Y	98.5	Very high	98.3	Very high	53 Å²	53	56 Å²	56	21%	0.208	29%	0.286	C	S	.	.	H	α-helix	trans	-65	-28.4	-171.9	-58.1	-70.7	0	0	0	114.4	E17 M22 A23 V46 N50 V51	E17-Y19 VanDerWaalsContact C-N 3.34Å; E17-Y19 HydrophobicContact CB-CE2 3.91Å; E17-Y19 HydrophobicContact CG-CE2 4.49Å; E17-Y19 WeakPolarHBondContact O-CD2 3.33Å; E17-Y19 PolarHBondContact O-N 3.2Å; Y19-M22 HydrophobicContact CD1-SD 4.01Å; Y19-M22 WeakPolarHBondContact O-CB 3.39Å; Y19-M22 PolarHBondContact O-N 3.23Å; Y19-A23 WeakPolarHBondContact O-CB 3.41Å; Y19-A23 PolarHBondContact O-N 2.91Å; Y19-V46 HydrophobicContact CE1-CG1 4.25Å; Y19-N50 HydrophobicContact CD1-CB 3.55Å; Y19-N50 HydrophobicContact CD2-CB 3.46Å; Y19-N50 VanDerWaalsContact CD2-CB 3.46Å; Y19-N50 HydrophobicContact CE1-CB 3.91Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.42Å; Y19-N50 HydrophobicContact CE2-CB 3.82Å; Y19-N50 HydrophobicContact CG-CB 3.29Å; Y19-V51 WeakPolarHBondContact O-CG2 3.33Å
20	D	98.2	Very high	98.3	Very high	85 Å²	85	51.4 Å²	51.4	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-64.5	-41.7	172.5	-60.9	-81.8	0	0	0	111.3	R18 M22 A23 A24 R55	R18-D20 VanDerWaalsContact C-N 3.3Å; R18-D20 PolarHBondContact O-N 2.83Å; D20-M22 VanDerWaalsContact C-N 3.33Å; D20-A23 PolarHBondContact O-N 2.94Å; D20-A24 PolarHBondContact O-N 3.04Å; D20-R55 IonicContact OD1-CZ 3.71Å; D20-R55 IonicContact OD1-NH1 3.58Å; D20-R55 PolarHBondContact OD1-NH1 3.48Å; D20-R55 IonicContact OD1-NH2 2.84Å; D20-R55 IonicContact OD2-NH1 3.29Å
21	D	98.4	Very high	98.3	Very high	48 Å²	48	55.5 Å²	55.5	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-68.2	-35.8	175.5	-65.4	7.9	0	0	0	111.3	S13 R18 S25	S13-D21 WeakPolarHBondContact OG-CB 3.38Å; R18-D21 HydrophobicContact CB-CB 4.16Å; R18-D21 IonicContact CZ-OD1 3.65Å; R18-D21 IonicContact CZ-OD2 2.87Å; R18-D21 IonicContact NE-OD1 3.81Å; R18-D21 IonicContact NE-OD2 3.02Å; R18-D21 PolarHBondContact NE-OD2 3.44Å; R18-D21 IonicContact NH1-OD2 3.48Å; R18-D21 PolarHBondContact NH1-OD2 3.4Å; R18-D21 VanDerWaalsContact NH2-CG 3.3Å; R18-D21 IonicContact NH2-OD1 2.94Å; R18-D21 PolarHBondContact NH2-OD1 3.14Å; R18-D21 IonicContact NH2-OD2 2.91Å; R18-D21 PolarHBondContact NH2-OD2 3.47Å; R18-D21 WeakPolarHBondContact O-CB 3.36Å; R18-D21 PolarHBondContact O-N 3.02Å; R18-D21 VanDerWaalsContact O-N 3.08Å; D21-S25 WeakPolarHBondContact O-CB 3.5Å; D21-S25 PolarHBondContact O-N 3.4Å; D21-S25 PolarHBondContact O-OG 3.09Å
22	M	98.4	Very high	98.2	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-46.7	174.6	-166.6	-170.5	-179	0	0	110.5	A10 E14 R18 Y19 D20 S25 M26 L43 V46 A47	A10-M22 HydrophobicContact CB-CG 4.09Å; E14-M22 HydrophobicContact CB-CE 3.89Å; E14-M22 HydrophobicContact CB-SD 3.91Å; E14-M22 HydrophobicContact CG-CE 4.1Å; E14-M22 HydrophobicContact CG-SD 4.32Å; R18-M22 PolarHBondContact O-N 3.17Å; Y19-M22 HydrophobicContact CD1-SD 4.01Å; Y19-M22 WeakPolarHBondContact O-CB 3.39Å; Y19-M22 PolarHBondContact O-N 3.23Å; D20-M22 VanDerWaalsContact C-N 3.33Å; M22-S25 PolarHBondContact O-N 3.35Å; M22-M26 WeakPolarHBondContact O-CB 3.34Å; M22-M26 WeakPolarHBondContact O-CG 3.5Å; M22-M26 PolarHBondContact O-N 3.11Å; M22-L43 HydrophobicContact CE-CB 3.93Å; M22-L43 HydrophobicContact CE-CD2 3.48Å; M22-L43 VanDerWaalsContact CE-CD2 3.48Å; M22-L43 HydrophobicContact CE-CG 4.33Å; M22-L43 WeakPolarHBondContact CE-O 3.41Å; M22-V46 HydrophobicContact CE-CB 4.1Å; M22-V46 HydrophobicContact CE-CG1 4.02Å; M22-V46 HydrophobicContact SD-CG1 4.22Å; M22-A47 HydrophobicContact CB-CB 3.92Å; M22-A47 HydrophobicContact CE-CB 4.31Å; M22-A47 HydrophobicContact CG-CB 3.62Å; M22-A47 HydrophobicContact SD-CB 3.63Å
23	A	98.6	Very high	98.1	Very high	7 Å²	7	54.9 Å²	54.9	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-44.5	178.4	0	0	0	0	0	111.1	Y19 D20 S25 M26 K27 A47 Y48 V51	Y19-A23 WeakPolarHBondContact O-CB 3.41Å; Y19-A23 PolarHBondContact O-N 2.91Å; D20-A23 PolarHBondContact O-N 2.94Å; A23-S25 VanDerWaalsContact C-N 3.32Å; A23-S25 PolarHBondContact O-N 3.11Å; A23-M26 PolarHBondContact O-N 3.29Å; A23-K27 WeakPolarHBondContact O-CB 3.34Å; A23-K27 PolarHBondContact O-N 3.2Å; A23-A47 HydrophobicContact CB-CB 4.1Å; A23-Y48 HydrophobicContact CB-CD1 4.5Å; A23-Y48 HydrophobicContact CB-CD2 4.3Å; A23-Y48 HydrophobicContact CB-CE1 4.33Å; A23-Y48 HydrophobicContact CB-CE2 4.1Å; A23-Y48 HydrophobicContact CB-CG 4.49Å; A23-V51 HydrophobicContact CB-CG2 4.29Å
24	A	98.4	Very high	97.9	Very high	62 Å²	62	57 Å²	57	51%	0.512	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-40.1	175.8	0	0	0	0	0	112.7	D20 A28	D20-A24 PolarHBondContact O-N 3.04Å; A24-A28 PolarHBondContact O-N 2.85Å
25	S	98.5	Very high	97.8	Very high	3 Å²	3	57 Å²	57	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-69.7	-45.7	178.5	-54.1	0	0	0	0	111.3	K9 D21 M22 A23 A28 V29	K9-S25 WeakPolarHBondContact CD-OG 3.47Å; D21-S25 WeakPolarHBondContact O-CB 3.5Å; D21-S25 PolarHBondContact O-N 3.4Å; D21-S25 PolarHBondContact O-OG 3.09Å; M22-S25 PolarHBondContact O-N 3.35Å; A23-S25 VanDerWaalsContact C-N 3.32Å; A23-S25 PolarHBondContact O-N 3.11Å; S25-A28 PolarHBondContact O-N 2.86Å; S25-V29 WeakPolarHBondContact O-CG2 3.49Å; S25-V29 PolarHBondContact O-N 2.92Å
26	M	98.6	Very high	97.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-70.2	-33.1	179.4	-70.1	-51.9	-51.6	0	0	113	A10 M22 A23 V29 T30 E40 L43 L44	A10-M26 HydrophobicContact CB-CG 3.74Å; A10-M26 HydrophobicContact CB-SD 3.54Å; A10-M26 VanDerWaalsContact CB-SD 3.54Å; M22-M26 WeakPolarHBondContact O-CB 3.34Å; M22-M26 WeakPolarHBondContact O-CG 3.5Å; M22-M26 PolarHBondContact O-N 3.11Å; A23-M26 PolarHBondContact O-N 3.29Å; M26-V29 HydrophobicContact CE-CB 4.18Å; M26-V29 HydrophobicContact CE-CG1 4.17Å; M26-V29 HydrophobicContact CE-CG2 4.49Å; M26-V29 WeakPolarHBondContact O-CB 3.46Å; M26-V29 PolarHBondContact O-N 2.92Å; M26-V29 HydrophobicContact SD-CG2 4.39Å; M26-T30 PolarHBondContact O-N 3.09Å; M26-T30 PolarHBondContact O-OG1 2.82Å; M26-T30 VanDerWaalsContact O-OG1 3.11Å; M26-E40 HydrophobicContact CE-CB 4.19Å; M26-E40 WeakPolarHBondContact CE-O 3.46Å; M26-L43 HydrophobicContact CE-CB 4.12Å; M26-L43 HydrophobicContact CG-CB 4.16Å; M26-L43 HydrophobicContact SD-CB 3.82Å; M26-L43 HydrophobicContact SD-CD1 4.31Å; M26-L44 HydrophobicContact CB-CB 4.26Å; M26-L44 HydrophobicContact CB-CD1 3.69Å; M26-L44 HydrophobicContact CE-CB 4.21Å
27	K	98.5	Very high	97.8	Very high	59 Å²	59	49.4 Å²	49.4	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-56.1	-50.7	168.7	172.7	167.4	-179.7	177.2	0	111.1	A23 V29 T30 E31 D96 L100	A23-K27 WeakPolarHBondContact O-CB 3.34Å; A23-K27 PolarHBondContact O-N 3.2Å; K27-V29 VanDerWaalsContact C-N 3.27Å; K27-V29 PolarHBondContact O-N 2.99Å; K27-T30 PolarHBondContact O-N 3.24Å; K27-T30 VanDerWaalsContact O-N 3.12Å; K27-E31 WeakPolarHBondContact CE-OE1 3.4Å; K27-E31 HydrophobicContact CG-CG 4.37Å; K27-E31 WeakPolarHBondContact O-CG 3.36Å; K27-E31 PolarHBondContact O-N 2.71Å; K27-D96 WeakPolarHBondContact CE-OD1 3.16Å; K27-D96 IonicContact NZ-OD1 2.75Å; K27-D96 PolarHBondContact NZ-OD1 3.05Å; K27-D96 IonicContact NZ-OD2 3.86Å; K27-L100 HydrophobicContact CB-CD1 4.06Å; K27-L100 HydrophobicContact CG-CD1 4.03Å; K27-L100 HydrophobicContact CG-CD2 4.09Å
28	A	98.3	Very high	97.7	Very high	32 Å²	32	46.7 Å²	46.7	26%	0.264	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-36	177.8	0	0	0	0	0	112.1	L6 A24 S25 L32	L6-A28 HydrophobicContact CD1-CB 3.82Å; L6-A28 HydrophobicContact CD2-CB 3.91Å; A24-A28 PolarHBondContact O-N 2.85Å; S25-A28 PolarHBondContact O-N 2.86Å; A28-L32 WeakPolarHBondContact O-CG 3.48Å; A28-L32 PolarHBondContact O-N 3.44Å
29	V	98.4	Very high	97.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-47.8	172.5	172.6	0	0	0	0	111.2	K3 L6 V7 S25 M26 K27 E31 L32 L36	K3-V29 HydrophobicContact CD-CG1 4.46Å; K3-V29 HydrophobicContact CG-CG1 4.03Å; L6-V29 HydrophobicContact CB-CG2 3.41Å; L6-V29 VanDerWaalsContact CB-CG2 3.41Å; L6-V29 HydrophobicContact CD1-CG2 4.11Å; L6-V29 HydrophobicContact CG-CG2 4.38Å; V7-V29 HydrophobicContact CG2-CG1 4.27Å; V7-V29 HydrophobicContact CG2-CG2 3.87Å; S25-V29 WeakPolarHBondContact O-CG2 3.49Å; S25-V29 PolarHBondContact O-N 2.92Å; M26-V29 HydrophobicContact CE-CB 4.18Å; M26-V29 HydrophobicContact CE-CG1 4.17Å; M26-V29 HydrophobicContact CE-CG2 4.49Å; M26-V29 WeakPolarHBondContact O-CB 3.46Å; M26-V29 PolarHBondContact O-N 2.92Å; M26-V29 HydrophobicContact SD-CG2 4.39Å; K27-V29 VanDerWaalsContact C-N 3.27Å; K27-V29 PolarHBondContact O-N 2.99Å; V29-E31 VanDerWaalsContact C-N 3.34Å; V29-E31 PolarHBondContact O-N 2.84Å; V29-L32 WeakPolarHBondContact O-CB 3.4Å; V29-L32 PolarHBondContact O-N 2.95Å; V29-L36 HydrophobicContact CG1-CD2 3.77Å
30	T	98.3	Very high	97.6	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-39.2	179.8	-61.6	0	0	0	0	112.2	M26 K27 L32 G33 L100 Y104 L105	M26-T30 PolarHBondContact O-N 3.09Å; M26-T30 PolarHBondContact O-OG1 2.82Å; M26-T30 VanDerWaalsContact O-OG1 3.11Å; K27-T30 PolarHBondContact O-N 3.24Å; K27-T30 VanDerWaalsContact O-N 3.12Å; T30-L32 PolarHBondContact O-N 2.99Å; T30-G33 PolarHBondContact O-N 3.27Å; T30-L100 HydrophobicContact CG2-CB 4.13Å; T30-L100 HydrophobicContact CG2-CD2 4.05Å; T30-L100 HydrophobicContact CG2-CG 4.49Å; T30-Y104 HydrophobicContact CG2-CD2 4.38Å; T30-Y104 HydrophobicContact CG2-CG 4.24Å; T30-L105 HydrophobicContact CG2-CD1 4.1Å; T30-L105 HydrophobicContact CG2-CD2 3.61Å; T30-L105 HydrophobicContact CG2-CG 3.73Å
31	E	97.9	Very high	97.6	Very high	87 Å²	87	40 Å²	40	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-69.8	-11.5	-179.9	-71.6	177.5	155	0	0	113.8	K27 V29 G33 L100 Y104	K27-E31 WeakPolarHBondContact CE-OE1 3.4Å; K27-E31 HydrophobicContact CG-CG 4.37Å; K27-E31 WeakPolarHBondContact O-CG 3.36Å; K27-E31 PolarHBondContact O-N 2.71Å; V29-E31 VanDerWaalsContact C-N 3.34Å; V29-E31 PolarHBondContact O-N 2.84Å; E31-G33 PolarHBondContact O-N 3.21Å; E31-L100 HydrophobicContact CG-CD2 3.84Å; E31-Y104 HydrophobicContact CG-CE2 3.88Å
32	L	96.5	Very high	97.6	Very high	98 Å²	98	41.3 Å²	41.3	51%	0.513	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-16.6	167.7	-61.5	176	0	0	0	112.5	K3 A28 V29 T30 A34	K3-L32 HydrophobicContact CB-CD1 3.69Å; K3-L32 HydrophobicContact CD-CD1 4.49Å; K3-L32 HydrophobicContact CG-CD1 3.94Å; A28-L32 WeakPolarHBondContact O-CG 3.48Å; A28-L32 PolarHBondContact O-N 3.44Å; V29-L32 WeakPolarHBondContact O-CB 3.4Å; V29-L32 PolarHBondContact O-N 2.95Å; T30-L32 PolarHBondContact O-N 2.99Å; L32-A34 VanDerWaalsContact C-N 3.31Å; L32-A34 PolarHBondContact O-N 3.46Å
33	G	95	Very high	97.6	Very high	32 Å²	32	41.8 Å²	41.8	33%	0.33	24%	0.243	S	C	.	.			trans	80	1.5	171	0	0	0	0	0	116	T30 E31 N108	T30-G33 PolarHBondContact O-N 3.27Å; E31-G33 PolarHBondContact O-N 3.21Å; G33-N108 PolarHBondContact O-ND2 3.01Å
34	A	95.1	Very high	97.6	Very high	54 Å²	54	41.5 Å²	41.5	45%	0.446	24%	0.241	S	C	.	.	S	Bend	trans	-80.1	146.2	170.6	0	0	0	0	0	110.8	L32 L36	L32-A34 VanDerWaalsContact C-N 3.31Å; L32-A34 PolarHBondContact O-N 3.46Å; A34-L36 PolarHBondContact O-N 3.46Å
35	E	97.2	Very high	97.6	Very high	68 Å²	68	40 Å²	40	32%	0.318	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-57.5	134.3	171.3	-173.4	168.7	-158.2	0	0	110.3	A109 T110 P111	E35-A109 WeakPolarHBondContact OE1-CA 3.43Å; E35-T110 PolarHBondContact OE1-N 3.43Å; E35-T110 PolarHBondContact OE1-OG1 3.49Å; E35-T110 WeakPolarHBondContact OE2-CG2 3.41Å; E35-T110 PolarHBondContact OE2-OG1 3.31Å; E35-P111 WeakPolarHBondContact OE1-CD 3.44Å
36	L	98	Very high	97.6	Very high	7 Å²	7	42 Å²	42	4%	0.037	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-78.3	142.5	-179.6	-59.9	-171.9	0	0	0	110.8	V29 A34 E40 R41 L44 L105	V29-L36 HydrophobicContact CG1-CD2 3.77Å; A34-L36 PolarHBondContact O-N 3.46Å; L36-E40 WeakPolarHBondContact CA-OE2 3.43Å; L36-E40 HydrophobicContact CB-CB 3.96Å; L36-E40 HydrophobicContact CD2-CB 4.24Å; L36-E40 HydrophobicContact CG-CB 4.46Å; L36-R41 HydrophobicContact CB-CB 4.38Å; L36-L44 HydrophobicContact CD1-CD2 4.14Å; L36-L105 HydrophobicContact CD1-CD2 3.63Å; L36-L105 HydrophobicContact CG-CD2 3.85Å
37	S	97.1	Very high	97.6	Very high	53 Å²	53	42 Å²	42	37%	0.371	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-67	165.8	165.9	76.8	0	0	0	0	111	E39 E40 R41	S37-E39 PolarHBondContact O-N 3.46Å; S37-E39 PolarHBondContact OG-N 3.27Å; S37-E40 PolarHBondContact N-OE2 3.07Å; S37-E40 PolarHBondContact O-N 3.02Å; S37-E40 WeakPolarHBondContact OG-CG 3.35Å; S37-E40 PolarHBondContact OG-N 3.4Å; S37-R41 VanDerWaalsContact O-CB 3.29Å; S37-R41 WeakPolarHBondContact O-CB 3.45Å; S37-R41 PolarHBondContact O-N 3.37Å
38	N	95.3	Very high	97.6	Very high	88 Å²	88	39.3 Å²	39.3	47%	0.471	23%	0.227	S	C	.	.	H	α-helix	trans	-56.8	-39	175.1	-74.5	-14	0	0	0	112.4	R41 N42	N38-R41 PolarHBondContact OD1-NH1 2.69Å; N38-N42 WeakPolarHBondContact O-CB 3.4Å; N38-N42 PolarHBondContact O-N 3.12Å; N38-N42 PolarHBondContact O-ND2 2.93Å; N38-N42 PolarHBondContact O-OD1 2.81Å
39	E	97	Very high	97.6	Very high	105 Å²	105	44.2 Å²	44.2	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-65.1	-48.4	176.8	-174.6	-178.2	-155.1	0	0	111.2	K11 S37 R41 N42 L43	K11-E39 WeakPolarHBondContact CE-OE1 3.48Å; K11-E39 IonicContact NZ-OE1 2.64Å; K11-E39 PolarHBondContact NZ-OE1 2.84Å; K11-E39 IonicContact NZ-OE2 2.96Å; K11-E39 PolarHBondContact NZ-OE2 3.37Å; S37-E39 PolarHBondContact O-N 3.46Å; S37-E39 PolarHBondContact OG-N 3.27Å; E39-R41 PolarHBondContact O-N 3.36Å; E39-N42 PolarHBondContact O-N 3.14Å; E39-L43 HydrophobicContact CG-CD1 4.39Å; E39-L43 WeakPolarHBondContact O-CG 3.38Å; E39-L43 PolarHBondContact O-N 3.02Å
40	E	98.2	Very high	97.6	Very high	24 Å²	24	47 Å²	47	11%	0.112	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-41.8	-180	-68.8	165.9	168.5	0	0	111.8	K3 V7 M26 L36 S37 N42 L43 L44	K3-E40 WeakPolarHBondContact CE-OE1 3.5Å; K3-E40 VanDerWaalsContact CE-OE2 3.27Å; K3-E40 WeakPolarHBondContact CE-OE2 3.31Å; K3-E40 IonicContact NZ-OE1 3.97Å; K3-E40 PolarHBondContact NZ-OE1 3.25Å; K3-E40 IonicContact NZ-OE2 2.64Å; K3-E40 PolarHBondContact NZ-OE2 3Å; V7-E40 HydrophobicContact CG2-CG 3.97Å; M26-E40 HydrophobicContact CE-CB 4.19Å; M26-E40 WeakPolarHBondContact CE-O 3.46Å; L36-E40 WeakPolarHBondContact CA-OE2 3.43Å; L36-E40 HydrophobicContact CB-CB 3.96Å; L36-E40 HydrophobicContact CD2-CB 4.24Å; L36-E40 HydrophobicContact CG-CB 4.46Å; S37-E40 PolarHBondContact N-OE2 3.07Å; S37-E40 PolarHBondContact O-N 3.02Å; S37-E40 WeakPolarHBondContact OG-CG 3.35Å; S37-E40 PolarHBondContact OG-N 3.4Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 2.53Å; E40-L43 PolarHBondContact O-N 2.82Å; E40-L44 PolarHBondContact O-N 3.32Å
41	R	97.9	Very high	97.6	Very high	12 Å²	12	47.2 Å²	47.2	5%	0.045	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-44.6	173.7	-179.9	-170.7	75.6	-166.7	-2.5	111.4	L36 S37 N38 E39 L44 S45 F117 Y118	L36-R41 HydrophobicContact CB-CB 4.38Å; S37-R41 VanDerWaalsContact O-CB 3.29Å; S37-R41 WeakPolarHBondContact O-CB 3.45Å; S37-R41 PolarHBondContact O-N 3.37Å; N38-R41 PolarHBondContact OD1-NH1 2.69Å; E39-R41 PolarHBondContact O-N 3.36Å; R41-L44 PolarHBondContact O-N 3Å; R41-S45 PolarHBondContact O-N 3.45Å; R41-F117 VanDerWaalsContact CD-CD1 3.43Å; R41-F117 HydrophobicContact CG-CD1 3.58Å; R41-F117 HydrophobicContact CG-CE1 3.45Å; R41-F117 VanDerWaalsContact CG-CE1 3.45Å; R41-F117 HydrophobicContact CG-CG 4.19Å; R41-F117 HydrophobicContact CG-CZ 3.95Å; R41-Y118 HydrophobicContact CG-CE1 3.64Å
42	N	97.2	Very high	97.6	Very high	75 Å²	75	43.1 Å²	43.1	40%	0.401	24%	0.24	S	C	.	.	H	α-helix	trans	-66	-41.6	178.6	-71.2	-9.6	0	0	0	111.3	N38 E39 E40 L44 S45 V46	N38-N42 WeakPolarHBondContact O-CB 3.4Å; N38-N42 PolarHBondContact O-N 3.12Å; N38-N42 PolarHBondContact O-ND2 2.93Å; N38-N42 PolarHBondContact O-OD1 2.81Å; E39-N42 PolarHBondContact O-N 3.14Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 2.53Å; N42-L44 PolarHBondContact O-N 3.1Å; N42-S45 WeakPolarHBondContact O-CB 3.49Å; N42-S45 PolarHBondContact O-N 2.7Å; N42-V46 WeakPolarHBondContact O-CG2 3.42Å; N42-V46 PolarHBondContact O-N 3.11Å
43	L	98.5	Very high	97.7	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-46.6	174.2	-71.4	169.5	0	0	0	111.7	V7 K11 E14 M22 M26 E39 E40 S45 V46 A47	V7-L43 HydrophobicContact CG1-CD1 3.97Å; K11-L43 HydrophobicContact CG-CD1 4.04Å; K11-L43 HydrophobicContact CG-CD2 4.18Å; E14-L43 WeakPolarHBondContact OE2-CD2 3.35Å; M22-L43 HydrophobicContact CE-CB 3.93Å; M22-L43 HydrophobicContact CE-CD2 3.48Å; M22-L43 VanDerWaalsContact CE-CD2 3.48Å; M22-L43 HydrophobicContact CE-CG 4.33Å; M22-L43 WeakPolarHBondContact CE-O 3.41Å; M26-L43 HydrophobicContact CE-CB 4.12Å; M26-L43 HydrophobicContact CG-CB 4.16Å; M26-L43 HydrophobicContact SD-CB 3.82Å; M26-L43 HydrophobicContact SD-CD1 4.31Å; E39-L43 HydrophobicContact CG-CD1 4.39Å; E39-L43 WeakPolarHBondContact O-CG 3.38Å; E39-L43 PolarHBondContact O-N 3.02Å; E40-L43 PolarHBondContact O-N 2.82Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 3.48Å; L43-V46 PolarHBondContact O-N 3.12Å; L43-A47 WeakPolarHBondContact O-CB 3.47Å; L43-A47 PolarHBondContact O-N 3.11Å
44	L	98.7	Very high	97.8	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-44.8	175.7	-179.8	74	0	0	0	111.3	M26 L36 E40 R41 N42 A47 Y48 L100 L105	M26-L44 HydrophobicContact CB-CB 4.26Å; M26-L44 HydrophobicContact CB-CD1 3.69Å; M26-L44 HydrophobicContact CE-CB 4.21Å; L36-L44 HydrophobicContact CD1-CD2 4.14Å; E40-L44 PolarHBondContact O-N 3.32Å; R41-L44 PolarHBondContact O-N 3Å; N42-L44 PolarHBondContact O-N 3.1Å; L44-A47 PolarHBondContact O-N 2.91Å; L44-Y48 HydrophobicContact CD1-CD2 3.68Å; L44-Y48 HydrophobicContact CD1-CE2 3.52Å; L44-Y48 HydrophobicContact CG-CD2 4.25Å; L44-Y48 PolarHBondContact O-N 3.21Å; L44-Y48 VanDerWaalsContact O-N 3.16Å; L44-L100 HydrophobicContact CD1-CD1 4.4Å; L44-L105 HydrophobicContact CD2-CD1 3.45Å; L44-L105 VanDerWaalsContact CD2-CD1 3.45Å; L44-L105 HydrophobicContact CD2-CD2 4.47Å
45	S	98.4	Very high	98	Very high	30 Å²	30	40.6 Å²	40.6	21%	0.21	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-48.5	179.4	-169.7	0	0	0	0	112.1	R41 N42 L43 A47 K49	R41-S45 PolarHBondContact O-N 3.45Å; N42-S45 WeakPolarHBondContact O-CB 3.49Å; N42-S45 PolarHBondContact O-N 2.7Å; L43-S45 VanDerWaalsContact C-N 3.29Å; L43-S45 PolarHBondContact O-N 3.48Å; S45-A47 VanDerWaalsContact C-N 3.33Å; S45-A47 PolarHBondContact O-N 3.29Å; S45-K49 WeakPolarHBondContact O-CB 3.37Å; S45-K49 PolarHBondContact O-N 3.33Å
46	V	98.4	Very high	98	Very high	45 Å²	45	38.9 Å²	38.9	27%	0.273	21%	0.21	S	C	.	.	H	α-helix	trans	-59.8	-44	177.6	169.4	0	0	0	0	111	Y19 M22 N42 L43 N50	Y19-V46 HydrophobicContact CE1-CG1 4.25Å; M22-V46 HydrophobicContact CE-CB 4.1Å; M22-V46 HydrophobicContact CE-CG1 4.02Å; M22-V46 HydrophobicContact SD-CG1 4.22Å; N42-V46 WeakPolarHBondContact O-CG2 3.42Å; N42-V46 PolarHBondContact O-N 3.11Å; L43-V46 PolarHBondContact O-N 3.12Å; V46-N50 PolarHBondContact O-N 3.27Å; V46-N50 VanDerWaalsContact O-N 3.14Å; V46-N50 PolarHBondContact O-ND2 3.23Å
47	A	98.7	Very high	98	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-61.7	179.6	0	0	0	0	0	111.6	M22 A23 L43 L44 S45 K49 N50 V51	M22-A47 HydrophobicContact CB-CB 3.92Å; M22-A47 HydrophobicContact CE-CB 4.31Å; M22-A47 HydrophobicContact CG-CB 3.62Å; M22-A47 HydrophobicContact SD-CB 3.63Å; A23-A47 HydrophobicContact CB-CB 4.1Å; L43-A47 WeakPolarHBondContact O-CB 3.47Å; L43-A47 PolarHBondContact O-N 3.11Å; L44-A47 PolarHBondContact O-N 2.91Å; S45-A47 VanDerWaalsContact C-N 3.33Å; S45-A47 PolarHBondContact O-N 3.29Å; A47-K49 PolarHBondContact O-N 3.35Å; A47-N50 PolarHBondContact O-N 3.46Å; A47-V51 WeakPolarHBondContact O-CG2 3.42Å; A47-V51 PolarHBondContact O-N 3.16Å; A47-V51 VanDerWaalsContact O-N 3.12Å
48	Y	98.7	Very high	98.1	Very high	4 Å²	4	42 Å²	42	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-69.8	-32.4	-175.9	-79.4	-85.3	0	0	0	112.5	A23 L44 N50 V51 V52 I93 D96 V97 L100 Y125	A23-Y48 HydrophobicContact CB-CD1 4.5Å; A23-Y48 HydrophobicContact CB-CD2 4.3Å; A23-Y48 HydrophobicContact CB-CE1 4.33Å; A23-Y48 HydrophobicContact CB-CE2 4.1Å; A23-Y48 HydrophobicContact CB-CG 4.49Å; L44-Y48 HydrophobicContact CD1-CD2 3.68Å; L44-Y48 HydrophobicContact CD1-CE2 3.52Å; L44-Y48 HydrophobicContact CG-CD2 4.25Å; L44-Y48 PolarHBondContact O-N 3.21Å; L44-Y48 VanDerWaalsContact O-N 3.16Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 3.01Å; Y48-V51 PolarHBondContact O-N 3.46Å; Y48-V52 VanDerWaalsContact O-CB 3.3Å; Y48-V52 WeakPolarHBondContact O-CB 3.36Å; Y48-V52 WeakPolarHBondContact O-CG1 3.46Å; Y48-V52 PolarHBondContact O-N 2.99Å; Y48-I93 HydrophobicContact CD1-CG2 4.07Å; Y48-D96 HydrophobicContact CE1-CB 4.46Å; Y48-D96 PolarHBondContact OH-OD2 3.38Å; Y48-V97 HydrophobicContact CD1-CB 3.76Å; Y48-V97 HydrophobicContact CD1-CG1 4.44Å; Y48-V97 HydrophobicContact CD1-CG2 4.11Å; Y48-V97 HydrophobicContact CD2-CB 4.45Å; Y48-V97 HydrophobicContact CD2-CG2 3.98Å; Y48-V97 HydrophobicContact CE1-CB 3.85Å; Y48-V97 HydrophobicContact CE1-CG2 4.41Å; Y48-V97 HydrophobicContact CE2-CG2 4.3Å; Y48-V97 HydrophobicContact CG-CB 4.06Å; Y48-V97 HydrophobicContact CG-CG2 3.88Å; Y48-L100 HydrophobicContact CE2-CD1 4.01Å; Y48-L100 WeakPolarHBondContact OH-CD1 3.27Å; Y48-Y125 WeakPolarHBondContact CB-OH 3.34Å; Y48-Y125 PolarHBondContact O-OH 3.49Å
49	K	98.1	Very high	98.2	Very high	135 Å²	135	39.7 Å²	39.7	59%	0.587	22%	0.217	S	C	*	.	H	α-helix	trans	-58.9	-43.5	175.1	179.3	-176.5	175.5	-174.5	0	111.4	S45 A47 G53 Y125	S45-K49 WeakPolarHBondContact O-CB 3.37Å; S45-K49 PolarHBondContact O-N 3.33Å; A47-K49 PolarHBondContact O-N 3.35Å; K49-G53 WeakPolarHBondContact O-CA 3.37Å; K49-G53 PolarHBondContact O-N 3.08Å; K49-Y125 PolarHBondContact N-OH 3.22Å
50	N	98.4	Very high	98.2	Very high	58 Å²	58	39.5 Å²	39.5	31%	0.31	21%	0.212	S	C	.	.	H	α-helix	trans	-72.2	-43.9	179.5	-80.1	-72.9	0	0	0	112.1	Y19 V46 A47 Y48 V52 G53 A54	Y19-N50 HydrophobicContact CD1-CB 3.55Å; Y19-N50 HydrophobicContact CD2-CB 3.46Å; Y19-N50 VanDerWaalsContact CD2-CB 3.46Å; Y19-N50 HydrophobicContact CE1-CB 3.91Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.42Å; Y19-N50 HydrophobicContact CE2-CB 3.82Å; Y19-N50 HydrophobicContact CG-CB 3.29Å; V46-N50 PolarHBondContact O-N 3.27Å; V46-N50 VanDerWaalsContact O-N 3.14Å; V46-N50 PolarHBondContact O-ND2 3.23Å; A47-N50 PolarHBondContact O-N 3.46Å; Y48-N50 VanDerWaalsContact C-N 3.32Å; Y48-N50 PolarHBondContact O-N 3.01Å; N50-V52 PolarHBondContact O-N 3.36Å; N50-G53 PolarHBondContact O-N 3.21Å; N50-A54 PolarHBondContact O-N 3.39Å
51	V	98.4	Very high	98.2	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-48.9	178	175.5	0	0	0	0	111	Y19 A23 A47 Y48 R55 I93	Y19-V51 WeakPolarHBondContact O-CG2 3.33Å; A23-V51 HydrophobicContact CB-CG2 4.29Å; A47-V51 WeakPolarHBondContact O-CG2 3.42Å; A47-V51 PolarHBondContact O-N 3.16Å; A47-V51 VanDerWaalsContact O-N 3.12Å; Y48-V51 PolarHBondContact O-N 3.46Å; V51-R55 WeakPolarHBondContact O-CD 3.4Å; V51-R55 PolarHBondContact O-N 3.1Å; V51-I93 HydrophobicContact CG1-CD1 3.59Å; V51-I93 HydrophobicContact CG1-CG1 3.88Å; V51-I93 HydrophobicContact CG1-CG2 3.94Å
52	V	98.4	Very high	98.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-69.3	-37.8	179.4	94	0	0	0	0	111.4	Y48 N50 A54 R55 R56 L90 I93 Y125 Y128	Y48-V52 VanDerWaalsContact O-CB 3.3Å; Y48-V52 WeakPolarHBondContact O-CB 3.36Å; Y48-V52 WeakPolarHBondContact O-CG1 3.46Å; Y48-V52 PolarHBondContact O-N 2.99Å; N50-V52 PolarHBondContact O-N 3.36Å; V52-A54 PolarHBondContact O-N 2.9Å; V52-R55 PolarHBondContact O-N 3.24Å; V52-R56 WeakPolarHBondContact O-CG 3.42Å; V52-R56 PolarHBondContact O-N 3.43Å; V52-L90 HydrophobicContact CG2-CD1 3.36Å; V52-I93 HydrophobicContact CB-CG2 4.15Å; V52-I93 HydrophobicContact CG2-CG2 4.07Å; V52-Y125 HydrophobicContact CB-CE1 3.92Å; V52-Y125 HydrophobicContact CG1-CE1 3.86Å; V52-Y125 HydrophobicContact CG2-CD1 4.2Å; V52-Y125 HydrophobicContact CG2-CE1 3.9Å; V52-Y128 HydrophobicContact CG1-CD2 3.84Å; V52-Y128 HydrophobicContact CG1-CE2 3.71Å; V52-Y128 HydrophobicContact CG2-CD2 4.09Å
53	G	98	Very high	98.2	Very high	23 Å²	23	40.4 Å²	40.4	24%	0.237	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-44.1	177.8	0	0	0	0	0	112.3	K49 N50 R55 R56 S57	K49-G53 WeakPolarHBondContact O-CA 3.37Å; K49-G53 PolarHBondContact O-N 3.08Å; N50-G53 PolarHBondContact O-N 3.21Å; G53-R55 PolarHBondContact O-N 2.98Å; G53-R56 PolarHBondContact O-N 3.16Å; G53-S57 WeakPolarHBondContact O-CB 3.41Å; G53-S57 PolarHBondContact O-N 3.42Å; G53-S57 PolarHBondContact O-OG 3.06Å
54	A	98.2	Very high	98.1	Very high	50 Å²	50	41.9 Å²	41.9	41%	0.413	23%	0.233	S	C	.	.	H	α-helix	trans	-61.5	-42	176.7	0	0	0	0	0	112.5	N50 V52 S58	N50-A54 PolarHBondContact O-N 3.39Å; V52-A54 PolarHBondContact O-N 2.9Å; A54-S58 WeakPolarHBondContact O-CB 3.33Å; A54-S58 PolarHBondContact O-N 3.02Å; A54-S58 PolarHBondContact O-OG 2.83Å
55	R	98.3	Very high	98	Very high	58 Å²	58	45.4 Å²	45.4	22%	0.219	25%	0.252	C	S	.	.	H	α-helix	trans	-68.3	-42.6	177	-89.1	66.6	-176.1	-164.4	-1.7	111.6	D20 V51 V52 G53 S57 S58 W59 V86 E89 L90 I93	D20-R55 IonicContact OD1-CZ 3.71Å; D20-R55 IonicContact OD1-NH1 3.58Å; D20-R55 PolarHBondContact OD1-NH1 3.48Å; D20-R55 IonicContact OD1-NH2 2.84Å; D20-R55 IonicContact OD2-NH1 3.29Å; V51-R55 WeakPolarHBondContact O-CD 3.4Å; V51-R55 PolarHBondContact O-N 3.1Å; V52-R55 PolarHBondContact O-N 3.24Å; G53-R55 PolarHBondContact O-N 2.98Å; R55-S57 PolarHBondContact O-N 3.14Å; R55-S58 WeakPolarHBondContact O-CB 3.5Å; R55-S58 PolarHBondContact O-N 3Å; R55-W59 WeakPolarHBondContact O-CB 3.43Å; R55-W59 PolarHBondContact O-N 3.45Å; R55-V86 HydrophobicContact CB-CG1 4.43Å; R55-V86 WeakPolarHBondContact O-CG1 3.3Å; R55-E89 HydrophobicContact CG-CB 4.1Å; R55-E89 IonicContact CZ-OE2 3.72Å; R55-E89 IonicContact NE-OE2 2.64Å; R55-E89 PolarHBondContact NE-OE2 2.89Å; R55-E89 VanDerWaalsContact NE-OE2 3.16Å; R55-E89 IonicContact NH2-OE2 3.94Å; R55-L90 HydrophobicContact CB-CB 4.25Å; R55-L90 HydrophobicContact CB-CD1 4.1Å; R55-I93 HydrophobicContact CB-CD1 4.43Å; R55-I93 HydrophobicContact CG-CD1 3.83Å
56	R	97.9	Very high	97.9	Very high	32 Å²	32	44.8 Å²	44.8	12%	0.121	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-42.6	175.3	-72.9	178.8	67.5	-128.5	14.1	112.5	V52 G53 W59 R60 L90 Y128 E131	V52-R56 WeakPolarHBondContact O-CG 3.42Å; V52-R56 PolarHBondContact O-N 3.43Å; G53-R56 PolarHBondContact O-N 3.16Å; R56-W59 PolarHBondContact O-N 3.33Å; R56-R60 WeakPolarHBondContact O-CG 3.36Å; R56-R60 PolarHBondContact O-N 3.31Å; R56-L90 HydrophobicContact CG-CD1 3.73Å; R56-L90 HydrophobicContact CG-CD2 4.07Å; R56-Y128 VanDerWaalsContact CZ-CE1 3.49Å; R56-Y128 VanDerWaalsContact NE-CD1 3.3Å; R56-E131 IonicContact CZ-OE1 3.65Å; R56-E131 IonicContact CZ-OE2 3.98Å; R56-E131 VanDerWaalsContact CZ-OE2 3.3Å; R56-E131 IonicContact NE-OE1 3.21Å; R56-E131 PolarHBondContact NE-OE1 3.08Å; R56-E131 IonicContact NE-OE2 3.87Å; R56-E131 PolarHBondContact NE-OE2 3.23Å; R56-E131 IonicContact NH2-OE1 3.16Å; R56-E131 PolarHBondContact NH2-OE1 2.91Å; R56-E131 IonicContact NH2-OE2 2.98Å; R56-E131 PolarHBondContact NH2-OE2 3.06Å
57	S	98.2	Very high	97.7	Very high	69 Å²	69	49.3 Å²	49.3	48%	0.483	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-44.7	175.5	-66.6	0	0	0	0	111.6	G53 R55 W59 R60 V61	G53-S57 WeakPolarHBondContact O-CB 3.41Å; G53-S57 PolarHBondContact O-N 3.42Å; G53-S57 PolarHBondContact O-OG 3.06Å; R55-S57 PolarHBondContact O-N 3.14Å; S57-W59 PolarHBondContact O-N 3.48Å; S57-R60 PolarHBondContact O-N 3.27Å; S57-V61 WeakPolarHBondContact O-CG2 3.34Å; S57-V61 PolarHBondContact O-N 2.96Å
58	S	98.3	Very high	97.6	Very high	55 Å²	55	57.2 Å²	57.2	39%	0.385	30%	0.298	S	S	.	.	H	α-helix	trans	-59.3	-47.9	175.2	-58.6	0	0	0	0	110.9	A54 R55 R60 V61 I62	A54-S58 WeakPolarHBondContact O-CB 3.33Å; A54-S58 PolarHBondContact O-N 3.02Å; A54-S58 PolarHBondContact O-OG 2.83Å; R55-S58 WeakPolarHBondContact O-CB 3.5Å; R55-S58 PolarHBondContact O-N 3Å; S58-R60 PolarHBondContact O-N 3.28Å; S58-V61 PolarHBondContact O-N 3.06Å; S58-I62 VanDerWaalsContact O-CG1 3.29Å; S58-I62 WeakPolarHBondContact O-CG1 3.36Å; S58-I62 PolarHBondContact O-N 3.26Å
59	W	98.1	Very high	97.3	Very high	41 Å²	41	58.1 Å²	58.1	16%	0.155	30%	0.304	C	S	.	.	H	α-helix	trans	-56.9	-50	179	177.8	78.1	0	0	0	112	R55 R56 S57 V61 I62 S63 V86 E87 E131 V132	R55-W59 WeakPolarHBondContact O-CB 3.43Å; R55-W59 PolarHBondContact O-N 3.45Å; R56-W59 PolarHBondContact O-N 3.33Å; S57-W59 PolarHBondContact O-N 3.48Å; W59-V61 VanDerWaalsContact C-N 3.32Å; W59-V61 PolarHBondContact O-N 2.64Å; W59-I62 PolarHBondContact O-N 3.45Å; W59-S63 WeakPolarHBondContact O-CB 3.42Å; W59-S63 PolarHBondContact O-N 3.14Å; W59-S63 PolarHBondContact O-OG 3.41Å; W59-V86 HydrophobicContact CB-CG1 3.82Å; W59-E87 VanDerWaalsContact CD1-CG 3.41Å; W59-E87 VanDerWaalsContact NE1-CG 3.34Å; W59-E87 PolarHBondContact NE1-OE1 2.93Å; W59-E131 WeakPolarHBondContact CH2-O 3.39Å; W59-V132 HydrophobicContact CD2-CG1 3.8Å; W59-V132 HydrophobicContact CE3-CG1 4.27Å; W59-V132 HydrophobicContact CG-CG1 4.21Å; W59-V132 HydrophobicContact CH2-CG1 4.26Å; W59-V132 HydrophobicContact CZ2-CB 4.46Å; W59-V132 HydrophobicContact CZ2-CG1 3.8Å; W59-V132 HydrophobicContact CZ3-CG1 4.48Å
60	R	97.5	Very high	96.8	Very high	100 Å²	100	59.2 Å²	59.2	38%	0.377	31%	0.311	S	S	.	.	H	α-helix	trans	-56	-44.8	177.8	-74	-175.5	179.8	87.5	10.3	112.8	R56 S57 S58 S64 E131	R56-R60 WeakPolarHBondContact O-CG 3.36Å; R56-R60 PolarHBondContact O-N 3.31Å; S57-R60 PolarHBondContact O-N 3.27Å; S58-R60 PolarHBondContact O-N 3.28Å; R60-S64 PolarHBondContact O-N 2.89Å; R60-E131 IonicContact NH2-OE2 2.69Å; R60-E131 PolarHBondContact NH2-OE2 3.22Å
61	V	98.1	Very high	96.4	Very high	88 Å²	88	59.9 Å²	59.9	53%	0.533	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-47	179.5	171.8	0	0	0	0	110.5	S57 S58 W59 S64 I65	S57-V61 WeakPolarHBondContact O-CG2 3.34Å; S57-V61 PolarHBondContact O-N 2.96Å; S58-V61 PolarHBondContact O-N 3.06Å; W59-V61 VanDerWaalsContact C-N 3.32Å; W59-V61 PolarHBondContact O-N 2.64Å; V61-S64 PolarHBondContact O-N 2.73Å; V61-I65 HydrophobicContact CG1-CD1 3.92Å; V61-I65 WeakPolarHBondContact O-CG1 3.32Å; V61-I65 PolarHBondContact O-N 3.15Å
62	I	97.7	Very high	96.2	Very high	25 Å²	25	62.8 Å²	62.8	13%	0.128	35%	0.347	C	S	.	.	H	α-helix	trans	-68.7	-40.3	-178.2	-59.2	-56.5	0	0	0	111.4	S58 W59 S64 I65 E66 A79 Y82 R83	S58-I62 VanDerWaalsContact O-CG1 3.29Å; S58-I62 WeakPolarHBondContact O-CG1 3.36Å; S58-I62 PolarHBondContact O-N 3.26Å; W59-I62 PolarHBondContact O-N 3.45Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 2.84Å; I62-I65 HydrophobicContact CD1-CD1 4.18Å; I62-I65 PolarHBondContact O-N 3.32Å; I62-I65 VanDerWaalsContact O-N 3.11Å; I62-E66 PolarHBondContact O-N 3.12Å; I62-A79 VanDerWaalsContact CG2-O 3.24Å; I62-A79 WeakPolarHBondContact CG2-O 3.43Å; I62-Y82 HydrophobicContact CD1-CD1 3.57Å; I62-Y82 HydrophobicContact CD1-CE1 3.81Å; I62-Y82 HydrophobicContact CG1-CD1 3.63Å; I62-Y82 HydrophobicContact CG1-CE1 3.91Å; I62-Y82 HydrophobicContact CG2-CD1 4.11Å; I62-R83 HydrophobicContact CG2-CB 3.83Å
63	S	96.4	Very high	95.9	Very high	18 Å²	18	68.7 Å²	68.7	13%	0.126	38%	0.378	C	S	.	.	H	α-helix	trans	-58.6	-41.2	172.8	-62.6	0	0	0	0	111.8	W59 E66 Q67 R83	W59-S63 WeakPolarHBondContact O-CB 3.42Å; W59-S63 PolarHBondContact O-N 3.14Å; W59-S63 PolarHBondContact O-OG 3.41Å; S63-E66 PolarHBondContact O-N 2.91Å; S63-Q67 WeakPolarHBondContact O-CG 3.49Å; S63-Q67 PolarHBondContact O-N 3.4Å; S63-Q67 VanDerWaalsContact O-N 3.14Å; S63-R83 WeakPolarHBondContact OG-CD 3.19Å
64	S	97.2	Very high	95.8	Very high	39 Å²	39	75.3 Å²	75.3	27%	0.273	40%	0.401	S	S	.	.	H	α-helix	trans	-65.7	-38.4	174.3	-172.9	0	0	0	0	112.5	R60 V61 I62 K68	R60-S64 PolarHBondContact O-N 2.89Å; V61-S64 PolarHBondContact O-N 2.73Å; I62-S64 VanDerWaalsContact C-N 3.3Å; I62-S64 PolarHBondContact O-N 2.84Å; S64-K68 WeakPolarHBondContact O-CB 3.5Å; S64-K68 VanDerWaalsContact O-CG 3.31Å; S64-K68 WeakPolarHBondContact O-CG 3.36Å; S64-K68 PolarHBondContact O-N 3.33Å; S64-K68 PolarHBondContact OG-NZ 3.29Å; S64-K68 VanDerWaalsContact OG-NZ 3.14Å
65	I	97	Very high	95.7	Very high	76 Å²	76	80.7 Å²	80.7	39%	0.39	41%	0.41	S	S	.	.	H	α-helix	trans	-65.7	-45.2	175.7	-69.6	167	0	0	0	110.5	V61 I62 Q67 K68 T69 A79	V61-I65 HydrophobicContact CG1-CD1 3.92Å; V61-I65 WeakPolarHBondContact O-CG1 3.32Å; V61-I65 PolarHBondContact O-N 3.15Å; I62-I65 HydrophobicContact CD1-CD1 4.18Å; I62-I65 PolarHBondContact O-N 3.32Å; I62-I65 VanDerWaalsContact O-N 3.11Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 2.93Å; I65-K68 PolarHBondContact O-N 3.49Å; I65-K68 VanDerWaalsContact O-N 3.15Å; I65-T69 HydrophobicContact CG2-CG2 4.19Å; I65-T69 WeakPolarHBondContact O-CG2 3.21Å; I65-T69 PolarHBondContact O-N 2.89Å; I65-T69 PolarHBondContact O-OG1 3.4Å; I65-T69 VanDerWaalsContact O-OG1 3.06Å; I65-A79 HydrophobicContact CG2-CB 4.21Å
66	E	96.1	Very high	95.6	Very high	16 Å²	16	80.2 Å²	80.2	8%	0.075	41%	0.41	C	S	.	.	H	α-helix	trans	-54.4	-50	177.4	-175.4	-177.1	169.3	0	0	110.6	I62 S63 K68 T69 Q76 A79 R80 R83	I62-E66 PolarHBondContact O-N 3.12Å; S63-E66 PolarHBondContact O-N 2.91Å; E66-K68 PolarHBondContact O-N 3.49Å; E66-T69 PolarHBondContact O-N 2.94Å; E66-T69 PolarHBondContact O-OG1 3.44Å; E66-Q76 HydrophobicContact CG-CG 4.06Å; E66-A79 HydrophobicContact CB-CB 3.82Å; E66-A79 HydrophobicContact CG-CB 4.31Å; E66-R80 HydrophobicContact CG-CB 4.48Å; E66-R80 IonicContact OE1-CZ 3.25Å; E66-R80 VanDerWaalsContact OE1-CZ 3.25Å; E66-R80 IonicContact OE1-NE 2.92Å; E66-R80 PolarHBondContact OE1-NE 3.34Å; E66-R80 IonicContact OE1-NH2 3.69Å; E66-R80 PolarHBondContact OE1-NH2 2.84Å; E66-R83 WeakPolarHBondContact OE2-CD 3.36Å; E66-R83 IonicContact OE2-CZ 3.6Å; E66-R83 IonicContact OE2-NE 2.71Å; E66-R83 PolarHBondContact OE2-NE 3.06Å; E66-R83 IonicContact OE2-NH2 3.61Å
67	Q	94.8	Very high	95.5	Very high	141 Å²	141	83 Å²	83	66%	0.659	43%	0.425	S	S	*	.	H	α-helix	trans	-59.3	-45.3	176.8	-71	173.7	-7.9	0	0	112.3	S63 I65 T69 E70	S63-Q67 WeakPolarHBondContact O-CG 3.49Å; S63-Q67 PolarHBondContact O-N 3.4Å; S63-Q67 VanDerWaalsContact O-N 3.14Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 2.93Å; Q67-T69 PolarHBondContact O-N 2.69Å; Q67-E70 WeakPolarHBondContact O-CB 3.44Å; Q67-E70 PolarHBondContact O-N 3.42Å
68	K	95.7	Very high	95.5	Very high	165 Å²	165	85 Å²	85	72%	0.717	43%	0.428	S	S	*	.	H	α-helix	trans	-71.3	-13.6	-179.8	-72.7	169.2	179.7	160.7	0	114.2	S64 I65 E66	S64-K68 WeakPolarHBondContact O-CB 3.5Å; S64-K68 VanDerWaalsContact O-CG 3.31Å; S64-K68 WeakPolarHBondContact O-CG 3.36Å; S64-K68 PolarHBondContact O-N 3.33Å; S64-K68 PolarHBondContact OG-NZ 3.29Å; S64-K68 VanDerWaalsContact OG-NZ 3.14Å; I65-K68 PolarHBondContact O-N 3.49Å; I65-K68 VanDerWaalsContact O-N 3.15Å; E66-K68 PolarHBondContact O-N 3.49Å
69	T	92.6	Very high	95.4	Very high	23 Å²	23	82.9 Å²	82.9	14%	0.141	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	8.4	177.2	54.3	0	0	0	0	113.7	I65 E66 Q67 G71 N72 R75 Q76	I65-T69 HydrophobicContact CG2-CG2 4.19Å; I65-T69 WeakPolarHBondContact O-CG2 3.21Å; I65-T69 PolarHBondContact O-N 2.89Å; I65-T69 PolarHBondContact O-OG1 3.4Å; I65-T69 VanDerWaalsContact O-OG1 3.06Å; E66-T69 PolarHBondContact O-N 2.94Å; E66-T69 PolarHBondContact O-OG1 3.44Å; Q67-T69 PolarHBondContact O-N 2.69Å; T69-G71 PolarHBondContact O-N 3.15Å; T69-N72 PolarHBondContact O-N 3.39Å; T69-R75 HydrophobicContact CG2-CB 3.94Å; T69-Q76 VanDerWaalsContact OG1-CA 3.31Å; T69-Q76 WeakPolarHBondContact OG1-CA 3.48Å
70	E	87.1	Confident	95.4	Very high	159 Å²	159	85.7 Å²	85.7	74%	0.743	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	131.2	173.7	-169.8	171.9	-161.5	0	0	111.3	Q67	Q67-E70 WeakPolarHBondContact O-CB 3.44Å; Q67-E70 PolarHBondContact O-N 3.42Å
71	G	90.3	Very high	95.4	Very high	72 Å²	72	86 Å²	86	74%	0.742	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-5.7	-173.1	0	0	0	0	0	115.2	T69	T69-G71 PolarHBondContact O-N 3.15Å
72	N	93.4	Very high	95.4	Very high	67 Å²	67	87.6 Å²	87.6	36%	0.358	43%	0.427	S	S	.	.			trans	-116.4	84.3	167.1	-171	-40.7	0	0	0	110.3	T69 K74 R75 Q76	T69-N72 PolarHBondContact O-N 3.39Å; N72-K74 PolarHBondContact O-N 2.93Å; N72-K74 VanDerWaalsContact O-N 3.08Å; N72-R75 HydrophobicContact CB-CB 4.18Å; N72-R75 PolarHBondContact O-N 2.94Å; N72-R75 PolarHBondContact OD1-N 3.17Å; N72-R75 VanDerWaalsContact OD1-N 3.16Å; N72-Q76 WeakPolarHBondContact O-CB 3.39Å; N72-Q76 PolarHBondContact O-N 3.26Å
73	D	93.7	Very high	95.4	Very high	125 Å²	125	88.4 Å²	88.4	67%	0.668	43%	0.429	S	S	*	.	H	α-helix	trans	-48.1	-43.5	-173	-59	-8.1	0	0	0	113.2	Q77	D73-Q77 WeakPolarHBondContact O-CB 3.38Å; D73-Q77 PolarHBondContact O-N 3.44Å
74	K	95.8	Very high	95.5	Very high	162 Å²	162	91.6 Å²	91.6	70%	0.704	44%	0.442	S	S	*	.	H	α-helix	trans	-65.9	-45.6	-179.9	-174.6	177.4	-179.8	178.5	0	112	N72 M78	N72-K74 PolarHBondContact O-N 2.93Å; N72-K74 VanDerWaalsContact O-N 3.08Å; K74-M78 HydrophobicContact CG-SD 4.37Å; K74-M78 VanDerWaalsContact O-CG 3.26Å; K74-M78 WeakPolarHBondContact O-CG 3.45Å; K74-M78 PolarHBondContact O-N 3.48Å; K74-M78 VanDerWaalsContact O-N 3.11Å
75	R	94.7	Very high	95.5	Very high	164 Å²	164	95.1 Å²	95.1	62%	0.619	45%	0.452	S	S	*	.	H	α-helix	trans	-69.8	-39.9	179.5	-73.3	-174.2	177.1	176.8	-1.1	111.4	T69 N72 M78 A79	T69-R75 HydrophobicContact CG2-CB 3.94Å; N72-R75 HydrophobicContact CB-CB 4.18Å; N72-R75 PolarHBondContact O-N 2.94Å; N72-R75 PolarHBondContact OD1-N 3.17Å; N72-R75 VanDerWaalsContact OD1-N 3.16Å; R75-M78 PolarHBondContact O-N 3.35Å; R75-A79 WeakPolarHBondContact O-CB 3.47Å; R75-A79 PolarHBondContact O-N 3.16Å
76	Q	96.5	Very high	95.6	Very high	47 Å²	47	91.7 Å²	91.7	22%	0.22	44%	0.435	C	S	.	.	H	α-helix	trans	-62.9	-44.6	177.2	-168.8	177	33.9	0	0	111.3	E66 T69 N72 M78 A79 R80	E66-Q76 HydrophobicContact CG-CG 4.06Å; T69-Q76 VanDerWaalsContact OG1-CA 3.31Å; T69-Q76 WeakPolarHBondContact OG1-CA 3.48Å; N72-Q76 WeakPolarHBondContact O-CB 3.39Å; N72-Q76 PolarHBondContact O-N 3.26Å; Q76-M78 PolarHBondContact O-N 3.41Å; Q76-A79 PolarHBondContact O-N 3Å; Q76-R80 WeakPolarHBondContact O-CB 3.46Å; Q76-R80 PolarHBondContact O-N 2.95Å
77	Q	97	Very high	95.7	Very high	90 Å²	90	92 Å²	92	42%	0.421	44%	0.436	S	S	.	.	H	α-helix	trans	-61.2	-44.7	175.4	-177.4	60	27.3	0	0	112	D73 A79 R80 E81	D73-Q77 WeakPolarHBondContact O-CB 3.38Å; D73-Q77 PolarHBondContact O-N 3.44Å; Q77-A79 VanDerWaalsContact C-N 3.33Å; Q77-A79 PolarHBondContact O-N 3.28Å; Q77-R80 WeakPolarHBondContact O-CB 3.46Å; Q77-R80 PolarHBondContact O-N 3.37Å; Q77-E81 WeakPolarHBondContact CG-OE1 3.22Å; Q77-E81 PolarHBondContact NE2-OE1 3.3Å; Q77-E81 WeakPolarHBondContact O-CG 3.43Å; Q77-E81 PolarHBondContact O-N 2.97Å
78	M	97.3	Very high	95.8	Very high	113 Å²	113	88.8 Å²	88.8	56%	0.557	43%	0.426	S	S	*	.	H	α-helix	trans	-61.8	-40.5	176.3	-71.5	174.6	66.6	0	0	112.4	K74 R75 Q76 Y82	K74-M78 HydrophobicContact CG-SD 4.37Å; K74-M78 VanDerWaalsContact O-CG 3.26Å; K74-M78 WeakPolarHBondContact O-CG 3.45Å; K74-M78 PolarHBondContact O-N 3.48Å; K74-M78 VanDerWaalsContact O-N 3.11Å; R75-M78 PolarHBondContact O-N 3.35Å; Q76-M78 PolarHBondContact O-N 3.41Å; M78-Y82 WeakPolarHBondContact O-CB 3.39Å; M78-Y82 PolarHBondContact O-N 3.46Å
79	A	97.3	Very high	95.9	Very high	10 Å²	10	83.9 Å²	83.9	8%	0.083	41%	0.406	C	S	.	.	H	α-helix	trans	-65.9	-42.1	177	0	0	0	0	0	111.4	I62 I65 E66 R75 Q76 Q77 Y82 R83	I62-A79 VanDerWaalsContact CG2-O 3.24Å; I62-A79 WeakPolarHBondContact CG2-O 3.43Å; I65-A79 HydrophobicContact CG2-CB 4.21Å; E66-A79 HydrophobicContact CB-CB 3.82Å; E66-A79 HydrophobicContact CG-CB 4.31Å; R75-A79 WeakPolarHBondContact O-CB 3.47Å; R75-A79 PolarHBondContact O-N 3.16Å; Q76-A79 PolarHBondContact O-N 3Å; Q77-A79 VanDerWaalsContact C-N 3.33Å; Q77-A79 PolarHBondContact O-N 3.28Å; A79-Y82 PolarHBondContact O-N 3.35Å; A79-R83 WeakPolarHBondContact O-CB 3.48Å; A79-R83 PolarHBondContact O-N 2.99Å
80	R	97.2	Very high	96.2	Very high	100 Å²	100	82.8 Å²	82.8	38%	0.377	40%	0.399	S	S	.	.	H	α-helix	trans	-59.8	-52.1	175.6	176.4	171.9	-62.3	-136.1	-2	112.7	E66 Q76 Q77 Y82 R83 E84	E66-R80 HydrophobicContact CG-CB 4.48Å; E66-R80 IonicContact OE1-CZ 3.25Å; E66-R80 VanDerWaalsContact OE1-CZ 3.25Å; E66-R80 IonicContact OE1-NE 2.92Å; E66-R80 PolarHBondContact OE1-NE 3.34Å; E66-R80 IonicContact OE1-NH2 3.69Å; E66-R80 PolarHBondContact OE1-NH2 2.84Å; Q76-R80 WeakPolarHBondContact O-CB 3.46Å; Q76-R80 PolarHBondContact O-N 2.95Å; Q77-R80 WeakPolarHBondContact O-CB 3.46Å; Q77-R80 PolarHBondContact O-N 3.37Å; R80-Y82 PolarHBondContact O-N 3.01Å; R80-R83 WeakPolarHBondContact O-CB 3.24Å; R80-R83 PolarHBondContact O-N 3.02Å; R80-R83 VanDerWaalsContact O-N 3.09Å; R80-E84 WeakPolarHBondContact CG-OE1 3.05Å; R80-E84 WeakPolarHBondContact O-CG 3.44Å; R80-E84 PolarHBondContact O-N 3.47Å
81	E	97.9	Very high	96.7	Very high	107 Å²	107	77.8 Å²	77.8	50%	0.5	38%	0.376	S	S	.	.	H	α-helix	trans	-58.2	-39.5	179	-73.6	170.7	-172.5	0	0	111.3	Q77 K85	Q77-E81 WeakPolarHBondContact CG-OE1 3.22Å; Q77-E81 PolarHBondContact NE2-OE1 3.3Å; Q77-E81 WeakPolarHBondContact O-CG 3.43Å; Q77-E81 PolarHBondContact O-N 2.97Å; E81-K85 PolarHBondContact O-N 3.06Å; E81-K85 VanDerWaalsContact O-N 3.11Å
82	Y	97.9	Very high	97.1	Very high	120 Å²	120	78.9 Å²	78.9	47%	0.471	37%	0.365	S	S	.	.	H	α-helix	trans	-72.5	-35.9	176.9	-163	-114.1	0	0	0	112.6	I62 M78 A79 R80 K85 V86	I62-Y82 HydrophobicContact CD1-CD1 3.57Å; I62-Y82 HydrophobicContact CD1-CE1 3.81Å; I62-Y82 HydrophobicContact CG1-CD1 3.63Å; I62-Y82 HydrophobicContact CG1-CE1 3.91Å; I62-Y82 HydrophobicContact CG2-CD1 4.11Å; M78-Y82 WeakPolarHBondContact O-CB 3.39Å; M78-Y82 PolarHBondContact O-N 3.46Å; A79-Y82 PolarHBondContact O-N 3.35Å; R80-Y82 PolarHBondContact O-N 3.01Å; Y82-K85 HydrophobicContact CD2-CD 4.39Å; Y82-K85 HydrophobicContact CE2-CD 4.36Å; Y82-K85 PolarHBondContact O-N 3.27Å; Y82-V86 HydrophobicContact CE1-CG2 4.35Å; Y82-V86 WeakPolarHBondContact O-CG2 3.05Å; Y82-V86 PolarHBondContact O-N 3.38Å; Y82-V86 VanDerWaalsContact O-N 3.11Å
83	R	97.6	Very high	97.3	Very high	42 Å²	42	76.7 Å²	76.7	16%	0.158	35%	0.353	C	S	.	.	H	α-helix	trans	-58.6	-51.1	172	-177.5	-176.9	52.6	73	10.1	110.3	I62 S63 E66 A79 R80 K85 V86 E87	I62-R83 HydrophobicContact CG2-CB 3.83Å; S63-R83 WeakPolarHBondContact OG-CD 3.19Å; E66-R83 WeakPolarHBondContact OE2-CD 3.36Å; E66-R83 IonicContact OE2-CZ 3.6Å; E66-R83 IonicContact OE2-NE 2.71Å; E66-R83 PolarHBondContact OE2-NE 3.06Å; E66-R83 IonicContact OE2-NH2 3.61Å; A79-R83 WeakPolarHBondContact O-CB 3.48Å; A79-R83 PolarHBondContact O-N 2.99Å; R80-R83 WeakPolarHBondContact O-CB 3.24Å; R80-R83 PolarHBondContact O-N 3.02Å; R80-R83 VanDerWaalsContact O-N 3.09Å; R83-K85 VanDerWaalsContact C-N 3.28Å; R83-K85 PolarHBondContact O-N 3.38Å; R83-V86 PolarHBondContact O-N 3.34Å; R83-E87 HydrophobicContact CG-CG 4.41Å; R83-E87 IonicContact CZ-OE1 3.7Å; R83-E87 IonicContact NH1-OE1 2.83Å; R83-E87 PolarHBondContact NH1-OE1 3.24Å; R83-E87 IonicContact NH1-OE2 2.63Å; R83-E87 PolarHBondContact NH1-OE2 3.41Å; R83-E87 WeakPolarHBondContact O-CG 3.4Å; R83-E87 PolarHBondContact O-N 2.67Å
84	E	97.5	Very high	97.5	Very high	85 Å²	85	70.8 Å²	70.8	40%	0.397	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-35.7	-179.1	-71.6	170.8	-175.6	0	0	112.2	R80 E87 T88	R80-E84 WeakPolarHBondContact CG-OE1 3.05Å; R80-E84 WeakPolarHBondContact O-CG 3.44Å; R80-E84 PolarHBondContact O-N 3.47Å; E84-E87 PolarHBondContact O-N 2.78Å; E84-T88 PolarHBondContact O-N 3.34Å; E84-T88 PolarHBondContact O-OG1 3.2Å
85	K	98.3	Very high	97.7	Very high	114 Å²	114	68.7 Å²	68.7	50%	0.496	31%	0.312	S	S	.	.	H	α-helix	trans	-60.6	-49.3	170.5	-176.9	-174.9	174.5	-171.9	0	111.6	E81 Y82 R83 E87 T88 E89	E81-K85 PolarHBondContact O-N 3.06Å; E81-K85 VanDerWaalsContact O-N 3.11Å; Y82-K85 HydrophobicContact CD2-CD 4.39Å; Y82-K85 HydrophobicContact CE2-CD 4.36Å; Y82-K85 PolarHBondContact O-N 3.27Å; R83-K85 VanDerWaalsContact C-N 3.28Å; R83-K85 PolarHBondContact O-N 3.38Å; K85-E87 VanDerWaalsContact C-N 3.3Å; K85-E87 PolarHBondContact O-N 2.98Å; K85-T88 WeakPolarHBondContact O-CB 3.2Å; K85-T88 PolarHBondContact O-N 3.46Å; K85-E89 WeakPolarHBondContact CE-OE1 3.48Å; K85-E89 PolarHBondContact O-N 2.92Å
86	V	98.2	Very high	97.8	Very high	4 Å²	4	63.2 Å²	63.2	2%	0.024	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-36.1	179.3	178.1	0	0	0	0	111.3	R55 W59 Y82 R83 E89 L90	R55-V86 HydrophobicContact CB-CG1 4.43Å; R55-V86 WeakPolarHBondContact O-CG1 3.3Å; W59-V86 HydrophobicContact CB-CG1 3.82Å; Y82-V86 HydrophobicContact CE1-CG2 4.35Å; Y82-V86 WeakPolarHBondContact O-CG2 3.05Å; Y82-V86 PolarHBondContact O-N 3.38Å; Y82-V86 VanDerWaalsContact O-N 3.11Å; R83-V86 PolarHBondContact O-N 3.34Å; V86-E89 PolarHBondContact O-N 3.45Å; V86-L90 WeakPolarHBondContact O-CB 3.24Å; V86-L90 PolarHBondContact O-N 2.97Å
87	E	97.9	Very high	97.9	Very high	23 Å²	23	61 Å²	61	11%	0.107	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-43.6	173.7	-71.9	175.1	172.7	0	0	111.8	W59 R83 E84 K85 L90 Q91 V132	W59-E87 VanDerWaalsContact CD1-CG 3.41Å; W59-E87 VanDerWaalsContact NE1-CG 3.34Å; W59-E87 PolarHBondContact NE1-OE1 2.93Å; R83-E87 HydrophobicContact CG-CG 4.41Å; R83-E87 IonicContact CZ-OE1 3.7Å; R83-E87 IonicContact NH1-OE1 2.83Å; R83-E87 PolarHBondContact NH1-OE1 3.24Å; R83-E87 IonicContact NH1-OE2 2.63Å; R83-E87 PolarHBondContact NH1-OE2 3.41Å; R83-E87 WeakPolarHBondContact O-CG 3.4Å; R83-E87 PolarHBondContact O-N 2.67Å; E84-E87 PolarHBondContact O-N 2.78Å; K85-E87 VanDerWaalsContact C-N 3.3Å; K85-E87 PolarHBondContact O-N 2.98Å; E87-L90 PolarHBondContact O-N 3.4Å; E87-Q91 WeakPolarHBondContact O-CB 3.37Å; E87-Q91 WeakPolarHBondContact O-CG 3.07Å; E87-Q91 PolarHBondContact O-N 3.03Å; E87-V132 HydrophobicContact CG-CB 4.06Å; E87-V132 HydrophobicContact CG-CG1 4.26Å
88	T	97.8	Very high	98	Very high	72 Å²	72	57 Å²	57	44%	0.442	27%	0.266	S	S	.	.	H	α-helix	trans	-61	-47.8	176.5	-56	0	0	0	0	110.7	E84 K85 L90 Q91 D92	E84-T88 PolarHBondContact O-N 3.34Å; E84-T88 PolarHBondContact O-OG1 3.2Å; K85-T88 WeakPolarHBondContact O-CB 3.2Å; K85-T88 PolarHBondContact O-N 3.46Å; T88-L90 VanDerWaalsContact C-N 3.34Å; T88-L90 PolarHBondContact O-N 3.01Å; T88-Q91 PolarHBondContact O-N 2.87Å; T88-D92 VanDerWaalsContact O-CG 3.3Å; T88-D92 PolarHBondContact O-N 3.29Å
89	E	98.2	Very high	98.1	Very high	63 Å²	63	53.5 Å²	53.5	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-58.5	-45.6	175.9	-68.7	178.8	-161.2	0	0	111.8	R55 K85 V86 Q91 D92 I93	R55-E89 HydrophobicContact CG-CB 4.1Å; R55-E89 IonicContact CZ-OE2 3.72Å; R55-E89 IonicContact NE-OE2 2.64Å; R55-E89 PolarHBondContact NE-OE2 2.89Å; R55-E89 VanDerWaalsContact NE-OE2 3.16Å; R55-E89 IonicContact NH2-OE2 3.94Å; K85-E89 WeakPolarHBondContact CE-OE1 3.48Å; K85-E89 PolarHBondContact O-N 2.92Å; V86-E89 PolarHBondContact O-N 3.45Å; E89-Q91 PolarHBondContact O-N 3.28Å; E89-D92 PolarHBondContact O-N 3.49Å; E89-I93 VanDerWaalsContact O-CD1 3.27Å; E89-I93 WeakPolarHBondContact O-CD1 3.41Å; E89-I93 VanDerWaalsContact O-CG1 3.24Å; E89-I93 WeakPolarHBondContact O-CG1 3.43Å; E89-I93 PolarHBondContact O-N 2.95Å
90	L	98.1	Very high	98.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.3	-45.7	177.5	179.3	64.4	0	0	0	111.5	V52 R55 R56 V86 E87 T88 D92 I93 C94 V132	V52-L90 HydrophobicContact CG2-CD1 3.36Å; R55-L90 HydrophobicContact CB-CB 4.25Å; R55-L90 HydrophobicContact CB-CD1 4.1Å; R56-L90 HydrophobicContact CG-CD1 3.73Å; R56-L90 HydrophobicContact CG-CD2 4.07Å; V86-L90 WeakPolarHBondContact O-CB 3.24Å; V86-L90 PolarHBondContact O-N 2.97Å; E87-L90 PolarHBondContact O-N 3.4Å; T88-L90 VanDerWaalsContact C-N 3.34Å; T88-L90 PolarHBondContact O-N 3.01Å; L90-D92 VanDerWaalsContact C-N 3.35Å; L90-I93 PolarHBondContact O-N 3.16Å; L90-C94 WeakPolarHBondContact O-CB 3.42Å; L90-C94 PolarHBondContact O-N 3.44Å; L90-C94 PolarHBondContact O-SG 3.42Å; L90-V132 HydrophobicContact CD2-CB 4.49Å; L90-V132 HydrophobicContact CD2-CG1 3.57Å; L90-V132 HydrophobicContact CD2-CG2 4.09Å
91	Q	97.8	Very high	98.2	Very high	54 Å²	54	48.4 Å²	48.4	25%	0.252	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-43	178.1	-74.6	176.3	8.6	0	0	111.8	E87 T88 E89 C94 K95 L129 V132	E87-Q91 WeakPolarHBondContact O-CB 3.37Å; E87-Q91 WeakPolarHBondContact O-CG 3.07Å; E87-Q91 PolarHBondContact O-N 3.03Å; T88-Q91 PolarHBondContact O-N 2.87Å; E89-Q91 PolarHBondContact O-N 3.28Å; Q91-C94 PolarHBondContact O-N 3.45Å; Q91-K95 WeakPolarHBondContact O-CB 3.27Å; Q91-K95 VanDerWaalsContact O-CG 3.27Å; Q91-K95 WeakPolarHBondContact O-CG 3.45Å; Q91-K95 PolarHBondContact O-N 3.44Å; Q91-L129 HydrophobicContact CB-CD2 4.15Å; Q91-L129 HydrophobicContact CG-CD2 3.83Å; Q91-V132 HydrophobicContact CG-CG2 4.4Å
92	D	98.3	Very high	98.3	Very high	95 Å²	95	46.5 Å²	46.5	51%	0.508	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-44.9	178.9	-71.1	-18.7	0	0	0	111.3	T88 E89 L90 C94 K95 D96	T88-D92 VanDerWaalsContact O-CG 3.3Å; T88-D92 PolarHBondContact O-N 3.29Å; E89-D92 PolarHBondContact O-N 3.49Å; L90-D92 VanDerWaalsContact C-N 3.35Å; D92-C94 PolarHBondContact O-N 2.83Å; D92-K95 PolarHBondContact O-N 3.39Å; D92-D96 WeakPolarHBondContact O-CB 3.43Å; D92-D96 PolarHBondContact O-N 3.37Å
93	I	98.4	Very high	98.3	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.108	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-46.9	176	-65.6	155.1	0	0	0	110.9	Y48 V51 V52 R55 E89 L90 D96 V97	Y48-I93 HydrophobicContact CD1-CG2 4.07Å; V51-I93 HydrophobicContact CG1-CD1 3.59Å; V51-I93 HydrophobicContact CG1-CG1 3.88Å; V51-I93 HydrophobicContact CG1-CG2 3.94Å; V52-I93 HydrophobicContact CB-CG2 4.15Å; V52-I93 HydrophobicContact CG2-CG2 4.07Å; R55-I93 HydrophobicContact CB-CD1 4.43Å; R55-I93 HydrophobicContact CG-CD1 3.83Å; E89-I93 VanDerWaalsContact O-CD1 3.27Å; E89-I93 WeakPolarHBondContact O-CD1 3.41Å; E89-I93 VanDerWaalsContact O-CG1 3.24Å; E89-I93 WeakPolarHBondContact O-CG1 3.43Å; E89-I93 PolarHBondContact O-N 2.95Å; L90-I93 PolarHBondContact O-N 3.16Å; I93-D96 PolarHBondContact O-N 3.43Å; I93-V97 PolarHBondContact O-N 2.91Å
94	C	98.5	Very high	98.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-44.9	178.8	-71.9	0	0	0	0	111.7	L90 Q91 D92 D96 V97 L98 Y125 L129	L90-C94 WeakPolarHBondContact O-CB 3.42Å; L90-C94 PolarHBondContact O-N 3.44Å; L90-C94 PolarHBondContact O-SG 3.42Å; Q91-C94 PolarHBondContact O-N 3.45Å; D92-C94 PolarHBondContact O-N 2.83Å; C94-D96 VanDerWaalsContact C-N 3.3Å; C94-D96 PolarHBondContact O-N 2.91Å; C94-V97 VanDerWaalsContact O-CG1 3.25Å; C94-V97 WeakPolarHBondContact O-CG1 3.33Å; C94-V97 PolarHBondContact O-N 3.42Å; C94-L98 VanDerWaalsContact O-CB 3.31Å; C94-L98 WeakPolarHBondContact O-CB 3.29Å; C94-L98 WeakPolarHBondContact O-CD1 3.31Å; C94-L98 WeakPolarHBondContact O-CG 3.27Å; C94-L98 PolarHBondContact O-N 3.26Å; C94-Y125 HydrophobicContact CB-CD1 4.31Å; C94-L129 HydrophobicContact CB-CD1 3.99Å; C94-L129 HydrophobicContact CB-CD2 3.6Å; C94-L129 HydrophobicContact CB-CG 3.64Å
95	K	98.3	Very high	98.4	Very high	118 Å²	118	44 Å²	44	51%	0.513	22%	0.222	S	C	.	.	H	α-helix	trans	-64.7	-36.5	178.7	-75.9	172.5	-177.7	168.7	0	112	Q91 D92 G99	Q91-K95 WeakPolarHBondContact O-CB 3.27Å; Q91-K95 VanDerWaalsContact O-CG 3.27Å; Q91-K95 WeakPolarHBondContact O-CG 3.45Å; Q91-K95 PolarHBondContact O-N 3.44Å; D92-K95 PolarHBondContact O-N 3.39Å; K95-G99 PolarHBondContact O-N 3.08Å
96	D	98.4	Very high	98.4	Very high	49 Å²	49	39.9 Å²	39.9	26%	0.262	21%	0.206	S	C	.	.	H	α-helix	trans	-59.7	-52.7	176.7	-171.4	39.5	0	0	0	111.3	K27 Y48 D92 I93 C94 G99 L100	K27-D96 WeakPolarHBondContact CE-OD1 3.16Å; K27-D96 IonicContact NZ-OD1 2.75Å; K27-D96 PolarHBondContact NZ-OD1 3.05Å; K27-D96 IonicContact NZ-OD2 3.86Å; Y48-D96 HydrophobicContact CE1-CB 4.46Å; Y48-D96 PolarHBondContact OH-OD2 3.38Å; D92-D96 WeakPolarHBondContact O-CB 3.43Å; D92-D96 PolarHBondContact O-N 3.37Å; I93-D96 PolarHBondContact O-N 3.43Å; C94-D96 VanDerWaalsContact C-N 3.3Å; C94-D96 PolarHBondContact O-N 2.91Å; D96-G99 PolarHBondContact O-N 3.12Å; D96-L100 PolarHBondContact O-N 3.09Å; D96-L100 VanDerWaalsContact O-N 3.07Å
97	V	98.4	Very high	98.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-70.4	-34.6	-179.5	72.4	0	0	0	0	113	Y48 I93 C94 G99 L100 L101 M121 Y125	Y48-V97 HydrophobicContact CD1-CB 3.76Å; Y48-V97 HydrophobicContact CD1-CG1 4.44Å; Y48-V97 HydrophobicContact CD1-CG2 4.11Å; Y48-V97 HydrophobicContact CD2-CB 4.45Å; Y48-V97 HydrophobicContact CD2-CG2 3.98Å; Y48-V97 HydrophobicContact CE1-CB 3.85Å; Y48-V97 HydrophobicContact CE1-CG2 4.41Å; Y48-V97 HydrophobicContact CE2-CG2 4.3Å; Y48-V97 HydrophobicContact CG-CB 4.06Å; Y48-V97 HydrophobicContact CG-CG2 3.88Å; I93-V97 PolarHBondContact O-N 2.91Å; C94-V97 VanDerWaalsContact O-CG1 3.25Å; C94-V97 WeakPolarHBondContact O-CG1 3.33Å; C94-V97 PolarHBondContact O-N 3.42Å; V97-G99 VanDerWaalsContact C-N 3.3Å; V97-G99 PolarHBondContact O-N 2.86Å; V97-L100 WeakPolarHBondContact O-CB 3.37Å; V97-L100 PolarHBondContact O-N 2.89Å; V97-L101 HydrophobicContact CG2-CD1 4.39Å; V97-L101 VanDerWaalsContact O-CG 3.25Å; V97-L101 WeakPolarHBondContact O-CG 3.27Å; V97-L101 PolarHBondContact O-N 2.84Å; V97-M121 HydrophobicContact CG2-CE 3.38Å; V97-Y125 HydrophobicContact CG1-CD1 3.37Å; V97-Y125 HydrophobicContact CG1-CD2 3.48Å; V97-Y125 VanDerWaalsContact CG1-CD2 3.48Å; V97-Y125 HydrophobicContact CG1-CE1 3.59Å; V97-Y125 HydrophobicContact CG1-CE2 3.74Å; V97-Y125 HydrophobicContact CG1-CG 3.34Å; V97-Y125 HydrophobicContact CG2-CD2 4.36Å; V97-Y125 HydrophobicContact CG2-CE2 4.06Å
98	L	98.8	Very high	98.2	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-41	171.9	-72.9	170.6	0	0	0	111	C94 L100 L101 D102 K122 Y126 L129	C94-L98 VanDerWaalsContact O-CB 3.31Å; C94-L98 WeakPolarHBondContact O-CB 3.29Å; C94-L98 WeakPolarHBondContact O-CD1 3.31Å; C94-L98 WeakPolarHBondContact O-CG 3.27Å; C94-L98 PolarHBondContact O-N 3.26Å; L98-L100 VanDerWaalsContact C-N 3.33Å; L98-L100 PolarHBondContact O-N 2.99Å; L98-L101 HydrophobicContact CD2-CD1 4.4Å; L98-L101 PolarHBondContact O-N 3.16Å; L98-D102 WeakPolarHBondContact O-CB 3.32Å; L98-D102 PolarHBondContact O-N 3.32Å; L98-K122 HydrophobicContact CD2-CB 4.42Å; L98-K122 HydrophobicContact CD2-CG 3.77Å; L98-Y126 HydrophobicContact CD1-CD1 4.06Å; L98-Y126 HydrophobicContact CD1-CD2 4.35Å; L98-Y126 HydrophobicContact CD1-CE1 3.83Å; L98-Y126 HydrophobicContact CD1-CE2 4.12Å; L98-Y126 HydrophobicContact CD1-CG 4.31Å; L98-Y126 HydrophobicContact CD2-CD2 3.69Å; L98-Y126 HydrophobicContact CD2-CE2 3.51Å; L98-Y126 HydrophobicContact CD2-CG 4.35Å; L98-Y126 HydrophobicContact CG-CE2 4.42Å; L98-L129 HydrophobicContact CD1-CD1 3.62Å
99	G	98.7	Very high	98.2	Very high	38 Å²	38	43 Å²	43	39%	0.392	23%	0.227	S	C	.	.	H	α-helix	trans	-60.4	-40.3	173.2	0	0	0	0	0	112.9	K95 D96 V97 K103	K95-G99 PolarHBondContact O-N 3.08Å; D96-G99 PolarHBondContact O-N 3.12Å; V97-G99 VanDerWaalsContact C-N 3.3Å; V97-G99 PolarHBondContact O-N 2.86Å; G99-K103 WeakPolarHBondContact O-CB 3.25Å; G99-K103 PolarHBondContact O-N 2.77Å
100	L	98.8	Very high	98.1	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-65.6	-43.5	174.3	-64.7	178.5	0	0	0	112.4	K27 T30 E31 L44 Y48 D96 V97 L98 Y104 L105	K27-L100 HydrophobicContact CB-CD1 4.06Å; K27-L100 HydrophobicContact CG-CD1 4.03Å; K27-L100 HydrophobicContact CG-CD2 4.09Å; T30-L100 HydrophobicContact CG2-CB 4.13Å; T30-L100 HydrophobicContact CG2-CD2 4.05Å; T30-L100 HydrophobicContact CG2-CG 4.49Å; E31-L100 HydrophobicContact CG-CD2 3.84Å; L44-L100 HydrophobicContact CD1-CD1 4.4Å; Y48-L100 HydrophobicContact CE2-CD1 4.01Å; Y48-L100 WeakPolarHBondContact OH-CD1 3.27Å; D96-L100 PolarHBondContact O-N 3.09Å; D96-L100 VanDerWaalsContact O-N 3.07Å; V97-L100 WeakPolarHBondContact O-CB 3.37Å; V97-L100 PolarHBondContact O-N 2.89Å; L98-L100 VanDerWaalsContact C-N 3.33Å; L98-L100 PolarHBondContact O-N 2.99Å; L100-Y104 HydrophobicContact CD2-CD2 4.09Å; L100-Y104 HydrophobicContact CD2-CE2 4.3Å; L100-Y104 PolarHBondContact O-N 3.26Å; L100-L105 HydrophobicContact CB-CD1 4.39Å; L100-L105 PolarHBondContact O-N 2.88Å; L100-L105 VanDerWaalsContact O-N 3.16Å
101	L	98.8	Very high	98	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-60.4	-49.8	178.9	-72.2	163.7	0	0	0	111.2	V97 L98 L105 V106 Y118 M121 K122	V97-L101 HydrophobicContact CG2-CD1 4.39Å; V97-L101 VanDerWaalsContact O-CG 3.25Å; V97-L101 WeakPolarHBondContact O-CG 3.27Å; V97-L101 PolarHBondContact O-N 2.84Å; L98-L101 HydrophobicContact CD2-CD1 4.4Å; L98-L101 PolarHBondContact O-N 3.16Å; L101-L105 HydrophobicContact CD2-CB 4.32Å; L101-L105 HydrophobicContact CD2-CD1 3.82Å; L101-L105 HydrophobicContact CG-CD1 4.29Å; L101-L105 PolarHBondContact O-N 3.02Å; L101-V106 HydrophobicContact CB-CG2 4.45Å; L101-V106 WeakPolarHBondContact O-CB 3.46Å; L101-V106 WeakPolarHBondContact O-CG2 3.38Å; L101-V106 PolarHBondContact O-N 3.2Å; L101-Y118 HydrophobicContact CD2-CD1 3.83Å; L101-Y118 HydrophobicContact CD2-CG 4.12Å; L101-M121 HydrophobicContact CD1-CB 4.38Å; L101-M121 HydrophobicContact CD1-CG 4.17Å; L101-M121 HydrophobicContact CD2-CB 4.34Å; L101-M121 HydrophobicContact CD2-CG 4.44Å; L101-M121 HydrophobicContact CD2-SD 4.2Å; L101-K122 HydrophobicContact CD1-CB 4.03Å
102	D	98.5	Very high	97.9	Very high	68 Å²	68	47.6 Å²	47.6	36%	0.364	27%	0.265	S	S	.	.	I	π-helix	trans	-74	-34.3	-174.9	-73.3	-19	0	0	0	113.3	L98 P107 K122	L98-D102 WeakPolarHBondContact O-CB 3.32Å; L98-D102 PolarHBondContact O-N 3.32Å; D102-P107 WeakPolarHBondContact O-CG 3.37Å; D102-K122 WeakPolarHBondContact OD1-CE 3.32Å; D102-K122 IonicContact OD1-NZ 2.94Å; D102-K122 PolarHBondContact OD1-NZ 2.87Å; D102-K122 IonicContact OD2-NZ 3.29Å
103	K	98.3	Very high	97.8	Very high	143 Å²	143	46.7 Å²	46.7	62%	0.622	26%	0.258	S	S	*	.	I	π-helix	trans	-90.6	-33	-174.8	-171.5	174.2	174.1	-160.5	0	113.8	G99	G99-K103 WeakPolarHBondContact O-CB 3.25Å; G99-K103 PolarHBondContact O-N 2.77Å
104	Y	98.4	Very high	97.8	Very high	45 Å²	45	45.8 Å²	45.8	18%	0.176	25%	0.254	C	S	.	.	I	π-helix	trans	-126.4	-35.9	-168.5	-59.5	-81.8	0	0	0	114.4	T30 E31 L100 N108	T30-Y104 HydrophobicContact CG2-CD2 4.38Å; T30-Y104 HydrophobicContact CG2-CG 4.24Å; E31-Y104 HydrophobicContact CG-CE2 3.88Å; L100-Y104 HydrophobicContact CD2-CD2 4.09Å; L100-Y104 HydrophobicContact CD2-CE2 4.3Å; L100-Y104 PolarHBondContact O-N 3.26Å; Y104-N108 VanDerWaalsContact O-CB 3.28Å; Y104-N108 WeakPolarHBondContact O-CB 3.4Å; Y104-N108 PolarHBondContact O-ND2 3.39Å
105	L	98.6	Very high	97.8	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.037	27%	0.267	C	S	.	.	I	π-helix	trans	-95	-54.9	-167.4	-58.9	167.5	0	0	0	112.7	T30 L36 L44 L100 L101 N108 A109 Y118	T30-L105 HydrophobicContact CG2-CD1 4.1Å; T30-L105 HydrophobicContact CG2-CD2 3.61Å; T30-L105 HydrophobicContact CG2-CG 3.73Å; L36-L105 HydrophobicContact CD1-CD2 3.63Å; L36-L105 HydrophobicContact CG-CD2 3.85Å; L44-L105 HydrophobicContact CD2-CD1 3.45Å; L44-L105 VanDerWaalsContact CD2-CD1 3.45Å; L44-L105 HydrophobicContact CD2-CD2 4.47Å; L100-L105 HydrophobicContact CB-CD1 4.39Å; L100-L105 PolarHBondContact O-N 2.88Å; L100-L105 VanDerWaalsContact O-N 3.16Å; L101-L105 HydrophobicContact CD2-CB 4.32Å; L101-L105 HydrophobicContact CD2-CD1 3.82Å; L101-L105 HydrophobicContact CG-CD1 4.29Å; L101-L105 PolarHBondContact O-N 3.02Å; L105-N108 PolarHBondContact O-N 3.31Å; L105-A109 WeakPolarHBondContact O-CB 3.35Å; L105-A109 PolarHBondContact O-N 2.82Å; L105-Y118 HydrophobicContact CB-CD1 3.84Å; L105-Y118 HydrophobicContact CB-CD2 3.83Å; L105-Y118 HydrophobicContact CB-CE1 3.9Å; L105-Y118 HydrophobicContact CB-CE2 3.92Å; L105-Y118 HydrophobicContact CB-CG 3.83Å; L105-Y118 HydrophobicContact CD1-CD1 4.04Å; L105-Y118 HydrophobicContact CD1-CE1 3.94Å; L105-Y118 HydrophobicContact CD2-CE1 3.95Å; L105-Y118 HydrophobicContact CD2-CE2 4.48Å; L105-Y118 HydrophobicContact CG-CD1 4.4Å; L105-Y118 HydrophobicContact CG-CE1 4.15Å
106	V	98.2	Very high	97.8	Very high	27 Å²	27	43.3 Å²	43.3	16%	0.164	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-44.6	-180	177.4	0	0	0	0	111.6	L101 N108 A109 L119	L101-V106 HydrophobicContact CB-CG2 4.45Å; L101-V106 WeakPolarHBondContact O-CB 3.46Å; L101-V106 WeakPolarHBondContact O-CG2 3.38Å; L101-V106 PolarHBondContact O-N 3.2Å; V106-N108 VanDerWaalsContact C-N 3.33Å; V106-N108 PolarHBondContact O-N 3.2Å; V106-A109 PolarHBondContact O-N 3.37Å; V106-L119 HydrophobicContact CG1-CD2 4.21Å; V106-L119 HydrophobicContact CG2-CD2 4.42Å
107	P	97.4	Very high	97.8	Very high	82 Å²	82	42.2 Å²	42.2	53%	0.532	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.7	179.5	-22.2	34.8	0	0	0	114.6	D102	D102-P107 WeakPolarHBondContact O-CG 3.37Å
108	N	95.6	Very high	97.8	Very high	64 Å²	64	42.3 Å²	42.3	34%	0.342	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	1.4	-177.5	-64.6	-40.4	0	0	0	113.4	G33 Y104 L105 V106 T110	G33-N108 PolarHBondContact O-ND2 3.01Å; Y104-N108 VanDerWaalsContact O-CB 3.28Å; Y104-N108 WeakPolarHBondContact O-CB 3.4Å; Y104-N108 PolarHBondContact O-ND2 3.39Å; L105-N108 PolarHBondContact O-N 3.31Å; V106-N108 VanDerWaalsContact C-N 3.33Å; V106-N108 PolarHBondContact O-N 3.2Å; N108-T110 PolarHBondContact O-N 3.02Å
109	A	97	Very high	97.8	Very high	17 Å²	17	42 Å²	42	14%	0.14	24%	0.235	C	C	.	.			trans	-73.1	112.3	179.2	0	0	0	0	0	110.5	E35 L105 V106 K115 Y118	E35-A109 WeakPolarHBondContact OE1-CA 3.43Å; L105-A109 WeakPolarHBondContact O-CB 3.35Å; L105-A109 PolarHBondContact O-N 2.82Å; V106-A109 PolarHBondContact O-N 3.37Å; A109-K115 HydrophobicContact CB-CB 4.01Å; A109-Y118 HydrophobicContact CB-CD2 3.9Å; A109-Y118 HydrophobicContact CB-CE2 4.04Å
110	T	95.9	Very high	97.9	Very high	110 Å²	110	42 Å²	42	68%	0.675	22%	0.224	S	C	*	.			trans	-91.1	-43.9	179.6	64.2	0	0	0	0	113.1	E35 N108	E35-T110 PolarHBondContact OE1-N 3.43Å; E35-T110 PolarHBondContact OE1-OG1 3.49Å; E35-T110 WeakPolarHBondContact OE2-CG2 3.41Å; E35-T110 PolarHBondContact OE2-OG1 3.31Å; N108-T110 PolarHBondContact O-N 3.02Å
111	P	95.9	Very high	97.8	Very high	53 Å²	53	42.2 Å²	42.2	34%	0.344	23%	0.225	S	C	.	.	S	Bend	trans	-75.3	141.9	173.8	-13.7	31.2	0	0	0	110.9	E35 E113 S114 K115	E35-P111 WeakPolarHBondContact OE1-CD 3.44Å; P111-E113 PolarHBondContact O-N 2.82Å; P111-S114 PolarHBondContact O-N 3.27Å; P111-S114 VanDerWaalsContact O-N 3.11Å; P111-K115 PolarHBondContact O-N 3.16Å
112	P	96.8	Very high	97.9	Very high	51 Å²	51	44.2 Å²	44.2	33%	0.331	23%	0.234	S	C	.	.	H	α-helix	trans	-52.5	-40	172.9	-28.8	35.8	0	0	0	113.3	S114 K115 V116 I155 E159	P112-S114 PolarHBondContact O-N 3.09Å; P112-K115 PolarHBondContact O-N 2.97Å; P112-K115 VanDerWaalsContact O-N 3.15Å; P112-V116 WeakPolarHBondContact O-CG2 3.4Å; P112-V116 PolarHBondContact O-N 3.25Å; P112-I155 HydrophobicContact CB-CG2 4.22Å; P112-E159 HydrophobicContact CB-CB 3.53Å; P112-E159 HydrophobicContact CB-CG 3.72Å; P112-E159 HydrophobicContact CG-CB 3.96Å; P112-E159 HydrophobicContact CG-CG 3.88Å
113	E	96.7	Very high	97.9	Very high	76 Å²	76	41 Å²	41	36%	0.355	22%	0.216	S	C	.	.	H	α-helix	trans	-58	-44.6	178.2	-67.7	177.4	-167.8	0	0	112.8	P111 K115 V116 F117 M160 H164 I166	P111-E113 PolarHBondContact O-N 2.82Å; E113-K115 VanDerWaalsContact C-N 3.35Å; E113-V116 PolarHBondContact O-N 2.9Å; E113-F117 VanDerWaalsContact O-CB 3.27Å; E113-F117 WeakPolarHBondContact O-CB 3.12Å; E113-F117 PolarHBondContact O-N 3.15Å; E113-M160 HydrophobicContact CG-CE 4.01Å; E113-H164 IonicContact OE1-CD2 3.09Å; E113-H164 IonicContact OE1-NE2 3.3Å; E113-H164 PolarHBondContact OE1-NE2 2.86Å; E113-H164 IonicContact OE2-NE2 3.46Å; E113-I166 HydrophobicContact CB-CD1 4.3Å
114	S	98	Very high	97.9	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-64.8	-42.2	176.9	-69.3	0	0	0	0	110.8	P111 P112 F117 Y118	P111-S114 PolarHBondContact O-N 3.27Å; P111-S114 VanDerWaalsContact O-N 3.11Å; P112-S114 PolarHBondContact O-N 3.09Å; S114-F117 WeakPolarHBondContact O-CB 3.37Å; S114-F117 PolarHBondContact O-N 3.18Å; S114-Y118 WeakPolarHBondContact O-CD2 3.4Å; S114-Y118 VanDerWaalsContact O-CG 3.31Å; S114-Y118 PolarHBondContact O-N 3.49Å
115	K	98.3	Very high	97.9	Very high	65 Å²	65	32.9 Å²	32.9	28%	0.283	18%	0.182	S	C	.	.	H	α-helix	trans	-63.2	-46.3	178.1	-171	170.2	176.9	-169.5	0	111.6	A109 P111 P112 E113 F117 Y118 L119 E151 I155	A109-K115 HydrophobicContact CB-CB 4.01Å; P111-K115 PolarHBondContact O-N 3.16Å; P112-K115 PolarHBondContact O-N 2.97Å; P112-K115 VanDerWaalsContact O-N 3.15Å; E113-K115 VanDerWaalsContact C-N 3.35Å; K115-F117 VanDerWaalsContact C-N 3.34Å; K115-F117 PolarHBondContact O-N 3.48Å; K115-Y118 PolarHBondContact O-N 3.21Å; K115-L119 HydrophobicContact CG-CD1 3.89Å; K115-L119 HydrophobicContact CG-CG 4.45Å; K115-L119 WeakPolarHBondContact O-CB 3.16Å; K115-L119 WeakPolarHBondContact O-CG 3.31Å; K115-L119 PolarHBondContact O-N 2.69Å; K115-E151 VanDerWaalsContact CE-OE1 3.31Å; K115-E151 WeakPolarHBondContact CE-OE1 3.39Å; K115-E151 IonicContact NZ-OE1 2.69Å; K115-E151 PolarHBondContact NZ-OE1 2.87Å; K115-E151 VanDerWaalsContact NZ-OE1 3.09Å; K115-I155 HydrophobicContact CD-CD1 3.79Å; K115-I155 HydrophobicContact CG-CD1 4.06Å
116	V	98.7	Very high	97.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-42.3	175.3	175.2	0	0	0	0	110.9	P112 E113 Y118 L119 K120 A152 I155 M160 I166 L170	P112-V116 WeakPolarHBondContact O-CG2 3.4Å; P112-V116 PolarHBondContact O-N 3.25Å; E113-V116 PolarHBondContact O-N 2.9Å; V116-Y118 PolarHBondContact O-N 3.25Å; V116-L119 PolarHBondContact O-N 3.07Å; V116-K120 WeakPolarHBondContact O-CB 3.42Å; V116-K120 PolarHBondContact O-N 3.09Å; V116-A152 HydrophobicContact CG1-CB 4.35Å; V116-I155 HydrophobicContact CG2-CB 3.8Å; V116-I155 HydrophobicContact CG2-CG2 3.55Å; V116-M160 HydrophobicContact CB-SD 3.97Å; V116-M160 HydrophobicContact CG1-SD 3.96Å; V116-M160 HydrophobicContact CG2-SD 3.8Å; V116-I166 HydrophobicContact CB-CG2 4.33Å; V116-I166 HydrophobicContact CG1-CG2 3.77Å; V116-L170 HydrophobicContact CG1-CD2 4.04Å
117	F	98.6	Very high	97.9	Very high	27 Å²	27	33.7 Å²	33.7	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-58.1	-49.2	177.3	-171.6	-79.5	0	0	0	111.8	R41 E113 S114 K115 M121 I166	R41-F117 VanDerWaalsContact CD-CD1 3.43Å; R41-F117 HydrophobicContact CG-CD1 3.58Å; R41-F117 HydrophobicContact CG-CE1 3.45Å; R41-F117 VanDerWaalsContact CG-CE1 3.45Å; R41-F117 HydrophobicContact CG-CG 4.19Å; R41-F117 HydrophobicContact CG-CZ 3.95Å; E113-F117 VanDerWaalsContact O-CB 3.27Å; E113-F117 WeakPolarHBondContact O-CB 3.12Å; E113-F117 PolarHBondContact O-N 3.15Å; S114-F117 WeakPolarHBondContact O-CB 3.37Å; S114-F117 PolarHBondContact O-N 3.18Å; K115-F117 VanDerWaalsContact C-N 3.34Å; K115-F117 PolarHBondContact O-N 3.48Å; F117-M121 HydrophobicContact CE1-SD 4.32Å; F117-M121 VanDerWaalsContact O-CB 3.31Å; F117-M121 WeakPolarHBondContact O-CB 3.03Å; F117-M121 PolarHBondContact O-N 2.88Å; F117-I166 HydrophobicContact CB-CD1 4.41Å; F117-I166 HydrophobicContact CB-CG2 4.45Å; F117-I166 HydrophobicContact CD2-CD1 3.97Å; F117-I166 HydrophobicContact CD2-CG1 4.19Å
118	Y	98.8	Very high	98	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-70.4	-39.2	-179.1	-62.5	-46.2	0	0	0	112.8	R41 L101 L105 A109 S114 K115 V116 M121 K122	R41-Y118 HydrophobicContact CG-CE1 3.64Å; L101-Y118 HydrophobicContact CD2-CD1 3.83Å; L101-Y118 HydrophobicContact CD2-CG 4.12Å; L105-Y118 HydrophobicContact CB-CD1 3.84Å; L105-Y118 HydrophobicContact CB-CD2 3.83Å; L105-Y118 HydrophobicContact CB-CE1 3.9Å; L105-Y118 HydrophobicContact CB-CE2 3.92Å; L105-Y118 HydrophobicContact CB-CG 3.83Å; L105-Y118 HydrophobicContact CD1-CD1 4.04Å; L105-Y118 HydrophobicContact CD1-CE1 3.94Å; L105-Y118 HydrophobicContact CD2-CE1 3.95Å; L105-Y118 HydrophobicContact CD2-CE2 4.48Å; L105-Y118 HydrophobicContact CG-CD1 4.4Å; L105-Y118 HydrophobicContact CG-CE1 4.15Å; A109-Y118 HydrophobicContact CB-CD2 3.9Å; A109-Y118 HydrophobicContact CB-CE2 4.04Å; S114-Y118 WeakPolarHBondContact O-CD2 3.4Å; S114-Y118 VanDerWaalsContact O-CG 3.31Å; S114-Y118 PolarHBondContact O-N 3.49Å; K115-Y118 PolarHBondContact O-N 3.21Å; V116-Y118 PolarHBondContact O-N 3.25Å; Y118-M121 WeakPolarHBondContact O-CB 3.33Å; Y118-M121 PolarHBondContact O-N 2.94Å; Y118-K122 WeakPolarHBondContact O-CB 3.46Å; Y118-K122 PolarHBondContact O-N 3.31Å
119	L	98.9	Very high	98.1	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-67.5	-41	176.3	-72.5	170	0	0	0	112	V106 K115 V116 M121 K122 G123 E151 A152 I155	V106-L119 HydrophobicContact CG1-CD2 4.21Å; V106-L119 HydrophobicContact CG2-CD2 4.42Å; K115-L119 HydrophobicContact CG-CD1 3.89Å; K115-L119 HydrophobicContact CG-CG 4.45Å; K115-L119 WeakPolarHBondContact O-CB 3.16Å; K115-L119 WeakPolarHBondContact O-CG 3.31Å; K115-L119 PolarHBondContact O-N 2.69Å; V116-L119 PolarHBondContact O-N 3.07Å; L119-M121 VanDerWaalsContact C-N 3.3Å; L119-M121 PolarHBondContact O-N 2.97Å; L119-K122 WeakPolarHBondContact O-CB 3.18Å; L119-K122 PolarHBondContact O-N 3.39Å; L119-G123 PolarHBondContact O-N 3.28Å; L119-E151 HydrophobicContact CD1-CB 4.06Å; L119-E151 HydrophobicContact CD1-CG 3.68Å; L119-A152 HydrophobicContact CB-CB 3.65Å; L119-I155 HydrophobicContact CD1-CD1 3.77Å
120	K	98.7	Very high	98.1	Very high	38 Å²	38	27.7 Å²	27.7	17%	0.165	14%	0.142	C	C	.	.	H	α-helix	trans	-55.9	-48.3	170.1	177.7	-168	169.8	-67.3	0	110.6	V116 K122 G123 D124 Y149 G169 L170 N173	V116-K120 WeakPolarHBondContact O-CB 3.42Å; V116-K120 PolarHBondContact O-N 3.09Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 3.19Å; K120-G123 PolarHBondContact O-N 3.09Å; K120-D124 IonicContact NZ-OD2 3.54Å; K120-D124 PolarHBondContact NZ-OD2 3.07Å; K120-D124 VanDerWaalsContact O-CG 3.3Å; K120-D124 PolarHBondContact O-N 3.28Å; K120-Y149 HydrophobicContact CG-CE1 4.49Å; K120-G169 WeakPolarHBondContact CE-O 3.41Å; K120-L170 HydrophobicContact CB-CD1 4Å; K120-L170 HydrophobicContact CD-CB 4.1Å; K120-L170 HydrophobicContact CG-CB 4.29Å; K120-L170 HydrophobicContact CG-CD1 3.97Å; K120-N173 PolarHBondContact NZ-ND2 2.88Å
121	M	98.7	Very high	98.1	Very high	6 Å²	6	24 Å²	24	3%	0.03	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-43.6	178.2	-168.8	174.6	170.2	0	0	111	V97 L101 F117 Y118 L119 G123 D124 Y125	V97-M121 HydrophobicContact CG2-CE 3.38Å; L101-M121 HydrophobicContact CD1-CB 4.38Å; L101-M121 HydrophobicContact CD1-CG 4.17Å; L101-M121 HydrophobicContact CD2-CB 4.34Å; L101-M121 HydrophobicContact CD2-CG 4.44Å; L101-M121 HydrophobicContact CD2-SD 4.2Å; F117-M121 HydrophobicContact CE1-SD 4.32Å; F117-M121 VanDerWaalsContact O-CB 3.31Å; F117-M121 WeakPolarHBondContact O-CB 3.03Å; F117-M121 PolarHBondContact O-N 2.88Å; Y118-M121 WeakPolarHBondContact O-CB 3.33Å; Y118-M121 PolarHBondContact O-N 2.94Å; L119-M121 VanDerWaalsContact C-N 3.3Å; L119-M121 PolarHBondContact O-N 2.97Å; M121-G123 PolarHBondContact O-N 3.41Å; M121-D124 WeakPolarHBondContact O-CB 3.35Å; M121-D124 PolarHBondContact O-N 3.43Å; M121-D124 VanDerWaalsContact O-N 3.14Å; M121-Y125 HydrophobicContact CE-CD2 4.43Å; M121-Y125 HydrophobicContact CE-CE2 3.51Å; M121-Y125 HydrophobicContact CG-CD2 3.86Å; M121-Y125 HydrophobicContact CG-CE2 3.49Å; M121-Y125 VanDerWaalsContact CG-CE2 3.49Å; M121-Y125 WeakPolarHBondContact O-CD2 3.46Å; M121-Y125 PolarHBondContact O-N 3.44Å; M121-Y125 HydrophobicContact SD-CE2 4.38Å
122	K	98.9	Very high	98	Very high	43 Å²	43	22.2 Å²	22.2	19%	0.187	11%	0.105	C	C	.	.	H	α-helix	trans	-57.3	-46.7	174.1	-174.6	174.2	-179.8	172.9	0	111.8	L98 L101 D102 Y118 L119 K120 D124 Y125 Y126 A148	L98-K122 HydrophobicContact CD2-CB 4.42Å; L98-K122 HydrophobicContact CD2-CG 3.77Å; L101-K122 HydrophobicContact CD1-CB 4.03Å; D102-K122 WeakPolarHBondContact OD1-CE 3.32Å; D102-K122 IonicContact OD1-NZ 2.94Å; D102-K122 PolarHBondContact OD1-NZ 2.87Å; D102-K122 IonicContact OD2-NZ 3.29Å; Y118-K122 WeakPolarHBondContact O-CB 3.46Å; Y118-K122 PolarHBondContact O-N 3.31Å; L119-K122 WeakPolarHBondContact O-CB 3.18Å; L119-K122 PolarHBondContact O-N 3.39Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 3.19Å; K122-D124 VanDerWaalsContact C-N 3.34Å; K122-D124 PolarHBondContact O-N 3.03Å; K122-Y125 PolarHBondContact O-N 2.91Å; K122-Y126 HydrophobicContact CD-CE2 4.35Å; K122-Y126 HydrophobicContact CG-CD2 3.88Å; K122-Y126 HydrophobicContact CG-CE2 3.78Å; K122-Y126 VanDerWaalsContact O-CD2 3.31Å; K122-Y126 WeakPolarHBondContact O-CD2 3.31Å; K122-Y126 PolarHBondContact O-N 3.27Å; K122-A148 HydrophobicContact CB-CB 4.04Å; K122-A148 HydrophobicContact CD-CB 4.18Å; K122-A148 HydrophobicContact CG-CB 3.92Å
123	G	98.8	Very high	97.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.1	-45.6	173.2	0	0	0	0	0	112.3	L119 K120 M121 Y125 Y126 R127 S145 Y149	L119-G123 PolarHBondContact O-N 3.28Å; K120-G123 PolarHBondContact O-N 3.09Å; M121-G123 PolarHBondContact O-N 3.41Å; G123-Y125 PolarHBondContact O-N 3.36Å; G123-Y126 PolarHBondContact O-N 2.63Å; G123-R127 WeakPolarHBondContact O-CB 3.13Å; G123-R127 PolarHBondContact O-N 3.39Å; G123-S145 PolarHBondContact O-OG 2.99Å; G123-Y149 VanDerWaalsContact C-CZ 3.42Å
124	D	98.8	Very high	97.4	Very high	11 Å²	11	21.4 Å²	21.4	6%	0.059	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-46.9	177.8	-68.1	-35.5	0	0	0	112.5	K120 M121 K122 R127 Y128 Y149 N173	K120-D124 IonicContact NZ-OD2 3.54Å; K120-D124 PolarHBondContact NZ-OD2 3.07Å; K120-D124 VanDerWaalsContact O-CG 3.3Å; K120-D124 PolarHBondContact O-N 3.28Å; M121-D124 WeakPolarHBondContact O-CB 3.35Å; M121-D124 PolarHBondContact O-N 3.43Å; M121-D124 VanDerWaalsContact O-N 3.14Å; K122-D124 VanDerWaalsContact C-N 3.34Å; K122-D124 PolarHBondContact O-N 3.03Å; D124-R127 WeakPolarHBondContact O-CB 3.42Å; D124-R127 PolarHBondContact O-N 2.9Å; D124-R127 IonicContact OD1-NH2 3.78Å; D124-Y128 HydrophobicContact CB-CE2 4.17Å; D124-Y128 WeakPolarHBondContact O-CD1 3.25Å; D124-Y128 WeakPolarHBondContact O-CD2 3.27Å; D124-Y128 PolarHBondContact O-N 2.9Å; D124-Y149 VanDerWaalsContact CA-OH 3.31Å; D124-Y149 WeakPolarHBondContact CA-OH 3.45Å; D124-Y149 PolarHBondContact N-OH 3.14Å; D124-Y149 PolarHBondContact OD1-OH 3.36Å; D124-N173 VanDerWaalsContact OD1-CB 3.3Å; D124-N173 WeakPolarHBondContact OD1-CB 3.39Å; D124-N173 PolarHBondContact OD1-ND2 3.21Å; D124-N173 PolarHBondContact OD2-ND2 3.31Å
125	Y	98.7	Very high	96.9	Very high	6 Å²	6	24.1 Å²	24.1	2%	0.024	14%	0.138	C	C	.	.	H	α-helix	trans	-72.5	-34.7	-178.6	-74.2	-77.2	0	0	0	113.3	Y48 K49 V52 C94 V97 M121 K122 G123 Y128 L129	Y48-Y125 WeakPolarHBondContact CB-OH 3.34Å; Y48-Y125 PolarHBondContact O-OH 3.49Å; K49-Y125 PolarHBondContact N-OH 3.22Å; V52-Y125 HydrophobicContact CB-CE1 3.92Å; V52-Y125 HydrophobicContact CG1-CE1 3.86Å; V52-Y125 HydrophobicContact CG2-CD1 4.2Å; V52-Y125 HydrophobicContact CG2-CE1 3.9Å; C94-Y125 HydrophobicContact CB-CD1 4.31Å; V97-Y125 HydrophobicContact CG1-CD1 3.37Å; V97-Y125 HydrophobicContact CG1-CD2 3.48Å; V97-Y125 VanDerWaalsContact CG1-CD2 3.48Å; V97-Y125 HydrophobicContact CG1-CE1 3.59Å; V97-Y125 HydrophobicContact CG1-CE2 3.74Å; V97-Y125 HydrophobicContact CG1-CG 3.34Å; V97-Y125 HydrophobicContact CG2-CD2 4.36Å; V97-Y125 HydrophobicContact CG2-CE2 4.06Å; M121-Y125 HydrophobicContact CE-CD2 4.43Å; M121-Y125 HydrophobicContact CE-CE2 3.51Å; M121-Y125 HydrophobicContact CG-CD2 3.86Å; M121-Y125 HydrophobicContact CG-CE2 3.49Å; M121-Y125 VanDerWaalsContact CG-CE2 3.49Å; M121-Y125 WeakPolarHBondContact O-CD2 3.46Å; M121-Y125 PolarHBondContact O-N 3.44Å; M121-Y125 HydrophobicContact SD-CE2 4.38Å; K122-Y125 PolarHBondContact O-N 2.91Å; G123-Y125 PolarHBondContact O-N 3.36Å; Y125-Y128 AromaticContact CD1-CD2 3.89Å; Y125-Y128 HydrophobicContact CD1-CD2 3.89Å; Y125-Y128 HydrophobicContact CD1-CE2 4.31Å; Y125-Y128 HydrophobicContact CE1-CD2 4.23Å; Y125-Y128 HydrophobicContact CE1-CE2 4.32Å; Y125-Y128 HydrophobicContact CG-CD2 4.41Å; Y125-Y128 PolarHBondContact O-N 3.21Å; Y125-L129 WeakPolarHBondContact O-CG 3.15Å; Y125-L129 PolarHBondContact O-N 3.39Å
126	Y	98.8	Very high	96.4	Very high	40 Å²	40	28.2 Å²	28.2	16%	0.157	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-39	170	-83	-64.8	0	0	0	112.2	L98 K122 G123 Y128 L129 S130 T141 C144	L98-Y126 HydrophobicContact CD1-CD1 4.06Å; L98-Y126 HydrophobicContact CD1-CD2 4.35Å; L98-Y126 HydrophobicContact CD1-CE1 3.83Å; L98-Y126 HydrophobicContact CD1-CE2 4.12Å; L98-Y126 HydrophobicContact CD1-CG 4.31Å; L98-Y126 HydrophobicContact CD2-CD2 3.69Å; L98-Y126 HydrophobicContact CD2-CE2 3.51Å; L98-Y126 HydrophobicContact CD2-CG 4.35Å; L98-Y126 HydrophobicContact CG-CE2 4.42Å; K122-Y126 HydrophobicContact CD-CE2 4.35Å; K122-Y126 HydrophobicContact CG-CD2 3.88Å; K122-Y126 HydrophobicContact CG-CE2 3.78Å; K122-Y126 VanDerWaalsContact O-CD2 3.31Å; K122-Y126 WeakPolarHBondContact O-CD2 3.31Å; K122-Y126 PolarHBondContact O-N 3.27Å; G123-Y126 PolarHBondContact O-N 2.63Å; Y126-Y128 VanDerWaalsContact C-N 3.33Å; Y126-Y128 PolarHBondContact O-N 2.64Å; Y126-L129 HydrophobicContact CD1-CD1 4.09Å; Y126-L129 HydrophobicContact CE1-CD1 4.46Å; Y126-L129 WeakPolarHBondContact O-CB 3.38Å; Y126-L129 PolarHBondContact O-N 3Å; Y126-L129 VanDerWaalsContact O-N 3.12Å; Y126-S130 PolarHBondContact O-N 2.9Å; Y126-S130 PolarHBondContact O-OG 2.92Å; Y126-S130 VanDerWaalsContact O-OG 3.12Å; Y126-T141 HydrophobicContact CD1-CG2 4.39Å; Y126-C144 HydrophobicContact CD1-CB 3.61Å; Y126-C144 HydrophobicContact CD2-CB 3.68Å; Y126-C144 HydrophobicContact CE1-CB 3.58Å; Y126-C144 HydrophobicContact CE2-CB 3.66Å; Y126-C144 HydrophobicContact CG-CB 3.65Å
127	R	98.4	Very high	96.1	Very high	11 Å²	11	31 Å²	31	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-57.5	-45.6	172.4	170.6	166.2	69.8	86.6	2.5	111.7	G123 D124 L129 S130 E131 Y149 F177 E180 I181	G123-R127 WeakPolarHBondContact O-CB 3.13Å; G123-R127 PolarHBondContact O-N 3.39Å; D124-R127 WeakPolarHBondContact O-CB 3.42Å; D124-R127 PolarHBondContact O-N 2.9Å; D124-R127 IonicContact OD1-NH2 3.78Å; R127-L129 VanDerWaalsContact C-N 3.28Å; R127-L129 PolarHBondContact O-N 2.79Å; R127-S130 WeakPolarHBondContact O-CB 3.46Å; R127-S130 PolarHBondContact O-N 3.21Å; R127-S130 VanDerWaalsContact O-N 3.09Å; R127-E131 IonicContact NH1-OE1 3.36Å; R127-E131 PolarHBondContact O-N 3.11Å; R127-E131 VanDerWaalsContact O-N 3.08Å; R127-Y149 PolarHBondContact NE-OH 3.5Å; R127-F177 HydrophobicContact CB-CD2 4.25Å; R127-F177 HydrophobicContact CG-CD2 4.31Å; R127-E180 IonicContact NH1-OE2 3.9Å; R127-I181 HydrophobicContact CG-CD1 4.12Å; R127-I181 HydrophobicContact CG-CG1 3.78Å
128	Y	98.2	Very high	95.9	Very high	23 Å²	23	34.1 Å²	34.1	9%	0.09	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-34.5	176.1	-56.4	-29.6	0	0	0	112.7	V52 R56 D124 Y125 Y126	V52-Y128 HydrophobicContact CG1-CD2 3.84Å; V52-Y128 HydrophobicContact CG1-CE2 3.71Å; V52-Y128 HydrophobicContact CG2-CD2 4.09Å; R56-Y128 VanDerWaalsContact CZ-CE1 3.49Å; R56-Y128 VanDerWaalsContact NE-CD1 3.3Å; D124-Y128 HydrophobicContact CB-CE2 4.17Å; D124-Y128 WeakPolarHBondContact O-CD1 3.25Å; D124-Y128 WeakPolarHBondContact O-CD2 3.27Å; D124-Y128 PolarHBondContact O-N 2.9Å; Y125-Y128 AromaticContact CD1-CD2 3.89Å; Y125-Y128 HydrophobicContact CD1-CD2 3.89Å; Y125-Y128 HydrophobicContact CD1-CE2 4.31Å; Y125-Y128 HydrophobicContact CE1-CD2 4.23Å; Y125-Y128 HydrophobicContact CE1-CE2 4.32Å; Y125-Y128 HydrophobicContact CG-CD2 4.41Å; Y125-Y128 PolarHBondContact O-N 3.21Å; Y126-Y128 VanDerWaalsContact C-N 3.33Å; Y126-Y128 PolarHBondContact O-N 2.64Å
129	L	98.1	Very high	95.7	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.073	22%	0.224	C	C	.	.	H	α-helix	trans	-66.5	-41.2	171.4	-70.6	172.3	0	0	0	111.6	Q91 C94 L98 Y125 Y126 R127 E131 V132 A133 T141	Q91-L129 HydrophobicContact CB-CD2 4.15Å; Q91-L129 HydrophobicContact CG-CD2 3.83Å; C94-L129 HydrophobicContact CB-CD1 3.99Å; C94-L129 HydrophobicContact CB-CD2 3.6Å; C94-L129 HydrophobicContact CB-CG 3.64Å; L98-L129 HydrophobicContact CD1-CD1 3.62Å; Y125-L129 WeakPolarHBondContact O-CG 3.15Å; Y125-L129 PolarHBondContact O-N 3.39Å; Y126-L129 HydrophobicContact CD1-CD1 4.09Å; Y126-L129 HydrophobicContact CE1-CD1 4.46Å; Y126-L129 WeakPolarHBondContact O-CB 3.38Å; Y126-L129 PolarHBondContact O-N 3Å; Y126-L129 VanDerWaalsContact O-N 3.12Å; R127-L129 VanDerWaalsContact C-N 3.28Å; R127-L129 PolarHBondContact O-N 2.79Å; L129-E131 PolarHBondContact O-N 3.36Å; L129-V132 WeakPolarHBondContact O-CG2 3.39Å; L129-V132 PolarHBondContact O-N 3.44Å; L129-V132 VanDerWaalsContact O-N 3.16Å; L129-A133 VanDerWaalsContact O-CB 3.24Å; L129-A133 WeakPolarHBondContact O-CB 3.25Å; L129-A133 PolarHBondContact O-N 3.44Å; L129-T141 HydrophobicContact CB-CG2 3.7Å; L129-T141 HydrophobicContact CD1-CG2 4.39Å
130	S	97.4	Very high	95.7	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-27.7	177.6	-60.1	0	0	0	0	113.8	Y126 R127 V132 T141 V142	Y126-S130 PolarHBondContact O-N 2.9Å; Y126-S130 PolarHBondContact O-OG 2.92Å; Y126-S130 VanDerWaalsContact O-OG 3.12Å; R127-S130 WeakPolarHBondContact O-CB 3.46Å; R127-S130 PolarHBondContact O-N 3.21Å; R127-S130 VanDerWaalsContact O-N 3.09Å; S130-V132 VanDerWaalsContact C-N 3.26Å; S130-V132 PolarHBondContact O-N 3.42Å; S130-T141 WeakPolarHBondContact CA-OG1 3.13Å; S130-T141 WeakPolarHBondContact OG-CB 3.36Å; S130-T141 PolarHBondContact OG-OG1 3.06Å; S130-V142 PolarHBondContact OG-N 2.96Å; S130-V142 VanDerWaalsContact OG-N 3.16Å
131	E	95.2	Very high	95.6	Very high	32 Å²	32	44.9 Å²	44.9	15%	0.15	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-33.9	174.7	-72	171	-150.9	0	0	112.3	R56 W59 R60 R127 L129 I181	R56-E131 IonicContact CZ-OE1 3.65Å; R56-E131 IonicContact CZ-OE2 3.98Å; R56-E131 VanDerWaalsContact CZ-OE2 3.3Å; R56-E131 IonicContact NE-OE1 3.21Å; R56-E131 PolarHBondContact NE-OE1 3.08Å; R56-E131 IonicContact NE-OE2 3.87Å; R56-E131 PolarHBondContact NE-OE2 3.23Å; R56-E131 IonicContact NH2-OE1 3.16Å; R56-E131 PolarHBondContact NH2-OE1 2.91Å; R56-E131 IonicContact NH2-OE2 2.98Å; R56-E131 PolarHBondContact NH2-OE2 3.06Å; W59-E131 WeakPolarHBondContact CH2-O 3.39Å; R60-E131 IonicContact NH2-OE2 2.69Å; R60-E131 PolarHBondContact NH2-OE2 3.22Å; R127-E131 IonicContact NH1-OE1 3.36Å; R127-E131 PolarHBondContact O-N 3.11Å; R127-E131 VanDerWaalsContact O-N 3.08Å; L129-E131 PolarHBondContact O-N 3.36Å; E131-I181 HydrophobicContact CG-CD1 3.91Å
132	V	94.7	Very high	95.6	Very high	15 Å²	15	45.2 Å²	45.2	9%	0.091	25%	0.25	C	C	.	.	H	α-helix	trans	-110.4	-10.6	-174.9	-55.8	0	0	0	0	113.9	W59 E87 L90 Q91 L129 S130	W59-V132 HydrophobicContact CD2-CG1 3.8Å; W59-V132 HydrophobicContact CE3-CG1 4.27Å; W59-V132 HydrophobicContact CG-CG1 4.21Å; W59-V132 HydrophobicContact CH2-CG1 4.26Å; W59-V132 HydrophobicContact CZ2-CB 4.46Å; W59-V132 HydrophobicContact CZ2-CG1 3.8Å; W59-V132 HydrophobicContact CZ3-CG1 4.48Å; E87-V132 HydrophobicContact CG-CB 4.06Å; E87-V132 HydrophobicContact CG-CG1 4.26Å; L90-V132 HydrophobicContact CD2-CB 4.49Å; L90-V132 HydrophobicContact CD2-CG1 3.57Å; L90-V132 HydrophobicContact CD2-CG2 4.09Å; Q91-V132 HydrophobicContact CG-CG2 4.4Å; L129-V132 WeakPolarHBondContact O-CG2 3.39Å; L129-V132 PolarHBondContact O-N 3.44Å; L129-V132 VanDerWaalsContact O-N 3.16Å; S130-V132 VanDerWaalsContact C-N 3.26Å; S130-V132 PolarHBondContact O-N 3.42Å
133	A	93.5	Very high	95.6	Very high	13 Å²	13	45.6 Å²	45.6	11%	0.107	26%	0.256	C	S	.	.			trans	-78	153.2	-179.8	0	0	0	0	0	112.3	L129 K138	L129-A133 VanDerWaalsContact O-CB 3.24Å; L129-A133 WeakPolarHBondContact O-CB 3.25Å; L129-A133 PolarHBondContact O-N 3.44Å; A133-K138 HydrophobicContact CB-CB 4.06Å
134	S	88	Confident	95.6	Very high	97 Å²	97	46.8 Å²	46.8	68%	0.678	26%	0.264	S	S	*	.			trans	-132.1	155	176.1	60.8	0	0	0	0	111.5
135	G	86.7	Confident	95.6	Very high	61 Å²	61	46.3 Å²	46.3	63%	0.629	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	-139	177.2	0	0	0	0	0	113	S137 K138 Q139	G135-S137 VanDerWaalsContact C-N 3.27Å; G135-S137 PolarHBondContact O-N 2.85Å; G135-K138 WeakPolarHBondContact O-CB 3.18Å; G135-K138 PolarHBondContact O-N 3.27Å; G135-Q139 PolarHBondContact O-N 3.49Å
136	D	88.1	Confident	95.6	Very high	150 Å²	150	49.4 Å²	49.4	80%	0.802	28%	0.276	S	S	*	.	H	α-helix	trans	-59.8	-35.7	-176	-62.6	-21.8	0	0	0	113.1	K138 Q139 E140	D136-K138 PolarHBondContact O-N 3.29Å; D136-Q139 PolarHBondContact O-N 3.33Å; D136-Q139 VanDerWaalsContact O-N 3.14Å; D136-E140 PolarHBondContact O-N 3.47Å
137	S	91.6	Very high	95.6	Very high	58 Å²	58	53.4 Å²	53.4	41%	0.406	30%	0.296	S	S	.	.	H	α-helix	trans	-62.2	-32.4	176.2	-178.6	0	0	0	0	112.1	G135 T141	G135-S137 VanDerWaalsContact C-N 3.27Å; G135-S137 PolarHBondContact O-N 2.85Å; S137-T141 VanDerWaalsContact O-CG2 3.25Å; S137-T141 WeakPolarHBondContact O-CG2 3.42Å; S137-T141 PolarHBondContact O-N 2.94Å; S137-T141 VanDerWaalsContact O-N 3.07Å; S137-T141 PolarHBondContact O-OG1 3.39Å
138	K	94.9	Very high	95.6	Very high	94 Å²	94	53.1 Å²	53.1	41%	0.409	30%	0.296	S	S	.	.	H	α-helix	trans	-67.2	-46.1	174.3	-170.6	171.6	-176.7	169.8	0	110.8	A133 G135 D136 E140 T141 V142	A133-K138 HydrophobicContact CB-CB 4.06Å; G135-K138 WeakPolarHBondContact O-CB 3.18Å; G135-K138 PolarHBondContact O-N 3.27Å; D136-K138 PolarHBondContact O-N 3.29Å; K138-E140 VanDerWaalsContact C-N 3.31Å; K138-E140 PolarHBondContact O-N 2.63Å; K138-T141 PolarHBondContact O-N 2.97Å; K138-T141 PolarHBondContact O-OG1 2.95Å; K138-V142 HydrophobicContact CG-CG2 4.2Å; K138-V142 WeakPolarHBondContact O-CB 3.15Å; K138-V142 WeakPolarHBondContact O-CG2 3.4Å; K138-V142 PolarHBondContact O-N 3.42Å
139	Q	95.7	Very high	95.6	Very high	128 Å²	128	52 Å²	52	60%	0.598	29%	0.292	S	S	*	.	H	α-helix	trans	-60.8	-41.8	179.7	-174.4	59.4	43.4	0	0	112.2	G135 D136 T143	G135-Q139 PolarHBondContact O-N 3.49Å; D136-Q139 PolarHBondContact O-N 3.33Å; D136-Q139 VanDerWaalsContact O-N 3.14Å; Q139-T143 PolarHBondContact NE2-OG1 3.38Å; Q139-T143 WeakPolarHBondContact O-CB 3.44Å; Q139-T143 PolarHBondContact O-N 2.82Å; Q139-T143 PolarHBondContact O-OG1 2.95Å
140	E	97.1	Very high	95.6	Very high	130 Å²	130	54.5 Å²	54.5	61%	0.607	30%	0.303	S	S	*	.	H	α-helix	trans	-62.2	-53	176.7	-175.7	-178.9	-173	0	0	111.4	D136 K138 V142 T143 C144	D136-E140 PolarHBondContact O-N 3.47Å; K138-E140 VanDerWaalsContact C-N 3.31Å; K138-E140 PolarHBondContact O-N 2.63Å; E140-V142 VanDerWaalsContact C-N 3.31Å; E140-V142 PolarHBondContact O-N 3.02Å; E140-T143 WeakPolarHBondContact O-CB 3.33Å; E140-T143 PolarHBondContact O-N 3.2Å; E140-T143 VanDerWaalsContact O-N 3.13Å; E140-C144 PolarHBondContact O-N 3.44Å; E140-C144 PolarHBondContact O-SG 3.4Å; E140-C144 VanDerWaalsContact O-SG 3.37Å
141	T	98	Very high	95.7	Very high	9 Å²	9	58.5 Å²	58.5	6%	0.055	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-39.5	-178.9	54.2	0	0	0	0	112.2	Y126 L129 S130 S137 K138 C144 S145	Y126-T141 HydrophobicContact CD1-CG2 4.39Å; L129-T141 HydrophobicContact CB-CG2 3.7Å; L129-T141 HydrophobicContact CD1-CG2 4.39Å; S130-T141 WeakPolarHBondContact CA-OG1 3.13Å; S130-T141 WeakPolarHBondContact OG-CB 3.36Å; S130-T141 PolarHBondContact OG-OG1 3.06Å; S137-T141 VanDerWaalsContact O-CG2 3.25Å; S137-T141 WeakPolarHBondContact O-CG2 3.42Å; S137-T141 PolarHBondContact O-N 2.94Å; S137-T141 VanDerWaalsContact O-N 3.07Å; S137-T141 PolarHBondContact O-OG1 3.39Å; K138-T141 PolarHBondContact O-N 2.97Å; K138-T141 PolarHBondContact O-OG1 2.95Å; T141-C144 PolarHBondContact O-N 3.12Å; T141-S145 VanDerWaalsContact O-CB 3.3Å; T141-S145 WeakPolarHBondContact O-CB 3.21Å; T141-S145 PolarHBondContact O-N 3.41Å
142	V	98.3	Very high	95.9	Very high	13 Å²	13	57 Å²	57	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-45.9	175.4	170.5	0	0	0	0	110.8	S130 K138 E140 S145 Q146 F177 I181 L182	S130-V142 PolarHBondContact OG-N 2.96Å; S130-V142 VanDerWaalsContact OG-N 3.16Å; K138-V142 HydrophobicContact CG-CG2 4.2Å; K138-V142 WeakPolarHBondContact O-CB 3.15Å; K138-V142 WeakPolarHBondContact O-CG2 3.4Å; K138-V142 PolarHBondContact O-N 3.42Å; E140-V142 VanDerWaalsContact C-N 3.31Å; E140-V142 PolarHBondContact O-N 3.02Å; V142-S145 PolarHBondContact O-N 3.14Å; V142-Q146 WeakPolarHBondContact O-CB 3.31Å; V142-Q146 PolarHBondContact O-N 3.3Å; V142-F177 HydrophobicContact CG1-CZ 4.12Å; V142-I181 HydrophobicContact CG2-CG2 3.63Å; V142-L182 HydrophobicContact CG1-CD2 3.52Å
143	T	98.3	Very high	96	Very high	51 Å²	51	57.4 Å²	57.4	31%	0.313	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-46.9	179.8	-57.1	0	0	0	0	110.9	Q139 E140 Q146 Q147	Q139-T143 PolarHBondContact NE2-OG1 3.38Å; Q139-T143 WeakPolarHBondContact O-CB 3.44Å; Q139-T143 PolarHBondContact O-N 2.82Å; Q139-T143 PolarHBondContact O-OG1 2.95Å; E140-T143 WeakPolarHBondContact O-CB 3.33Å; E140-T143 PolarHBondContact O-N 3.2Å; E140-T143 VanDerWaalsContact O-N 3.13Å; T143-Q146 PolarHBondContact O-N 3.21Å; T143-Q147 WeakPolarHBondContact O-CB 3.39Å; T143-Q147 VanDerWaalsContact O-CG 3.27Å; T143-Q147 WeakPolarHBondContact O-CG 3.31Å; T143-Q147 PolarHBondContact O-N 3.36Å
144	C	98.5	Very high	96.3	Very high	26 Å²	26	61.7 Å²	61.7	18%	0.176	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-40.7	178	-66.6	0	0	0	0	112.5	Y126 E140 T141 Q147 A148	Y126-C144 HydrophobicContact CD1-CB 3.61Å; Y126-C144 HydrophobicContact CD2-CB 3.68Å; Y126-C144 HydrophobicContact CE1-CB 3.58Å; Y126-C144 HydrophobicContact CE2-CB 3.66Å; Y126-C144 HydrophobicContact CG-CB 3.65Å; E140-C144 PolarHBondContact O-N 3.44Å; E140-C144 PolarHBondContact O-SG 3.4Å; E140-C144 VanDerWaalsContact O-SG 3.37Å; T141-C144 PolarHBondContact O-N 3.12Å; C144-Q147 PolarHBondContact O-N 3.07Å; C144-A148 WeakPolarHBondContact O-CB 3.07Å; C144-A148 PolarHBondContact O-N 3.47Å
145	S	98.7	Very high	96.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.3	-51.7	174.4	177.6	0	0	0	0	111	G123 T141 V142 Q147 A148 Y149 F177	G123-S145 PolarHBondContact O-OG 2.99Å; T141-S145 VanDerWaalsContact O-CB 3.3Å; T141-S145 WeakPolarHBondContact O-CB 3.21Å; T141-S145 PolarHBondContact O-N 3.41Å; V142-S145 PolarHBondContact O-N 3.14Å; S145-Q147 PolarHBondContact O-N 3.21Å; S145-A148 PolarHBondContact O-N 2.92Å; S145-Y149 WeakPolarHBondContact O-CD2 3.37Å; S145-Y149 PolarHBondContact O-N 3.02Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.34Å; S145-F177 WeakPolarHBondContact OG-CD2 3.15Å; S145-F177 WeakPolarHBondContact OG-CE2 3.3Å
146	Q	98.7	Very high	97.3	Very high	72 Å²	72	55.5 Å²	55.5	34%	0.336	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-43.5	-179.4	-172.5	174	6.4	0	0	112.1	V142 T143 Y149 Q150 F177	V142-Q146 WeakPolarHBondContact O-CB 3.31Å; V142-Q146 PolarHBondContact O-N 3.3Å; T143-Q146 PolarHBondContact O-N 3.21Å; Q146-Y149 PolarHBondContact O-N 3.39Å; Q146-Q150 VanDerWaalsContact O-CB 3.32Å; Q146-Q150 WeakPolarHBondContact O-CB 3.35Å; Q146-Q150 PolarHBondContact O-N 3.44Å; Q146-F177 HydrophobicContact CB-CE1 3.82Å; Q146-F177 HydrophobicContact CB-CZ 3.87Å; Q146-F177 HydrophobicContact CG-CE1 4.16Å
147	Q	98.7	Very high	97.7	Very high	123 Å²	123	53.3 Å²	53.3	58%	0.575	26%	0.261	S	S	*	.	H	α-helix	trans	-60.4	-46.8	177.6	-75.7	174	-8.5	0	0	111.9	T143 C144 S145 Q150 E151	T143-Q147 WeakPolarHBondContact O-CB 3.39Å; T143-Q147 VanDerWaalsContact O-CG 3.27Å; T143-Q147 WeakPolarHBondContact O-CG 3.31Å; T143-Q147 PolarHBondContact O-N 3.36Å; C144-Q147 PolarHBondContact O-N 3.07Å; S145-Q147 PolarHBondContact O-N 3.21Å; Q147-Q150 PolarHBondContact O-N 3.33Å; Q147-E151 WeakPolarHBondContact O-CB 3.21Å; Q147-E151 PolarHBondContact O-N 3.14Å
148	A	98.8	Very high	97.9	Very high	5 Å²	5	54.5 Å²	54.5	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-44	-179.9	0	0	0	0	0	112	K122 C144 S145 A152	K122-A148 HydrophobicContact CB-CB 4.04Å; K122-A148 HydrophobicContact CD-CB 4.18Å; K122-A148 HydrophobicContact CG-CB 3.92Å; C144-A148 WeakPolarHBondContact O-CB 3.07Å; C144-A148 PolarHBondContact O-N 3.47Å; S145-A148 PolarHBondContact O-N 2.92Å; A148-A152 WeakPolarHBondContact O-CB 3.25Å; A148-A152 PolarHBondContact O-N 3.21Å
149	Y	98.9	Very high	98.1	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-41.6	175	-74.8	-52.7	0	0	0	112.6	K120 G123 D124 R127 S145 Q146 A152 F153 L170 N173 F174 F177	K120-Y149 HydrophobicContact CG-CE1 4.49Å; G123-Y149 VanDerWaalsContact C-CZ 3.42Å; D124-Y149 VanDerWaalsContact CA-OH 3.31Å; D124-Y149 WeakPolarHBondContact CA-OH 3.45Å; D124-Y149 PolarHBondContact N-OH 3.14Å; D124-Y149 PolarHBondContact OD1-OH 3.36Å; R127-Y149 PolarHBondContact NE-OH 3.5Å; S145-Y149 WeakPolarHBondContact O-CD2 3.37Å; S145-Y149 PolarHBondContact O-N 3.02Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.34Å; Q146-Y149 PolarHBondContact O-N 3.39Å; Y149-A152 PolarHBondContact O-N 3.34Å; Y149-F153 VanDerWaalsContact O-CB 3.24Å; Y149-F153 WeakPolarHBondContact O-CB 3.3Å; Y149-F153 PolarHBondContact O-N 3.03Å; Y149-L170 HydrophobicContact CD1-CD1 3.66Å; Y149-L170 HydrophobicContact CE1-CD1 4.37Å; Y149-N173 HydrophobicContact CE1-CB 4.13Å; Y149-F174 VanDerWaalsContact CB-CD2 3.44Å; Y149-F174 VanDerWaalsContact CB-CE2 3.49Å; Y149-F174 HydrophobicContact CD1-CB 4.07Å; Y149-F174 HydrophobicContact CD1-CD2 4.47Å; Y149-F174 HydrophobicContact CD1-CG 4.33Å; Y149-F174 AromaticContact CD2-CD2 3.64Å; Y149-F174 HydrophobicContact CD2-CD2 3.64Å; Y149-F174 HydrophobicContact CD2-CE2 4.06Å; Y149-F174 HydrophobicContact CD2-CG 4.29Å; Y149-F174 HydrophobicContact CE2-CD2 4.46Å; Y149-F174 HydrophobicContact CG-CB 4.08Å; Y149-F174 AromaticContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CE2 4.1Å; Y149-F174 AromaticContact CG-CG 3.86Å; Y149-F174 HydrophobicContact CG-CG 3.86Å; Y149-F177 HydrophobicContact CD2-CB 4.18Å; Y149-F177 HydrophobicContact CD2-CD1 4.25Å; Y149-F177 HydrophobicContact CD2-CG 4.08Å; Y149-F177 HydrophobicContact CE2-CB 3.71Å; Y149-F177 HydrophobicContact CE2-CD2 4.21Å; Y149-F177 AromaticContact CE2-CG 3.9Å; Y149-F177 HydrophobicContact CE2-CG 3.9Å
150	Q	98.6	Very high	98.1	Very high	66 Å²	66	50.1 Å²	50.1	31%	0.308	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-45.1	179.1	-167.4	66.6	45.5	0	0	111.3	Q146 Q147 A152 F153 E154	Q146-Q150 VanDerWaalsContact O-CB 3.32Å; Q146-Q150 WeakPolarHBondContact O-CB 3.35Å; Q146-Q150 PolarHBondContact O-N 3.44Å; Q147-Q150 PolarHBondContact O-N 3.33Å; Q150-A152 VanDerWaalsContact C-N 3.34Å; Q150-A152 PolarHBondContact O-N 3.28Å; Q150-F153 PolarHBondContact O-N 3.45Å; Q150-F153 VanDerWaalsContact O-N 3.11Å; Q150-E154 PolarHBondContact NE2-OE1 3.16Å; Q150-E154 WeakPolarHBondContact O-CG 3.35Å; Q150-E154 PolarHBondContact O-N 3.47Å
151	E	98.5	Very high	98	Very high	85 Å²	85	49.6 Å²	49.6	40%	0.397	25%	0.248	S	C	.	.	H	α-helix	trans	-60.2	-45	176.1	-169.5	-172.8	165.7	0	0	111.1	K115 L119 Q147 F153 I155	K115-E151 VanDerWaalsContact CE-OE1 3.31Å; K115-E151 WeakPolarHBondContact CE-OE1 3.39Å; K115-E151 IonicContact NZ-OE1 2.69Å; K115-E151 PolarHBondContact NZ-OE1 2.87Å; K115-E151 VanDerWaalsContact NZ-OE1 3.09Å; L119-E151 HydrophobicContact CD1-CB 4.06Å; L119-E151 HydrophobicContact CD1-CG 3.68Å; Q147-E151 WeakPolarHBondContact O-CB 3.21Å; Q147-E151 PolarHBondContact O-N 3.14Å; E151-F153 VanDerWaalsContact C-N 3.26Å; E151-F153 PolarHBondContact O-N 2.93Å; E151-I155 HydrophobicContact CG-CD1 4.13Å; E151-I155 WeakPolarHBondContact O-CD1 3.43Å; E151-I155 WeakPolarHBondContact O-CG1 3.41Å; E151-I155 PolarHBondContact O-N 3.46Å
152	A	98.8	Very high	98	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.8	-40.8	174.8	0	0	0	0	0	111.6	V116 L119 A148 Y149 Q150 S156 L170	V116-A152 HydrophobicContact CG1-CB 4.35Å; L119-A152 HydrophobicContact CB-CB 3.65Å; A148-A152 WeakPolarHBondContact O-CB 3.25Å; A148-A152 PolarHBondContact O-N 3.21Å; Y149-A152 PolarHBondContact O-N 3.34Å; Q150-A152 VanDerWaalsContact C-N 3.34Å; Q150-A152 PolarHBondContact O-N 3.28Å; A152-S156 VanDerWaalsContact O-CB 3.27Å; A152-S156 WeakPolarHBondContact O-CB 3.35Å; A152-S156 PolarHBondContact O-N 2.56Å; A152-S156 PolarHBondContact O-OG 3.46Å; A152-L170 VanDerWaalsContact C-CD2 3.48Å; A152-L170 HydrophobicContact CB-CD1 3.83Å; A152-L170 HydrophobicContact CB-CD2 3.65Å; A152-L170 HydrophobicContact CB-CG 4.41Å
153	F	98.4	Very high	97.9	Very high	25 Å²	25	49.5 Å²	49.5	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-69.6	-43.9	-174.7	-168.6	-113.5	0	0	0	111.8	Y149 Q150 E151 S156 K157 L170 F174 L191	Y149-F153 VanDerWaalsContact O-CB 3.24Å; Y149-F153 WeakPolarHBondContact O-CB 3.3Å; Y149-F153 PolarHBondContact O-N 3.03Å; Q150-F153 PolarHBondContact O-N 3.45Å; Q150-F153 VanDerWaalsContact O-N 3.11Å; E151-F153 VanDerWaalsContact C-N 3.26Å; E151-F153 PolarHBondContact O-N 2.93Å; F153-S156 WeakPolarHBondContact CA-OG 3.39Å; F153-S156 PolarHBondContact O-N 3.11Å; F153-S156 PolarHBondContact O-OG 2.83Å; F153-K157 HydrophobicContact CD1-CD 4.15Å; F153-K157 HydrophobicContact CE1-CD 3.86Å; F153-K157 HydrophobicContact CZ-CD 4.26Å; F153-K157 WeakPolarHBondContact O-CG 3.22Å; F153-K157 PolarHBondContact O-N 3.24Å; F153-L170 HydrophobicContact CB-CD2 4.15Å; F153-L170 HydrophobicContact CD2-CD2 4.22Å; F153-F174 HydrophobicContact CB-CE1 4.42Å; F153-L191 HydrophobicContact CD2-CD1 4.49Å; F153-L191 HydrophobicContact CE1-CD1 4.23Å; F153-L191 HydrophobicContact CE2-CD1 3.55Å; F153-L191 HydrophobicContact CZ-CD1 3.37Å
154	E	98.2	Very high	97.8	Very high	102 Å²	102	49 Å²	49	48%	0.477	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-47.3	175.5	-65.1	-50.3	141.4	0	0	111.8	Q150 S156 K157 S158	Q150-E154 PolarHBondContact NE2-OE1 3.16Å; Q150-E154 WeakPolarHBondContact O-CG 3.35Å; Q150-E154 PolarHBondContact O-N 3.47Å; E154-S156 PolarHBondContact O-N 3.2Å; E154-K157 PolarHBondContact O-N 3.23Å; E154-S158 PolarHBondContact O-N 2.87Å
155	I	98.5	Very high	97.7	Very high	29 Å²	29	48.8 Å²	48.8	15%	0.149	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-43.6	177.4	-60.6	164.2	0	0	0	110.4	P112 K115 V116 L119 E151 K157 S158 E159	P112-I155 HydrophobicContact CB-CG2 4.22Å; K115-I155 HydrophobicContact CD-CD1 3.79Å; K115-I155 HydrophobicContact CG-CD1 4.06Å; V116-I155 HydrophobicContact CG2-CB 3.8Å; V116-I155 HydrophobicContact CG2-CG2 3.55Å; L119-I155 HydrophobicContact CD1-CD1 3.77Å; E151-I155 HydrophobicContact CG-CD1 4.13Å; E151-I155 WeakPolarHBondContact O-CD1 3.43Å; E151-I155 WeakPolarHBondContact O-CG1 3.41Å; E151-I155 PolarHBondContact O-N 3.46Å; I155-K157 VanDerWaalsContact C-N 3.26Å; I155-K157 PolarHBondContact O-N 3.45Å; I155-S158 PolarHBondContact O-N 2.89Å; I155-S158 PolarHBondContact O-OG 2.83Å; I155-E159 HydrophobicContact CG2-CG 4.09Å; I155-E159 WeakPolarHBondContact O-CB 3.49Å; I155-E159 WeakPolarHBondContact O-CG 3.38Å; I155-E159 PolarHBondContact O-N 3.42Å
156	S	98.3	Very high	97.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-31.5	-178.7	76	0	0	0	0	112.9	A152 F153 E154 M160	A152-S156 VanDerWaalsContact O-CB 3.27Å; A152-S156 WeakPolarHBondContact O-CB 3.35Å; A152-S156 PolarHBondContact O-N 2.56Å; A152-S156 PolarHBondContact O-OG 3.46Å; F153-S156 WeakPolarHBondContact CA-OG 3.39Å; F153-S156 PolarHBondContact O-N 3.11Å; F153-S156 PolarHBondContact O-OG 2.83Å; E154-S156 PolarHBondContact O-N 3.2Å; S156-M160 VanDerWaalsContact O-CB 3.3Å; S156-M160 WeakPolarHBondContact O-CB 3.47Å; S156-M160 PolarHBondContact O-N 3.38Å
157	K	97	Very high	97.7	Very high	103 Å²	103	47.6 Å²	47.6	45%	0.448	23%	0.234	S	C	.	.	H	α-helix	trans	-70.2	-36.9	177.9	-85.1	-176.4	163.5	179.6	0	112.6	F153 E154 I155	F153-K157 HydrophobicContact CD1-CD 4.15Å; F153-K157 HydrophobicContact CE1-CD 3.86Å; F153-K157 HydrophobicContact CZ-CD 4.26Å; F153-K157 WeakPolarHBondContact O-CG 3.22Å; F153-K157 PolarHBondContact O-N 3.24Å; E154-K157 PolarHBondContact O-N 3.23Å; I155-K157 VanDerWaalsContact C-N 3.26Å; I155-K157 PolarHBondContact O-N 3.45Å
158	S	96.1	Very high	97.6	Very high	84 Å²	84	41.8 Å²	41.8	59%	0.587	21%	0.207	S	C	*	.	H	α-helix	trans	-85.1	-34.1	-179.1	65.3	0	0	0	0	113.3	E154 I155	E154-S158 PolarHBondContact O-N 2.87Å; I155-S158 PolarHBondContact O-N 2.89Å; I155-S158 PolarHBondContact O-OG 2.83Å
159	E	97.4	Very high	97.6	Very high	119 Å²	119	42 Å²	42	56%	0.556	21%	0.21	S	C	*	.	H	α-helix	trans	-107.5	-9.3	-168	-56.4	-57.2	135.5	0	0	114.6	P112 I155	P112-E159 HydrophobicContact CB-CB 3.53Å; P112-E159 HydrophobicContact CB-CG 3.72Å; P112-E159 HydrophobicContact CG-CB 3.96Å; P112-E159 HydrophobicContact CG-CG 3.88Å; I155-E159 HydrophobicContact CG2-CG 4.09Å; I155-E159 WeakPolarHBondContact O-CB 3.49Å; I155-E159 WeakPolarHBondContact O-CG 3.38Å; I155-E159 PolarHBondContact O-N 3.42Å
160	M	96.6	Very high	97.6	Very high	11 Å²	11	42 Å²	42	5%	0.054	21%	0.21	C	C	.	.	S	Bend	trans	-132.6	140.3	-169.9	-48.4	176.9	67.7	0	0	112	E113 V116 S156 H164 I166 R167	E113-M160 HydrophobicContact CG-CE 4.01Å; V116-M160 HydrophobicContact CB-SD 3.97Å; V116-M160 HydrophobicContact CG1-SD 3.96Å; V116-M160 HydrophobicContact CG2-SD 3.8Å; S156-M160 VanDerWaalsContact O-CB 3.3Å; S156-M160 WeakPolarHBondContact O-CB 3.47Å; S156-M160 PolarHBondContact O-N 3.38Å; M160-H164 HydrophobicContact CB-CB 4.32Å; M160-H164 HydrophobicContact CE-CB 4.14Å; M160-H164 WeakPolarHBondContact CE-CE1 3.3Å; M160-H164 WeakPolarHBondContact CE-ND1 3.42Å; M160-I166 HydrophobicContact CE-CB 3.75Å; M160-I166 HydrophobicContact CE-CG2 4.02Å; M160-R167 HydrophobicContact CB-CB 4.39Å; M160-R167 HydrophobicContact CE-CB 4.4Å; M160-R167 PolarHBondContact O-NH1 3.27Å
161	Q	96	Very high	97.6	Very high	119 Å²	119	39 Å²	39	56%	0.556	20%	0.196	S	C	*	.			trans	-63.3	145.8	174.6	-62.6	-59.8	-35.9	0	0	111	T163 H164 R167 E202	Q161-T163 PolarHBondContact O-N 2.89Å; Q161-T163 VanDerWaalsContact O-N 3.1Å; Q161-H164 WeakPolarHBondContact O-CB 3.27Å; Q161-H164 PolarHBondContact O-N 2.92Å; Q161-R167 WeakPolarHBondContact O-CD 3.36Å; Q161-E202 PolarHBondContact OE1-OE2 3.4Å
162	P	97.2	Very high	97.6	Very high	13 Å²	13	36 Å²	36	8%	0.084	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-32.3	175.1	-28.3	35.3	0	0	0	114.4	H164 L168 E198 E202	P162-H164 VanDerWaalsContact C-N 3.31Å; P162-H164 PolarHBondContact O-N 3.19Å; P162-L168 WeakPolarHBondContact O-CG 3.4Å; P162-E198 HydrophobicContact CB-CB 3.89Å; P162-E198 HydrophobicContact CG-CB 4.37Å; P162-E202 WeakPolarHBondContact CD-OE2 3.16Å
163	T	96.5	Very high	97.6	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.037	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-3.2	-179.4	58.7	0	0	0	0	113.9	Q161 A199 E202 L206 S214	Q161-T163 PolarHBondContact O-N 2.89Å; Q161-T163 VanDerWaalsContact O-N 3.1Å; T163-A199 HydrophobicContact CG2-CB 4.31Å; T163-A199 WeakPolarHBondContact CG2-O 3.42Å; T163-E202 HydrophobicContact CG2-CB 3.81Å; T163-L206 WeakPolarHBondContact OG1-CD1 3.44Å; T163-S214 WeakPolarHBondContact O-CB 3.41Å; T163-S214 PolarHBondContact O-OG 3.39Å
164	H	96.2	Very high	97.7	Very high	40 Å²	40	36.2 Å²	36.2	19%	0.185	19%	0.185	C	C	.	.			trans	-67.5	128.3	-177.2	-171.3	-60.8	0	0	0	111.5	E113 M160 Q161 P162 I166 R167 L168	E113-H164 IonicContact OE1-CD2 3.09Å; E113-H164 IonicContact OE1-NE2 3.3Å; E113-H164 PolarHBondContact OE1-NE2 2.86Å; E113-H164 IonicContact OE2-NE2 3.46Å; M160-H164 HydrophobicContact CB-CB 4.32Å; M160-H164 HydrophobicContact CE-CB 4.14Å; M160-H164 WeakPolarHBondContact CE-CE1 3.3Å; M160-H164 WeakPolarHBondContact CE-ND1 3.42Å; Q161-H164 WeakPolarHBondContact O-CB 3.27Å; Q161-H164 PolarHBondContact O-N 2.92Å; P162-H164 VanDerWaalsContact C-N 3.31Å; P162-H164 PolarHBondContact O-N 3.19Å; H164-I166 PolarHBondContact ND1-N 2.99Å; H164-I166 VanDerWaalsContact ND1-N 3.11Å; H164-I166 PolarHBondContact O-N 3Å; H164-R167 HydrophobicContact CB-CB 4.28Å; H164-R167 PolarHBondContact O-N 2.88Å; H164-L168 PolarHBondContact O-N 3.03Å
165	P	96.7	Very high	97.7	Very high	22 Å²	22	31.3 Å²	31.3	14%	0.143	16%	0.162	C	C	.	.	H	α-helix	trans	-53.8	-43.8	-175.6	-26.6	30.4	0	0	0	114.7	L168 G169 D213 S214 I217	P165-L168 PolarHBondContact O-N 3.41Å; P165-G169 PolarHBondContact O-N 2.9Å; P165-D213 HydrophobicContact CB-CB 4.15Å; P165-D213 HydrophobicContact CG-CB 4.09Å; P165-S214 WeakPolarHBondContact CD-OG 3.22Å; P165-S214 WeakPolarHBondContact CG-OG 3.42Å; P165-I217 HydrophobicContact CB-CD1 4.15Å; P165-I217 VanDerWaalsContact O-CD1 3.29Å; P165-I217 WeakPolarHBondContact O-CD1 3.39Å
166	I	97.7	Very high	97.7	Very high	22 Å²	22	30.9 Å²	30.9	11%	0.113	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-42.1	176.7	-62.3	173.1	0	0	0	112.4	E113 V116 F117 M160 H164 G169 L170	E113-I166 HydrophobicContact CB-CD1 4.3Å; V116-I166 HydrophobicContact CB-CG2 4.33Å; V116-I166 HydrophobicContact CG1-CG2 3.77Å; F117-I166 HydrophobicContact CB-CD1 4.41Å; F117-I166 HydrophobicContact CB-CG2 4.45Å; F117-I166 HydrophobicContact CD2-CD1 3.97Å; F117-I166 HydrophobicContact CD2-CG1 4.19Å; M160-I166 HydrophobicContact CE-CB 3.75Å; M160-I166 HydrophobicContact CE-CG2 4.02Å; H164-I166 PolarHBondContact ND1-N 2.99Å; H164-I166 VanDerWaalsContact ND1-N 3.11Å; H164-I166 PolarHBondContact O-N 3Å; I166-G169 PolarHBondContact O-N 3.24Å; I166-L170 WeakPolarHBondContact O-CB 3.16Å; I166-L170 PolarHBondContact O-N 2.61Å
167	R	98.1	Very high	97.7	Very high	26 Å²	26	30.9 Å²	30.9	10%	0.098	16%	0.16	C	C	.	.	H	α-helix	trans	-66.1	-44.6	178.2	176.9	176.5	168.4	170.2	-5.8	110.9	M160 Q161 H164 L170 A171 E198	M160-R167 HydrophobicContact CB-CB 4.39Å; M160-R167 HydrophobicContact CE-CB 4.4Å; M160-R167 PolarHBondContact O-NH1 3.27Å; Q161-R167 WeakPolarHBondContact O-CD 3.36Å; H164-R167 HydrophobicContact CB-CB 4.28Å; H164-R167 PolarHBondContact O-N 2.88Å; R167-L170 WeakPolarHBondContact O-CB 3.3Å; R167-L170 PolarHBondContact O-N 3.02Å; R167-A171 PolarHBondContact O-N 3.36Å; R167-E198 IonicContact CZ-OE2 3.49Å; R167-E198 IonicContact NH2-OE2 2.84Å; R167-E198 PolarHBondContact NH2-OE2 3.4Å
168	L	98.5	Very high	97.8	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-61	-45	174.2	-74	168.6	0	0	0	111.8	P162 H164 P165 L170 A171 L172 A199 I217 M218 L221	P162-L168 WeakPolarHBondContact O-CG 3.4Å; H164-L168 PolarHBondContact O-N 3.03Å; P165-L168 PolarHBondContact O-N 3.41Å; L168-L170 VanDerWaalsContact C-N 3.28Å; L168-L170 PolarHBondContact O-N 3.05Å; L168-A171 PolarHBondContact O-N 3.28Å; L168-L172 PolarHBondContact O-N 3.13Å; L168-A199 HydrophobicContact CD1-CB 4.44Å; L168-A199 HydrophobicContact CD2-CB 3.74Å; L168-I217 HydrophobicContact CB-CB 4.17Å; L168-I217 HydrophobicContact CB-CD1 4.47Å; L168-I217 HydrophobicContact CB-CG2 3.62Å; L168-M218 HydrophobicContact CD1-CG 3.95Å; L168-M218 HydrophobicContact CD1-SD 4.4Å; L168-M218 HydrophobicContact CD2-CG 4.09Å; L168-L221 HydrophobicContact CD2-CD1 3.96Å
169	G	98.5	Very high	97.9	Very high	10 Å²	10	25.2 Å²	25.2	10%	0.103	12%	0.124	C	C	.	.	H	α-helix	trans	-64.2	-32.8	177.8	0	0	0	0	0	112.7	K120 P165 I166 N173	K120-G169 WeakPolarHBondContact CE-O 3.41Å; P165-G169 PolarHBondContact O-N 2.9Å; I166-G169 PolarHBondContact O-N 3.24Å; G169-N173 PolarHBondContact O-N 3.46Å; G169-N173 VanDerWaalsContact O-N 3.09Å
170	L	98.8	Very high	97.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.8	-49	171.3	170	63.1	0	0	0	111.2	V116 K120 Y149 A152 F153 I166 R167 L168 L172 N173 F174	V116-L170 HydrophobicContact CG1-CD2 4.04Å; K120-L170 HydrophobicContact CB-CD1 4Å; K120-L170 HydrophobicContact CD-CB 4.1Å; K120-L170 HydrophobicContact CG-CB 4.29Å; K120-L170 HydrophobicContact CG-CD1 3.97Å; Y149-L170 HydrophobicContact CD1-CD1 3.66Å; Y149-L170 HydrophobicContact CE1-CD1 4.37Å; A152-L170 VanDerWaalsContact C-CD2 3.48Å; A152-L170 HydrophobicContact CB-CD1 3.83Å; A152-L170 HydrophobicContact CB-CD2 3.65Å; A152-L170 HydrophobicContact CB-CG 4.41Å; F153-L170 HydrophobicContact CB-CD2 4.15Å; F153-L170 HydrophobicContact CD2-CD2 4.22Å; I166-L170 WeakPolarHBondContact O-CB 3.16Å; I166-L170 PolarHBondContact O-N 2.61Å; R167-L170 WeakPolarHBondContact O-CB 3.3Å; R167-L170 PolarHBondContact O-N 3.02Å; L168-L170 VanDerWaalsContact C-N 3.28Å; L168-L170 PolarHBondContact O-N 3.05Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.45Å; L170-N173 PolarHBondContact O-N 2.98Å; L170-F174 VanDerWaalsContact O-CB 3.25Å; L170-F174 WeakPolarHBondContact O-CB 3.45Å; L170-F174 PolarHBondContact O-N 3.13Å
171	A	98.8	Very high	97.8	Very high	2 Å²	2	25.4 Å²	25.4	2%	0.017	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-41.6	177.8	0	0	0	0	0	112.1	R167 L168 S175 A195	R167-A171 PolarHBondContact O-N 3.36Å; L168-A171 PolarHBondContact O-N 3.28Å; A171-S175 VanDerWaalsContact O-CB 3.32Å; A171-S175 WeakPolarHBondContact O-CB 3.49Å; A171-S175 PolarHBondContact O-N 3.4Å; A171-S175 PolarHBondContact O-OG 2.85Å; A171-A195 HydrophobicContact CB-CB 3.43Å; A171-A195 VanDerWaalsContact CB-CB 3.43Å
172	L	98.7	Very high	97.9	Very high	21 Å²	21	21.9 Å²	21.9	11%	0.11	11%	0.11	C	C	.	.	H	α-helix	trans	-57.3	-52.3	174.5	178.2	64.7	0	0	0	111.4	L168 L170 S175 V176 I217 L220 L221 N224	L168-L172 PolarHBondContact O-N 3.13Å; L170-L172 VanDerWaalsContact C-N 3.31Å; L170-L172 PolarHBondContact O-N 3.45Å; L172-S175 PolarHBondContact O-OG 3.46Å; L172-V176 VanDerWaalsContact O-CG2 3.31Å; L172-V176 WeakPolarHBondContact O-CG2 3.37Å; L172-V176 PolarHBondContact O-N 3.5Å; L172-I217 HydrophobicContact CB-CG2 4.3Å; L172-I217 HydrophobicContact CD2-CG2 4.2Å; L172-L220 HydrophobicContact CD1-CB 4.09Å; L172-L220 HydrophobicContact CD2-CB 3.92Å; L172-L220 HydrophobicContact CD2-CD1 3.9Å; L172-L221 HydrophobicContact CB-CD2 3.94Å; L172-L221 HydrophobicContact CB-CG 4.25Å; L172-L221 HydrophobicContact CD1-CD2 4Å; L172-L221 HydrophobicContact CD1-CG 4.21Å; L172-N224 VanDerWaalsContact CD1-ND2 3.33Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.35Å
173	N	98.6	Very high	97.8	Very high	28 Å²	28	28 Å²	28	15%	0.15	14%	0.142	C	C	.	.	H	α-helix	trans	-72	-35	-176.5	-75.1	16.2	0	0	0	113	K120 D124 Y149 G169 L170 V176 F177	K120-N173 PolarHBondContact NZ-ND2 2.88Å; D124-N173 VanDerWaalsContact OD1-CB 3.3Å; D124-N173 WeakPolarHBondContact OD1-CB 3.39Å; D124-N173 PolarHBondContact OD1-ND2 3.21Å; D124-N173 PolarHBondContact OD2-ND2 3.31Å; Y149-N173 HydrophobicContact CE1-CB 4.13Å; G169-N173 PolarHBondContact O-N 3.46Å; G169-N173 VanDerWaalsContact O-N 3.09Å; L170-N173 PolarHBondContact O-N 2.98Å; N173-V176 PolarHBondContact O-N 3.48Å; N173-F177 PolarHBondContact O-N 3.39Å
174	F	98.8	Very high	97.9	Very high	2 Å²	2	29 Å²	29	1%	0.009	15%	0.149	C	C	.	.	H	α-helix	trans	-73.2	-34.3	179.3	-168.1	-167.8	0	0	0	111.8	Y149 F153 L170 F177 Y178 L191	Y149-F174 VanDerWaalsContact CB-CD2 3.44Å; Y149-F174 VanDerWaalsContact CB-CE2 3.49Å; Y149-F174 HydrophobicContact CD1-CB 4.07Å; Y149-F174 HydrophobicContact CD1-CD2 4.47Å; Y149-F174 HydrophobicContact CD1-CG 4.33Å; Y149-F174 AromaticContact CD2-CD2 3.64Å; Y149-F174 HydrophobicContact CD2-CD2 3.64Å; Y149-F174 HydrophobicContact CD2-CE2 4.06Å; Y149-F174 HydrophobicContact CD2-CG 4.29Å; Y149-F174 HydrophobicContact CE2-CD2 4.46Å; Y149-F174 HydrophobicContact CG-CB 4.08Å; Y149-F174 AromaticContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CD2 3.63Å; Y149-F174 HydrophobicContact CG-CE2 4.1Å; Y149-F174 AromaticContact CG-CG 3.86Å; Y149-F174 HydrophobicContact CG-CG 3.86Å; F153-F174 HydrophobicContact CB-CE1 4.42Å; L170-F174 VanDerWaalsContact O-CB 3.25Å; L170-F174 WeakPolarHBondContact O-CB 3.45Å; L170-F174 PolarHBondContact O-N 3.13Å; F174-F177 HydrophobicContact CD2-CB 4.28Å; F174-F177 AromaticContact CD2-CD1 3.78Å; F174-F177 HydrophobicContact CD2-CD1 3.78Å; F174-F177 HydrophobicContact CD2-CG 4.42Å; F174-F177 AromaticContact CE2-CD1 3.71Å; F174-F177 HydrophobicContact CE2-CD1 3.71Å; F174-F177 HydrophobicContact CE2-CE1 4.14Å; F174-F177 WeakPolarHBondContact O-CB 3.27Å; F174-F177 PolarHBondContact O-N 2.94Å; F174-Y178 HydrophobicContact CD1-CE2 4.11Å; F174-Y178 AromaticContact CD2-CD2 3.97Å; F174-Y178 HydrophobicContact CD2-CD2 3.97Å; F174-Y178 AromaticContact CD2-CE2 3.62Å; F174-Y178 HydrophobicContact CD2-CE2 3.62Å; F174-Y178 AromaticContact CE1-CE2 3.92Å; F174-Y178 HydrophobicContact CE1-CE2 3.92Å; F174-Y178 HydrophobicContact CE2-CD2 4.1Å; F174-Y178 HydrophobicContact CE2-CE1 4.37Å; F174-Y178 AromaticContact CE2-CE2 3.39Å; F174-Y178 HydrophobicContact CE2-CE2 3.39Å; F174-Y178 AromaticContact CE2-CZ 3.54Å; F174-Y178 HydrophobicContact CG-CD2 4.39Å; F174-Y178 AromaticContact CG-CE2 3.99Å; F174-Y178 HydrophobicContact CG-CE2 3.99Å; F174-Y178 AromaticContact CZ-CE2 3.57Å; F174-Y178 HydrophobicContact CZ-CE2 3.57Å; F174-Y178 AromaticContact CZ-CZ 3.58Å; F174-Y178 WeakPolarHBondContact CZ-OH 3.46Å; F174-Y178 VanDerWaalsContact O-CD2 3.22Å; F174-Y178 WeakPolarHBondContact O-CD2 2.99Å; F174-Y178 PolarHBondContact O-N 3.49Å; F174-L191 HydrophobicContact CB-CD2 3.82Å; F174-L191 HydrophobicContact CD1-CD2 3.74Å; F174-L191 HydrophobicContact CG-CD2 3.82Å
175	S	98.6	Very high	97.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-41.5	171	58.2	0	0	0	0	111.8	A171 L172 F177 Y178 Y179 A188	A171-S175 VanDerWaalsContact O-CB 3.32Å; A171-S175 WeakPolarHBondContact O-CB 3.49Å; A171-S175 PolarHBondContact O-N 3.4Å; A171-S175 PolarHBondContact O-OG 2.85Å; L172-S175 PolarHBondContact O-OG 3.46Å; S175-F177 VanDerWaalsContact C-N 3.3Å; S175-F177 PolarHBondContact O-N 2.98Å; S175-Y178 PolarHBondContact O-N 2.85Å; S175-Y178 VanDerWaalsContact O-N 3.16Å; S175-Y179 PolarHBondContact O-N 3.44Å; S175-A188 WeakPolarHBondContact CB-O 3.13Å; S175-A188 VanDerWaalsContact O-CB 3.27Å; S175-A188 WeakPolarHBondContact O-CB 3.46Å
176	V	98.4	Very high	97.9	Very high	19 Å²	19	32.9 Å²	32.9	12%	0.115	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-40	172.4	173	0	0	0	0	111.4	L172 N173 Y179 E180 W228	L172-V176 VanDerWaalsContact O-CG2 3.31Å; L172-V176 WeakPolarHBondContact O-CG2 3.37Å; L172-V176 PolarHBondContact O-N 3.5Å; N173-V176 PolarHBondContact O-N 3.48Å; V176-Y179 PolarHBondContact O-N 3.22Å; V176-E180 VanDerWaalsContact CG1-CD 3.43Å; V176-E180 HydrophobicContact CG1-CG 3.98Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.38Å; V176-E180 WeakPolarHBondContact O-CB 3.45Å; V176-E180 PolarHBondContact O-N 2.99Å; V176-W228 HydrophobicContact CG2-CH2 4.06Å; V176-W228 HydrophobicContact CG2-CZ2 4.01Å
177	F	98.7	Very high	97.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-46.9	173.2	170.8	-102	0	0	0	112.5	R127 V142 S145 Q146 Y149 N173 F174 S175 Y179 I181 L182	R127-F177 HydrophobicContact CB-CD2 4.25Å; R127-F177 HydrophobicContact CG-CD2 4.31Å; V142-F177 HydrophobicContact CG1-CZ 4.12Å; S145-F177 WeakPolarHBondContact OG-CD2 3.15Å; S145-F177 WeakPolarHBondContact OG-CE2 3.3Å; Q146-F177 HydrophobicContact CB-CE1 3.82Å; Q146-F177 HydrophobicContact CB-CZ 3.87Å; Q146-F177 HydrophobicContact CG-CE1 4.16Å; Y149-F177 HydrophobicContact CD2-CB 4.18Å; Y149-F177 HydrophobicContact CD2-CD1 4.25Å; Y149-F177 HydrophobicContact CD2-CG 4.08Å; Y149-F177 HydrophobicContact CE2-CB 3.71Å; Y149-F177 HydrophobicContact CE2-CD2 4.21Å; Y149-F177 AromaticContact CE2-CG 3.9Å; Y149-F177 HydrophobicContact CE2-CG 3.9Å; N173-F177 PolarHBondContact O-N 3.39Å; F174-F177 HydrophobicContact CD2-CB 4.28Å; F174-F177 AromaticContact CD2-CD1 3.78Å; F174-F177 HydrophobicContact CD2-CD1 3.78Å; F174-F177 HydrophobicContact CD2-CG 4.42Å; F174-F177 AromaticContact CE2-CD1 3.71Å; F174-F177 HydrophobicContact CE2-CD1 3.71Å; F174-F177 HydrophobicContact CE2-CE1 4.14Å; F174-F177 WeakPolarHBondContact O-CB 3.27Å; F174-F177 PolarHBondContact O-N 2.94Å; S175-F177 VanDerWaalsContact C-N 3.3Å; S175-F177 PolarHBondContact O-N 2.98Å; F177-Y179 VanDerWaalsContact C-N 3.25Å; F177-Y179 PolarHBondContact O-N 3.18Å; F177-I181 HydrophobicContact CD2-CB 3.73Å; F177-I181 HydrophobicContact CD2-CG1 3.76Å; F177-I181 HydrophobicContact CD2-CG2 4.09Å; F177-I181 HydrophobicContact CE2-CB 3.82Å; F177-I181 HydrophobicContact CE2-CG1 4.22Å; F177-I181 HydrophobicContact CE2-CG2 3.67Å; F177-I181 HydrophobicContact CZ-CG2 4.48Å; F177-I181 WeakPolarHBondContact O-CB 3.32Å; F177-I181 PolarHBondContact O-N 3.17Å; F177-L182 HydrophobicContact CD1-CD1 4.09Å; F177-L182 HydrophobicContact CD1-CG 4.33Å; F177-L182 HydrophobicContact CE1-CD1 3.36Å; F177-L182 HydrophobicContact CE1-CD2 4.43Å; F177-L182 HydrophobicContact CE1-CG 3.67Å; F177-L182 HydrophobicContact CZ-CD1 3.92Å; F177-L182 HydrophobicContact CZ-CD2 4.14Å; F177-L182 HydrophobicContact CZ-CG 3.79Å; F177-L182 PolarHBondContact O-N 3.33Å
178	Y	98.5	Very high	97.9	Very high	24 Å²	24	36.2 Å²	36.2	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-40.4	176.5	-80.5	-61.7	0	0	0	112	F174 S175 L182 N183 S184 K187 L191	F174-Y178 HydrophobicContact CD1-CE2 4.11Å; F174-Y178 AromaticContact CD2-CD2 3.97Å; F174-Y178 HydrophobicContact CD2-CD2 3.97Å; F174-Y178 AromaticContact CD2-CE2 3.62Å; F174-Y178 HydrophobicContact CD2-CE2 3.62Å; F174-Y178 AromaticContact CE1-CE2 3.92Å; F174-Y178 HydrophobicContact CE1-CE2 3.92Å; F174-Y178 HydrophobicContact CE2-CD2 4.1Å; F174-Y178 HydrophobicContact CE2-CE1 4.37Å; F174-Y178 AromaticContact CE2-CE2 3.39Å; F174-Y178 HydrophobicContact CE2-CE2 3.39Å; F174-Y178 AromaticContact CE2-CZ 3.54Å; F174-Y178 HydrophobicContact CG-CD2 4.39Å; F174-Y178 AromaticContact CG-CE2 3.99Å; F174-Y178 HydrophobicContact CG-CE2 3.99Å; F174-Y178 AromaticContact CZ-CE2 3.57Å; F174-Y178 HydrophobicContact CZ-CE2 3.57Å; F174-Y178 AromaticContact CZ-CZ 3.58Å; F174-Y178 WeakPolarHBondContact CZ-OH 3.46Å; F174-Y178 VanDerWaalsContact O-CD2 3.22Å; F174-Y178 WeakPolarHBondContact O-CD2 2.99Å; F174-Y178 PolarHBondContact O-N 3.49Å; S175-Y178 PolarHBondContact O-N 2.85Å; S175-Y178 VanDerWaalsContact O-N 3.16Å; Y178-L182 HydrophobicContact CD1-CD1 3.6Å; Y178-L182 HydrophobicContact CE1-CD1 3.73Å; Y178-L182 CarbonylContact O-C 3.53Å; Y178-N183 PolarHBondContact O-N 2.98Å; Y178-S184 PolarHBondContact O-N 2.99Å; Y178-K187 HydrophobicContact CD1-CB 3.87Å; Y178-K187 HydrophobicContact CD1-CD 4Å; Y178-K187 HydrophobicContact CD2-CB 4.48Å; Y178-K187 HydrophobicContact CE1-CB 4.33Å; Y178-K187 HydrophobicContact CE1-CD 3.91Å; Y178-K187 HydrophobicContact CG-CB 3.98Å; Y178-L191 HydrophobicContact CD2-CD2 3.99Å; Y178-L191 HydrophobicContact CE2-CD2 3.92Å
179	Y	98	Very high	97.9	Very high	45 Å²	45	37.1 Å²	37.1	18%	0.176	19%	0.187	C	C	.	.	H	α-helix	trans	-70.5	-64.3	179.6	-165.7	-98.2	0	0	0	111.7	S175 V176 F177 N183 P185 A188 W228 E231	S175-Y179 PolarHBondContact O-N 3.44Å; V176-Y179 PolarHBondContact O-N 3.22Å; F177-Y179 VanDerWaalsContact C-N 3.25Å; F177-Y179 PolarHBondContact O-N 3.18Å; Y179-N183 WeakPolarHBondContact O-CA 3.49Å; Y179-N183 PolarHBondContact O-N 3.22Å; Y179-P185 HydrophobicContact CD2-CB 3.92Å; Y179-P185 HydrophobicContact CE2-CB 3.79Å; Y179-A188 HydrophobicContact CD2-CB 4.26Å; Y179-W228 AromaticContact CD1-CD1 3.78Å; Y179-W228 AromaticContact CD1-CE2 3.93Å; Y179-W228 HydrophobicContact CD1-CG 4.5Å; Y179-W228 HydrophobicContact CD1-CZ2 4.46Å; Y179-W228 AromaticContact CD1-NE1 3.37Å; Y179-W228 HydrophobicContact CD2-CB 4.13Å; Y179-W228 AromaticContact CD2-CD1 3.62Å; Y179-W228 AromaticContact CD2-CD2 3.76Å; Y179-W228 HydrophobicContact CD2-CD2 3.76Å; Y179-W228 AromaticContact CD2-CE2 3.89Å; Y179-W228 HydrophobicContact CD2-CE3 4.45Å; Y179-W228 AromaticContact CD2-CG 3.59Å; Y179-W228 HydrophobicContact CD2-CG 3.59Å; Y179-W228 AromaticContact CD2-NE1 3.8Å; Y179-W228 AromaticContact CE1-CD1 3.45Å; Y179-W228 VanDerWaalsContact CE1-CD1 3.45Å; Y179-W228 HydrophobicContact CE1-CG 4.35Å; Y179-W228 AromaticContact CE1-NE1 3.47Å; Y179-W228 HydrophobicContact CE2-CB 3.69Å; Y179-W228 AromaticContact CE2-CD1 3.32Å; Y179-W228 HydrophobicContact CE2-CD2 4.14Å; Y179-W228 AromaticContact CE2-CG 3.45Å; Y179-W228 HydrophobicContact CE2-CG 3.45Å; Y179-W228 VanDerWaalsContact CE2-CG 3.45Å; Y179-W228 AromaticContact CE2-NE1 3.92Å; Y179-W228 AromaticContact CG-CD1 3.86Å; Y179-W228 HydrophobicContact CG-CD2 4.03Å; Y179-W228 AromaticContact CG-CE2 3.65Å; Y179-W228 HydrophobicContact CG-CG 4.14Å; Y179-W228 HydrophobicContact CG-CZ2 4.12Å; Y179-W228 AromaticContact CG-NE1 3.55Å; Y179-W228 AromaticContact CZ-CD1 3.23Å; Y179-W228 AromaticContact CZ-CG 3.86Å; Y179-W228 AromaticContact CZ-NE1 3.76Å; Y179-E231 PolarHBondContact OH-OE2 2.9Å
180	E	96.1	Very high	97.8	Very high	106 Å²	106	40.6 Å²	40.6	50%	0.495	21%	0.21	S	C	.	.	H	α-helix	trans	-77.2	-29.6	-167.6	-63.3	-177.7	166.3	0	0	113.6	R127 V176	R127-E180 IonicContact NH1-OE2 3.9Å; V176-E180 VanDerWaalsContact CG1-CD 3.43Å; V176-E180 HydrophobicContact CG1-CG 3.98Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.38Å; V176-E180 WeakPolarHBondContact O-CB 3.45Å; V176-E180 PolarHBondContact O-N 2.99Å
181	I	97.2	Very high	97.8	Very high	27 Å²	27	41.5 Å²	41.5	14%	0.138	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-44.6	-171.7	-52.9	-58	0	0	0	112.3	R127 E131 V142 F177	R127-I181 HydrophobicContact CG-CD1 4.12Å; R127-I181 HydrophobicContact CG-CG1 3.78Å; E131-I181 HydrophobicContact CG-CD1 3.91Å; V142-I181 HydrophobicContact CG2-CG2 3.63Å; F177-I181 HydrophobicContact CD2-CB 3.73Å; F177-I181 HydrophobicContact CD2-CG1 3.76Å; F177-I181 HydrophobicContact CD2-CG2 4.09Å; F177-I181 HydrophobicContact CE2-CB 3.82Å; F177-I181 HydrophobicContact CE2-CG1 4.22Å; F177-I181 HydrophobicContact CE2-CG2 3.67Å; F177-I181 HydrophobicContact CZ-CG2 4.48Å; F177-I181 WeakPolarHBondContact O-CB 3.32Å; F177-I181 PolarHBondContact O-N 3.17Å
182	L	96.9	Very high	97.8	Very high	46 Å²	46	41.4 Å²	41.4	24%	0.241	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-3.1	179.9	-67.2	-175.9	0	0	0	113.5	V142 F177 Y178 S184	V142-L182 HydrophobicContact CG1-CD2 3.52Å; F177-L182 HydrophobicContact CD1-CD1 4.09Å; F177-L182 HydrophobicContact CD1-CG 4.33Å; F177-L182 HydrophobicContact CE1-CD1 3.36Å; F177-L182 HydrophobicContact CE1-CD2 4.43Å; F177-L182 HydrophobicContact CE1-CG 3.67Å; F177-L182 HydrophobicContact CZ-CD1 3.92Å; F177-L182 HydrophobicContact CZ-CD2 4.14Å; F177-L182 HydrophobicContact CZ-CG 3.79Å; F177-L182 PolarHBondContact O-N 3.33Å; Y178-L182 HydrophobicContact CD1-CD1 3.6Å; Y178-L182 HydrophobicContact CE1-CD1 3.73Å; Y178-L182 CarbonylContact O-C 3.53Å; L182-S184 PolarHBondContact O-N 3.33Å; L182-S184 VanDerWaalsContact O-N 3.15Å; L182-S184 PolarHBondContact O-OG 3.46Å
183	N	96.1	Very high	97.8	Very high	141 Å²	141	46.1 Å²	46.1	75%	0.754	23%	0.234	S	C	*	.			trans	46.7	45.2	-177.3	-162.6	56.8	0	0	0	111.8	Y178 Y179 P185	Y178-N183 PolarHBondContact O-N 2.98Å; Y179-N183 WeakPolarHBondContact O-CA 3.49Å; Y179-N183 PolarHBondContact O-N 3.22Å; N183-P185 VanDerWaalsContact C-CD 3.43Å; N183-P185 WeakPolarHBondContact O-CD 3.25Å
184	S	97.3	Very high	97.7	Very high	26 Å²	26	47.3 Å²	47.3	18%	0.182	24%	0.244	C	C	.	.			trans	-122.1	68.7	-173.9	-65.2	0	0	0	0	109.9	Y178 L182 E186 K187 A188	Y178-S184 PolarHBondContact O-N 2.99Å; L182-S184 PolarHBondContact O-N 3.33Å; L182-S184 VanDerWaalsContact O-N 3.15Å; L182-S184 PolarHBondContact O-OG 3.46Å; S184-E186 VanDerWaalsContact C-N 3.27Å; S184-E186 PolarHBondContact O-N 2.65Å; S184-K187 PolarHBondContact O-N 3.47Å; S184-K187 VanDerWaalsContact O-N 3.14Å; S184-A188 PolarHBondContact O-N 3.08Å
185	P	96.6	Very high	97.7	Very high	17 Å²	17	47.8 Å²	47.8	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-32.7	-173.3	25	-34.2	0	0	0	113	Y179 N183 K187 A188 C189	Y179-P185 HydrophobicContact CD2-CB 3.92Å; Y179-P185 HydrophobicContact CE2-CB 3.79Å; N183-P185 VanDerWaalsContact C-CD 3.43Å; N183-P185 WeakPolarHBondContact O-CD 3.25Å; P185-K187 VanDerWaalsContact C-N 3.34Å; P185-K187 PolarHBondContact O-N 3.46Å; P185-A188 PolarHBondContact O-N 3.44Å; P185-C189 WeakPolarHBondContact O-CB 3.31Å; P185-C189 PolarHBondContact O-N 3.48Å; P185-C189 PolarHBondContact O-SG 2.9Å; P185-C189 VanDerWaalsContact O-SG 3.39Å
186	E	96.3	Very high	97.7	Very high	127 Å²	127	49.7 Å²	49.7	59%	0.593	26%	0.257	S	S	*	.	H	α-helix	trans	-64.2	-41.4	177.6	-56.6	72.5	-156.8	0	0	111.1	S184 S190	S184-E186 VanDerWaalsContact C-N 3.27Å; S184-E186 PolarHBondContact O-N 2.65Å; E186-S190 WeakPolarHBondContact O-CB 3.5Å; E186-S190 PolarHBondContact O-N 3.12Å
187	K	97.7	Very high	97.7	Very high	118 Å²	118	52.7 Å²	52.7	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-69	-40.8	176.3	-69.9	-176.6	-179.9	172.1	0	111.3	Y178 S184 P185 S190 L191	Y178-K187 HydrophobicContact CD1-CB 3.87Å; Y178-K187 HydrophobicContact CD1-CD 4Å; Y178-K187 HydrophobicContact CD2-CB 4.48Å; Y178-K187 HydrophobicContact CE1-CB 4.33Å; Y178-K187 HydrophobicContact CE1-CD 3.91Å; Y178-K187 HydrophobicContact CG-CB 3.98Å; S184-K187 PolarHBondContact O-N 3.47Å; S184-K187 VanDerWaalsContact O-N 3.14Å; P185-K187 VanDerWaalsContact C-N 3.34Å; P185-K187 PolarHBondContact O-N 3.46Å; K187-S190 PolarHBondContact O-N 2.79Å; K187-L191 WeakPolarHBondContact O-CB 3.45Å; K187-L191 PolarHBondContact O-N 3.12Å
188	A	98.1	Very high	97.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-52	176.6	0	0	0	0	0	111.1	S175 Y179 S184 P185 L191 A192 W228	S175-A188 WeakPolarHBondContact CB-O 3.13Å; S175-A188 VanDerWaalsContact O-CB 3.27Å; S175-A188 WeakPolarHBondContact O-CB 3.46Å; Y179-A188 HydrophobicContact CD2-CB 4.26Å; S184-A188 PolarHBondContact O-N 3.08Å; P185-A188 PolarHBondContact O-N 3.44Å; A188-L191 PolarHBondContact O-N 3.38Å; A188-A192 WeakPolarHBondContact O-CB 3.43Å; A188-A192 PolarHBondContact O-N 3.41Å; A188-W228 HydrophobicContact CB-CE3 4.13Å; A188-W228 HydrophobicContact CB-CZ3 3.97Å
189	C	98.1	Very high	97.6	Very high	20 Å²	20	54.4 Å²	54.4	14%	0.135	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-42.8	178.3	-72.4	0	0	0	0	112.2	P185 L191 A192 K193 L225	P185-C189 WeakPolarHBondContact O-CB 3.31Å; P185-C189 PolarHBondContact O-N 3.48Å; P185-C189 PolarHBondContact O-SG 2.9Å; P185-C189 VanDerWaalsContact O-SG 3.39Å; C189-L191 PolarHBondContact O-N 3.33Å; C189-A192 PolarHBondContact O-N 3.22Å; C189-K193 WeakPolarHBondContact O-CB 3.41Å; C189-K193 PolarHBondContact O-N 3.48Å; C189-L225 HydrophobicContact CB-CD2 4.09Å; C189-L225 WeakPolarHBondContact O-CD2 3.4Å
190	S	98	Very high	97.5	Very high	83 Å²	83	56.4 Å²	56.4	58%	0.58	29%	0.294	S	S	*	.	H	α-helix	trans	-59.8	-46.2	177.2	177.2	0	0	0	0	111.7	E186 K187 S194	E186-S190 WeakPolarHBondContact O-CB 3.5Å; E186-S190 PolarHBondContact O-N 3.12Å; K187-S190 PolarHBondContact O-N 2.79Å; S190-S194 WeakPolarHBondContact O-CB 3.29Å; S190-S194 PolarHBondContact O-N 2.9Å
191	L	98.4	Very high	97.5	Very high	20 Å²	20	55.3 Å²	55.3	11%	0.105	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-49.1	179.1	178	61.6	0	0	0	112.1	F153 F174 Y178 K187 A188 C189 K193 S194 A195	F153-L191 HydrophobicContact CD2-CD1 4.49Å; F153-L191 HydrophobicContact CE1-CD1 4.23Å; F153-L191 HydrophobicContact CE2-CD1 3.55Å; F153-L191 HydrophobicContact CZ-CD1 3.37Å; F174-L191 HydrophobicContact CB-CD2 3.82Å; F174-L191 HydrophobicContact CD1-CD2 3.74Å; F174-L191 HydrophobicContact CG-CD2 3.82Å; Y178-L191 HydrophobicContact CD2-CD2 3.99Å; Y178-L191 HydrophobicContact CE2-CD2 3.92Å; K187-L191 WeakPolarHBondContact O-CB 3.45Å; K187-L191 PolarHBondContact O-N 3.12Å; A188-L191 PolarHBondContact O-N 3.38Å; C189-L191 PolarHBondContact O-N 3.33Å; L191-K193 VanDerWaalsContact C-N 3.32Å; L191-K193 PolarHBondContact O-N 3.07Å; L191-S194 PolarHBondContact O-N 3.19Å; L191-A195 PolarHBondContact O-N 3.44Å
192	A	98.4	Very high	97.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-40.8	-179.1	0	0	0	0	0	111.6	A188 C189 F196 L221 L225 W228	A188-A192 WeakPolarHBondContact O-CB 3.43Å; A188-A192 PolarHBondContact O-N 3.41Å; C189-A192 PolarHBondContact O-N 3.22Å; A192-F196 WeakPolarHBondContact O-CB 3.18Å; A192-F196 PolarHBondContact O-N 3.25Å; A192-L221 HydrophobicContact CB-CD2 3.86Å; A192-L225 HydrophobicContact CB-CD1 4.3Å; A192-L225 HydrophobicContact CB-CD2 3.84Å; A192-L225 HydrophobicContact CB-CG 3.89Å; A192-W228 HydrophobicContact CB-CZ3 4.32Å
193	K	98.1	Very high	97.3	Very high	120 Å²	120	56.6 Å²	56.6	52%	0.522	31%	0.309	S	S	.	.	H	α-helix	trans	-66	-47	176.9	-175.5	174.9	-178	177.4	0	112	C189 L191 A195 F196 D197 L225	C189-K193 WeakPolarHBondContact O-CB 3.41Å; C189-K193 PolarHBondContact O-N 3.48Å; L191-K193 VanDerWaalsContact C-N 3.32Å; L191-K193 PolarHBondContact O-N 3.07Å; K193-A195 VanDerWaalsContact C-N 3.32Å; K193-A195 PolarHBondContact O-N 2.92Å; K193-F196 PolarHBondContact O-N 2.69Å; K193-D197 WeakPolarHBondContact CE-OD2 3.41Å; K193-D197 WeakPolarHBondContact CG-OD2 3.45Å; K193-D197 WeakPolarHBondContact O-CB 3.27Å; K193-D197 VanDerWaalsContact O-CG 3.31Å; K193-D197 PolarHBondContact O-N 2.89Å; K193-L225 HydrophobicContact CB-CD1 4.19Å; K193-L225 HydrophobicContact CB-CD2 4.11Å
194	S	98.3	Very high	97	Very high	52 Å²	52	58 Å²	58	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-56.6	-47.8	177	-161.1	0	0	0	0	111	S190 L191 F196 D197 E198	S190-S194 WeakPolarHBondContact O-CB 3.29Å; S190-S194 PolarHBondContact O-N 2.9Å; L191-S194 PolarHBondContact O-N 3.19Å; S194-F196 PolarHBondContact O-N 2.9Å; S194-D197 PolarHBondContact O-N 3.37Å; S194-E198 VanDerWaalsContact O-CB 3.3Å; S194-E198 WeakPolarHBondContact O-CB 3.44Å; S194-E198 WeakPolarHBondContact O-CG 3.27Å; S194-E198 PolarHBondContact O-N 3.47Å; S194-E198 PolarHBondContact OG-OE1 2.91Å
195	A	98.3	Very high	96.6	Very high	13 Å²	13	61.7 Å²	61.7	11%	0.107	34%	0.337	C	S	.	.	H	α-helix	trans	-64.3	-39.9	179.5	0	0	0	0	0	112.7	A171 L191 K193 A199 L221	A171-A195 HydrophobicContact CB-CB 3.43Å; A171-A195 VanDerWaalsContact CB-CB 3.43Å; L191-A195 PolarHBondContact O-N 3.44Å; K193-A195 VanDerWaalsContact C-N 3.32Å; K193-A195 PolarHBondContact O-N 2.92Å; A195-A199 VanDerWaalsContact O-CB 3.3Å; A195-A199 WeakPolarHBondContact O-CB 3.36Å; A195-A199 PolarHBondContact O-N 3.13Å; A195-A199 VanDerWaalsContact O-N 3.13Å; A195-L221 HydrophobicContact CB-CD1 4.31Å
196	F	98.1	Very high	96.2	Very high	40 Å²	40	62.3 Å²	62.3	18%	0.175	34%	0.34	C	S	.	.	H	α-helix	trans	-65.5	-49.2	176.4	-175.9	-91.9	0	0	0	111.7	A192 K193 S194 A199 I200 M218 L221 R222	A192-F196 WeakPolarHBondContact O-CB 3.18Å; A192-F196 PolarHBondContact O-N 3.25Å; K193-F196 PolarHBondContact O-N 2.69Å; S194-F196 PolarHBondContact O-N 2.9Å; F196-A199 PolarHBondContact O-N 3.34Å; F196-I200 HydrophobicContact CD1-CG1 3.78Å; F196-I200 HydrophobicContact CE1-CD1 3.79Å; F196-I200 HydrophobicContact CE1-CG1 3.46Å; F196-I200 VanDerWaalsContact CE1-CG1 3.46Å; F196-I200 HydrophobicContact CE2-CD1 4.38Å; F196-I200 HydrophobicContact CE2-CG1 4.37Å; F196-I200 HydrophobicContact CG-CG1 4.38Å; F196-I200 HydrophobicContact CZ-CD1 3.67Å; F196-I200 HydrophobicContact CZ-CG1 3.78Å; F196-I200 WeakPolarHBondContact O-CB 3.38Å; F196-I200 WeakPolarHBondContact O-CG1 3.24Å; F196-I200 PolarHBondContact O-N 2.98Å; F196-M218 HydrophobicContact CD2-CB 4.11Å; F196-M218 WeakPolarHBondContact CD2-O 2.97Å; F196-M218 HydrophobicContact CE2-CB 4.09Å; F196-M218 HydrophobicContact CE2-CE 4.47Å; F196-M218 WeakPolarHBondContact CE2-O 3.46Å; F196-L221 HydrophobicContact CD2-CB 4.48Å; F196-R222 HydrophobicContact CD2-CB 4.33Å; F196-R222 HydrophobicContact CE2-CB 3.92Å; F196-R222 HydrophobicContact CZ-CB 4.42Å
197	D	98.1	Very high	95.8	Very high	81 Å²	81	60.5 Å²	60.5	43%	0.433	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-42.8	-177.6	-69.5	-15.1	0	0	0	111.5	K193 S194 A199 I200 A201	K193-D197 WeakPolarHBondContact CE-OD2 3.41Å; K193-D197 WeakPolarHBondContact CG-OD2 3.45Å; K193-D197 WeakPolarHBondContact O-CB 3.27Å; K193-D197 VanDerWaalsContact O-CG 3.31Å; K193-D197 PolarHBondContact O-N 2.89Å; S194-D197 PolarHBondContact O-N 3.37Å; D197-A199 PolarHBondContact O-N 3.05Å; D197-I200 PolarHBondContact O-N 3.29Å; D197-A201 WeakPolarHBondContact O-CB 3.32Å; D197-A201 PolarHBondContact O-N 2.85Å; D197-A201 VanDerWaalsContact O-N 3.08Å
198	E	97.7	Very high	95.2	Very high	61 Å²	61	63.9 Å²	63.9	29%	0.285	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-43.4	174.7	-71.8	166.4	-149.9	0	0	111.6	P162 R167 S194 A201	P162-E198 HydrophobicContact CB-CB 3.89Å; P162-E198 HydrophobicContact CG-CB 4.37Å; R167-E198 IonicContact CZ-OE2 3.49Å; R167-E198 IonicContact NH2-OE2 2.84Å; R167-E198 PolarHBondContact NH2-OE2 3.4Å; S194-E198 VanDerWaalsContact O-CB 3.3Å; S194-E198 WeakPolarHBondContact O-CB 3.44Å; S194-E198 WeakPolarHBondContact O-CG 3.27Å; S194-E198 PolarHBondContact O-N 3.47Å; S194-E198 PolarHBondContact OG-OE1 2.91Å; E198-A201 PolarHBondContact O-N 3.27Å
199	A	97.2	Very high	94.6	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-73.9	-35.2	179.9	0	0	0	0	0	113.2	T163 L168 A195 F196 D197 A201 E202 L203 M218	T163-A199 HydrophobicContact CG2-CB 4.31Å; T163-A199 WeakPolarHBondContact CG2-O 3.42Å; L168-A199 HydrophobicContact CD1-CB 4.44Å; L168-A199 HydrophobicContact CD2-CB 3.74Å; A195-A199 VanDerWaalsContact O-CB 3.3Å; A195-A199 WeakPolarHBondContact O-CB 3.36Å; A195-A199 PolarHBondContact O-N 3.13Å; A195-A199 VanDerWaalsContact O-N 3.13Å; F196-A199 PolarHBondContact O-N 3.34Å; D197-A199 PolarHBondContact O-N 3.05Å; A199-A201 VanDerWaalsContact C-N 3.29Å; A199-A201 PolarHBondContact O-N 3.49Å; A199-E202 PolarHBondContact O-N 2.99Å; A199-L203 WeakPolarHBondContact O-CA 3.16Å; A199-L203 WeakPolarHBondContact O-CB 3.48Å; A199-L203 PolarHBondContact O-N 2.94Å; A199-M218 HydrophobicContact CB-CE 3.88Å; A199-M218 HydrophobicContact CB-CG 4.31Å; A199-M218 HydrophobicContact CB-SD 3.93Å
200	I	96.6	Very high	94.2	Very high	86 Å²	86	72.4 Å²	72.4	44%	0.441	39%	0.393	S	S	.	.	H	α-helix	trans	-58.6	-44.4	171.8	-75	-81.5	0	0	0	110.2	F196 D197 E202 L203 M218	F196-I200 HydrophobicContact CD1-CG1 3.78Å; F196-I200 HydrophobicContact CE1-CD1 3.79Å; F196-I200 HydrophobicContact CE1-CG1 3.46Å; F196-I200 VanDerWaalsContact CE1-CG1 3.46Å; F196-I200 HydrophobicContact CE2-CD1 4.38Å; F196-I200 HydrophobicContact CE2-CG1 4.37Å; F196-I200 HydrophobicContact CG-CG1 4.38Å; F196-I200 HydrophobicContact CZ-CD1 3.67Å; F196-I200 HydrophobicContact CZ-CG1 3.78Å; F196-I200 WeakPolarHBondContact O-CB 3.38Å; F196-I200 WeakPolarHBondContact O-CG1 3.24Å; F196-I200 PolarHBondContact O-N 2.98Å; D197-I200 PolarHBondContact O-N 3.29Å; I200-E202 PolarHBondContact O-N 3.43Å; I200-L203 PolarHBondContact O-N 3.47Å; I200-M218 HydrophobicContact CB-CE 4.37Å; I200-M218 HydrophobicContact CD1-CE 3.71Å; I200-M218 HydrophobicContact CG1-CE 3.61Å
201	A	96.7	Very high	93.9	Very high	84 Å²	84	74 Å²	74	69%	0.694	39%	0.387	S	S	*	.	H	α-helix	trans	-63.2	-25.1	-177.1	0	0	0	0	0	113.5	D197 E198 A199	D197-A201 WeakPolarHBondContact O-CB 3.32Å; D197-A201 PolarHBondContact O-N 2.85Å; D197-A201 VanDerWaalsContact O-N 3.08Å; E198-A201 PolarHBondContact O-N 3.27Å; A199-A201 VanDerWaalsContact C-N 3.29Å; A199-A201 PolarHBondContact O-N 3.49Å
202	E	95.5	Very high	93.7	Very high	68 Å²	68	80.7 Å²	80.7	32%	0.318	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	7.6	-177.8	-66.1	-173.8	-159.7	0	0	113.3	Q161 P162 T163 A199 I200 D204 T205	Q161-E202 PolarHBondContact OE1-OE2 3.4Å; P162-E202 WeakPolarHBondContact CD-OE2 3.16Å; T163-E202 HydrophobicContact CG2-CB 3.81Å; A199-E202 PolarHBondContact O-N 2.99Å; I200-E202 PolarHBondContact O-N 3.43Å; E202-D204 PolarHBondContact O-N 2.82Å; E202-D204 VanDerWaalsContact O-N 3.17Å; E202-T205 WeakPolarHBondContact O-CB 3.16Å; E202-T205 PolarHBondContact O-N 3.37Å; E202-T205 PolarHBondContact O-OG1 2.97Å
203	L	92.6	Very high	93.5	Very high	32 Å²	32	84.9 Å²	84.9	17%	0.168	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-59.2	-34.4	-171.9	-171.2	62	0	0	0	113	A199 I200 T205 L206 Y211 T215 M218	A199-L203 WeakPolarHBondContact O-CA 3.16Å; A199-L203 WeakPolarHBondContact O-CB 3.48Å; A199-L203 PolarHBondContact O-N 2.94Å; I200-L203 PolarHBondContact O-N 3.47Å; L203-T205 PolarHBondContact O-N 3.48Å; L203-L206 HydrophobicContact CD1-CD2 4.3Å; L203-L206 VanDerWaalsContact O-CB 3.27Å; L203-L206 WeakPolarHBondContact O-CB 3.18Å; L203-L206 PolarHBondContact O-N 2.92Å; L203-Y211 HydrophobicContact CG-CE2 4.49Å; L203-T215 HydrophobicContact CD1-CG2 4.17Å; L203-M218 HydrophobicContact CD1-CE 4.35Å; L203-M218 HydrophobicContact CD1-SD 3.9Å; L203-M218 HydrophobicContact CD2-CE 4.46Å
204	D	91	Very high	93.4	Very high	171 Å²	171	79.2 Å²	79.2	91%	0.914	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-66.2	-14.9	179.2	-67.5	-24.7	0	0	0	113.5	E202	E202-D204 PolarHBondContact O-N 2.82Å; E202-D204 VanDerWaalsContact O-N 3.17Å
205	T	88.1	Confident	93.4	Very high	102 Å²	102	78.8 Å²	78.8	63%	0.626	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-86	-10.4	178.9	70.7	0	0	0	0	113.3	E202 L203	E202-T205 WeakPolarHBondContact O-CB 3.16Å; E202-T205 PolarHBondContact O-N 3.37Å; E202-T205 PolarHBondContact O-OG1 2.97Å; L203-T205 PolarHBondContact O-N 3.48Å
206	L	88.2	Confident	93.3	Very high	30 Å²	30	82.9 Å²	82.9	16%	0.157	43%	0.428	C	S	.	.			trans	-76.8	139	-169.2	-165.1	77.8	0	0	0	111.7	T163 L203 Y211	T163-L206 WeakPolarHBondContact OG1-CD1 3.44Å; L203-L206 HydrophobicContact CD1-CD2 4.3Å; L203-L206 VanDerWaalsContact O-CB 3.27Å; L203-L206 WeakPolarHBondContact O-CB 3.18Å; L203-L206 PolarHBondContact O-N 2.92Å; L206-Y211 HydrophobicContact CD2-CD2 3.99Å; L206-Y211 HydrophobicContact CD2-CG 4.37Å
207	N	87.8	Confident	93.3	Very high	90 Å²	90	82.4 Å²	82.4	48%	0.481	43%	0.427	S	S	.	.			trans	-75.3	160.8	174.6	66.7	32.9	0	0	0	112.3	E209 S210 Y211	N207-E209 VanDerWaalsContact C-N 3.26Å; N207-E209 PolarHBondContact O-N 3.34Å; N207-E209 PolarHBondContact OD1-N 3.37Å; N207-S210 PolarHBondContact O-N 2.96Å; N207-S210 WeakPolarHBondContact OD1-CB 3.32Å; N207-S210 PolarHBondContact OD1-N 3.39Å; N207-S210 PolarHBondContact OD1-OG 3.22Å; N207-S210 VanDerWaalsContact OD1-OG 3.13Å; N207-Y211 WeakPolarHBondContact O-CB 3.35Å; N207-Y211 PolarHBondContact O-N 2.95Å; N207-Y211 VanDerWaalsContact O-N 3.09Å
208	E	86	Confident	93.3	Very high	188 Å²	188	78.9 Å²	78.9	88%	0.879	41%	0.408	S	S	*	.	H	α-helix	trans	-61.6	-32.8	-177.7	-167.7	174.2	-174.7	0	0	112.8	Y211	E208-Y211 PolarHBondContact O-N 3.03Å
209	E	85.3	Confident	93.3	Very high	169 Å²	169	79 Å²	79	79%	0.79	41%	0.408	S	S	*	.	H	α-helix	trans	-65.1	-42.4	-179.2	-172.9	177.1	-173.7	0	0	112.3	N207	N207-E209 VanDerWaalsContact C-N 3.26Å; N207-E209 PolarHBondContact O-N 3.34Å; N207-E209 PolarHBondContact OD1-N 3.37Å
210	S	89.7	Confident	93.4	Very high	30 Å²	30	82.5 Å²	82.5	21%	0.21	43%	0.427	C	S	.	.	H	α-helix	trans	-88	-16.4	-179.5	-57.3	0	0	0	0	113.1	N207 K212 D213 S214	N207-S210 PolarHBondContact O-N 2.96Å; N207-S210 WeakPolarHBondContact OD1-CB 3.32Å; N207-S210 PolarHBondContact OD1-N 3.39Å; N207-S210 PolarHBondContact OD1-OG 3.22Å; N207-S210 VanDerWaalsContact OD1-OG 3.13Å; S210-K212 PolarHBondContact O-N 2.75Å; S210-D213 PolarHBondContact O-N 2.88Å; S210-S214 WeakPolarHBondContact O-CB 3.39Å; S210-S214 PolarHBondContact O-N 3.49Å; S210-S214 PolarHBondContact O-OG 3.47Å
211	Y	92	Very high	93.5	Very high	116 Å²	116	78.4 Å²	78.4	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-54.8	-47.5	-172.9	-167.4	-87.8	0	0	0	114	L203 L206 N207 E208 D213 T215	L203-Y211 HydrophobicContact CG-CE2 4.49Å; L206-Y211 HydrophobicContact CD2-CD2 3.99Å; L206-Y211 HydrophobicContact CD2-CG 4.37Å; N207-Y211 WeakPolarHBondContact O-CB 3.35Å; N207-Y211 PolarHBondContact O-N 2.95Å; N207-Y211 VanDerWaalsContact O-N 3.09Å; E208-Y211 PolarHBondContact O-N 3.03Å; Y211-D213 PolarHBondContact O-N 3.47Å; Y211-T215 HydrophobicContact CD1-CG2 4.09Å; Y211-T215 HydrophobicContact CE1-CG2 3.79Å; Y211-T215 HydrophobicContact CE2-CG2 4.25Å; Y211-T215 HydrophobicContact CG-CG2 4.45Å; Y211-T215 WeakPolarHBondContact O-CB 3.15Å; Y211-T215 VanDerWaalsContact O-CG2 3.27Å; Y211-T215 WeakPolarHBondContact O-CG2 3.17Å; Y211-T215 PolarHBondContact O-N 3.05Å; Y211-T215 PolarHBondContact O-OG1 3.47Å
212	K	94	Very high	93.5	Very high	162 Å²	162	80 Å²	80	70%	0.704	39%	0.394	S	S	*	.	H	α-helix	trans	-63.5	-44.2	-179.1	-173.7	-178	175.1	-172.7	0	112.2	S210 T215 L216	S210-K212 PolarHBondContact O-N 2.75Å; K212-T215 PolarHBondContact O-OG1 3.4Å; K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 PolarHBondContact O-N 3.02Å; K212-L216 VanDerWaalsContact O-N 3.17Å
213	D	94.7	Very high	93.6	Very high	88 Å²	88	80.1 Å²	80.1	47%	0.471	40%	0.397	S	S	.	.	H	α-helix	trans	-73.4	-44.4	-175.6	-70.9	-13.3	0	0	0	111.4	P165 S210 Y211 L216 I217	P165-D213 HydrophobicContact CB-CB 4.15Å; P165-D213 HydrophobicContact CG-CB 4.09Å; S210-D213 PolarHBondContact O-N 2.88Å; Y211-D213 PolarHBondContact O-N 3.47Å; D213-L216 PolarHBondContact O-N 3.03Å; D213-I217 VanDerWaalsContact O-CG1 3.27Å; D213-I217 WeakPolarHBondContact O-CG1 3.03Å; D213-I217 PolarHBondContact O-N 3.36Å; D213-I217 VanDerWaalsContact O-N 3.09Å
214	S	96.5	Very high	93.9	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.1	-46.3	178.3	-62.8	0	0	0	0	112	T163 P165 S210 L216 I217 M218	T163-S214 WeakPolarHBondContact O-CB 3.41Å; T163-S214 PolarHBondContact O-OG 3.39Å; P165-S214 WeakPolarHBondContact CD-OG 3.22Å; P165-S214 WeakPolarHBondContact CG-OG 3.42Å; S210-S214 WeakPolarHBondContact O-CB 3.39Å; S210-S214 PolarHBondContact O-N 3.49Å; S210-S214 PolarHBondContact O-OG 3.47Å; S214-L216 VanDerWaalsContact C-N 3.34Å; S214-L216 PolarHBondContact O-N 2.88Å; S214-I217 PolarHBondContact O-N 3Å; S214-M218 VanDerWaalsContact O-CG 3.25Å; S214-M218 WeakPolarHBondContact O-CG 3.28Å; S214-M218 PolarHBondContact O-N 2.87Å
215	T	96.6	Very high	94.1	Very high	43 Å²	43	73.3 Å²	73.3	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-65.9	-36.2	179.9	54.1	0	0	0	0	112.5	L203 Y211 K212 M218 Q219	L203-T215 HydrophobicContact CD1-CG2 4.17Å; Y211-T215 HydrophobicContact CD1-CG2 4.09Å; Y211-T215 HydrophobicContact CE1-CG2 3.79Å; Y211-T215 HydrophobicContact CE2-CG2 4.25Å; Y211-T215 HydrophobicContact CG-CG2 4.45Å; Y211-T215 WeakPolarHBondContact O-CB 3.15Å; Y211-T215 VanDerWaalsContact O-CG2 3.27Å; Y211-T215 WeakPolarHBondContact O-CG2 3.17Å; Y211-T215 PolarHBondContact O-N 3.05Å; Y211-T215 PolarHBondContact O-OG1 3.47Å; K212-T215 PolarHBondContact O-OG1 3.4Å; T215-M218 PolarHBondContact O-N 2.87Å; T215-Q219 WeakPolarHBondContact O-CB 3.42Å; T215-Q219 PolarHBondContact O-N 3.47Å
216	L	97.3	Very high	94.5	Very high	100 Å²	100	72.6 Å²	72.6	52%	0.524	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-43.1	172.7	178.6	62	0	0	0	111.7	K212 D213 S214 Q219 L220	K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 PolarHBondContact O-N 3.02Å; K212-L216 VanDerWaalsContact O-N 3.17Å; D213-L216 PolarHBondContact O-N 3.03Å; S214-L216 VanDerWaalsContact C-N 3.34Å; S214-L216 PolarHBondContact O-N 2.88Å; L216-Q219 WeakPolarHBondContact O-CB 3.2Å; L216-Q219 PolarHBondContact O-N 3.33Å; L216-L220 WeakPolarHBondContact O-CG 3.41Å; L216-L220 PolarHBondContact O-N 3.45Å; L216-L220 VanDerWaalsContact O-N 3.15Å
217	I	98.1	Very high	94.9	Very high	29 Å²	29	75 Å²	75	15%	0.149	37%	0.368	C	S	.	.	H	α-helix	trans	-70.4	-39.7	179	-61.3	164.8	0	0	0	111.2	P165 L168 L172 D213 S214 Q219 L220 L221	P165-I217 HydrophobicContact CB-CD1 4.15Å; P165-I217 VanDerWaalsContact O-CD1 3.29Å; P165-I217 WeakPolarHBondContact O-CD1 3.39Å; L168-I217 HydrophobicContact CB-CB 4.17Å; L168-I217 HydrophobicContact CB-CD1 4.47Å; L168-I217 HydrophobicContact CB-CG2 3.62Å; L172-I217 HydrophobicContact CB-CG2 4.3Å; L172-I217 HydrophobicContact CD2-CG2 4.2Å; D213-I217 VanDerWaalsContact O-CG1 3.27Å; D213-I217 WeakPolarHBondContact O-CG1 3.03Å; D213-I217 PolarHBondContact O-N 3.36Å; D213-I217 VanDerWaalsContact O-N 3.09Å; S214-I217 PolarHBondContact O-N 3Å; I217-Q219 VanDerWaalsContact C-N 3.27Å; I217-Q219 PolarHBondContact O-N 3.37Å; I217-L220 WeakPolarHBondContact O-CB 3.35Å; I217-L220 PolarHBondContact O-N 3.49Å; I217-L220 VanDerWaalsContact O-N 3.16Å; I217-L221 PolarHBondContact O-N 3.1Å
218	M	98	Very high	95.3	Very high	7 Å²	7	71.1 Å²	71.1	3%	0.034	35%	0.347	C	S	.	.	H	α-helix	trans	-60.5	-38.7	174	-70	170.2	72.7	0	0	111.8	L168 F196 A199 I200 L203 S214 T215 L221 R222	L168-M218 HydrophobicContact CD1-CG 3.95Å; L168-M218 HydrophobicContact CD1-SD 4.4Å; L168-M218 HydrophobicContact CD2-CG 4.09Å; F196-M218 HydrophobicContact CD2-CB 4.11Å; F196-M218 WeakPolarHBondContact CD2-O 2.97Å; F196-M218 HydrophobicContact CE2-CB 4.09Å; F196-M218 HydrophobicContact CE2-CE 4.47Å; F196-M218 WeakPolarHBondContact CE2-O 3.46Å; A199-M218 HydrophobicContact CB-CE 3.88Å; A199-M218 HydrophobicContact CB-CG 4.31Å; A199-M218 HydrophobicContact CB-SD 3.93Å; I200-M218 HydrophobicContact CB-CE 4.37Å; I200-M218 HydrophobicContact CD1-CE 3.71Å; I200-M218 HydrophobicContact CG1-CE 3.61Å; L203-M218 HydrophobicContact CD1-CE 4.35Å; L203-M218 HydrophobicContact CD1-SD 3.9Å; L203-M218 HydrophobicContact CD2-CE 4.46Å; S214-M218 VanDerWaalsContact O-CG 3.25Å; S214-M218 WeakPolarHBondContact O-CG 3.28Å; S214-M218 PolarHBondContact O-N 2.87Å; T215-M218 PolarHBondContact O-N 2.87Å; M218-L221 PolarHBondContact O-N 2.75Å; M218-R222 PolarHBondContact O-N 3.35Å
219	Q	98.1	Very high	95.5	Very high	63 Å²	63	65.1 Å²	65.1	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-46.2	173.4	176.7	56.1	39.7	0	0	111.3	T215 L216 I217 L221 R222 D223	T215-Q219 WeakPolarHBondContact O-CB 3.42Å; T215-Q219 PolarHBondContact O-N 3.47Å; L216-Q219 WeakPolarHBondContact O-CB 3.2Å; L216-Q219 PolarHBondContact O-N 3.33Å; I217-Q219 VanDerWaalsContact C-N 3.27Å; I217-Q219 PolarHBondContact O-N 3.37Å; Q219-L221 PolarHBondContact O-N 2.76Å; Q219-R222 WeakPolarHBondContact O-CB 3.33Å; Q219-R222 PolarHBondContact O-N 2.82Å; Q219-D223 PolarHBondContact NE2-OD1 3.03Å; Q219-D223 PolarHBondContact NE2-OD2 2.98Å; Q219-D223 PolarHBondContact O-N 2.94Å
220	L	98.4	Very high	95.7	Very high	75 Å²	75	60.2 Å²	60.2	39%	0.393	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-39.9	176.6	-65.9	171.7	0	0	0	112.6	L172 L216 I217 R222 D223 N224	L172-L220 HydrophobicContact CD1-CB 4.09Å; L172-L220 HydrophobicContact CD2-CB 3.92Å; L172-L220 HydrophobicContact CD2-CD1 3.9Å; L216-L220 WeakPolarHBondContact O-CG 3.41Å; L216-L220 PolarHBondContact O-N 3.45Å; L216-L220 VanDerWaalsContact O-N 3.15Å; I217-L220 WeakPolarHBondContact O-CB 3.35Å; I217-L220 PolarHBondContact O-N 3.49Å; I217-L220 VanDerWaalsContact O-N 3.16Å; L220-R222 VanDerWaalsContact C-N 3.35Å; L220-D223 PolarHBondContact O-N 3.29Å; L220-N224 PolarHBondContact O-N 3.05Å
221	L	98.4	Very high	95.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-45.8	174	-78.4	167.8	0	0	0	111.5	L168 L172 A192 A195 F196 I217 M218 Q219 N224 L225	L168-L221 HydrophobicContact CD2-CD1 3.96Å; L172-L221 HydrophobicContact CB-CD2 3.94Å; L172-L221 HydrophobicContact CB-CG 4.25Å; L172-L221 HydrophobicContact CD1-CD2 4Å; L172-L221 HydrophobicContact CD1-CG 4.21Å; A192-L221 HydrophobicContact CB-CD2 3.86Å; A195-L221 HydrophobicContact CB-CD1 4.31Å; F196-L221 HydrophobicContact CD2-CB 4.48Å; I217-L221 PolarHBondContact O-N 3.1Å; M218-L221 PolarHBondContact O-N 2.75Å; Q219-L221 PolarHBondContact O-N 2.76Å; L221-N224 PolarHBondContact O-N 3.16Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 2.65Å
222	R	97.8	Very high	94.8	Very high	117 Å²	117	58.6 Å²	58.6	44%	0.442	30%	0.302	S	S	.	.	H	α-helix	trans	-63.5	-40.7	177.8	-171.8	-171.3	74.1	-167.9	5.6	112.4	F196 M218 Q219 L220 L225 T226	F196-R222 HydrophobicContact CD2-CB 4.33Å; F196-R222 HydrophobicContact CE2-CB 3.92Å; F196-R222 HydrophobicContact CZ-CB 4.42Å; M218-R222 PolarHBondContact O-N 3.35Å; Q219-R222 WeakPolarHBondContact O-CB 3.33Å; Q219-R222 PolarHBondContact O-N 2.82Å; L220-R222 VanDerWaalsContact C-N 3.35Å; R222-L225 PolarHBondContact O-N 3.37Å; R222-T226 PolarHBondContact O-N 3.22Å; R222-T226 PolarHBondContact O-OG1 2.64Å
223	D	98.1	Very high	93.8	Very high	70 Å²	70	57.4 Å²	57.4	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-42	-179.4	-65.4	-13	0	0	0	110.6	Q219 L220 T226 L227	Q219-D223 PolarHBondContact NE2-OD1 3.03Å; Q219-D223 PolarHBondContact NE2-OD2 2.98Å; Q219-D223 PolarHBondContact O-N 2.94Å; L220-D223 PolarHBondContact O-N 3.29Å; D223-T226 PolarHBondContact O-N 3.31Å; D223-L227 PolarHBondContact O-N 3.4Å
224	N	97.1	Very high	92.7	Very high	35 Å²	35	54.9 Å²	54.9	19%	0.187	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-45.7	171.9	-78.5	2.5	0	0	0	112.4	L172 L220 L221 T226 L227 W228	L172-N224 VanDerWaalsContact CD1-ND2 3.33Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.35Å; L220-N224 PolarHBondContact O-N 3.05Å; L221-N224 PolarHBondContact O-N 3.16Å; N224-T226 VanDerWaalsContact C-N 3.26Å; N224-T226 PolarHBondContact O-N 3.41Å; N224-L227 PolarHBondContact O-N 2.79Å; N224-W228 HydrophobicContact CB-CD2 4.21Å; N224-W228 HydrophobicContact CB-CE3 4.08Å; N224-W228 HydrophobicContact CB-CH2 3.68Å; N224-W228 HydrophobicContact CB-CZ2 3.8Å; N224-W228 HydrophobicContact CB-CZ3 3.81Å; N224-W228 WeakPolarHBondContact ND2-CH2 3.5Å; N224-W228 VanDerWaalsContact O-CD2 3.26Å; N224-W228 PolarHBondContact O-N 3.4Å
225	L	96.9	Very high	91.1	Very high	26 Å²	26	60.7 Å²	60.7	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-57.9	-41.7	176.9	-78.2	167.9	0	0	0	111.9	C189 A192 K193 L221 R222 T229	C189-L225 HydrophobicContact CB-CD2 4.09Å; C189-L225 WeakPolarHBondContact O-CD2 3.4Å; A192-L225 HydrophobicContact CB-CD1 4.3Å; A192-L225 HydrophobicContact CB-CD2 3.84Å; A192-L225 HydrophobicContact CB-CG 3.89Å; K193-L225 HydrophobicContact CB-CD1 4.19Å; K193-L225 HydrophobicContact CB-CD2 4.11Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 2.65Å; R222-L225 PolarHBondContact O-N 3.37Å; L225-T229 WeakPolarHBondContact O-CB 3.27Å; L225-T229 WeakPolarHBondContact O-CG2 3.49Å; L225-T229 PolarHBondContact O-N 3.05Å; L225-T229 PolarHBondContact O-OG1 2.86Å
226	T	96.3	Very high	89.4	Confident	86 Å²	86	65.3 Å²	65.3	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-65.6	-45	179.1	-57.7	0	0	0	0	110.9	R222 D223 N224 T229 S230	R222-T226 PolarHBondContact O-N 3.22Å; R222-T226 PolarHBondContact O-OG1 2.64Å; D223-T226 PolarHBondContact O-N 3.31Å; N224-T226 VanDerWaalsContact C-N 3.26Å; N224-T226 PolarHBondContact O-N 3.41Å; T226-T229 PolarHBondContact O-OG1 3.36Å; T226-S230 WeakPolarHBondContact O-CB 3.44Å; T226-S230 PolarHBondContact O-N 2.78Å; T226-S230 PolarHBondContact O-OG 2.87Å
227	L	95.3	Very high	87.3	Confident	81 Å²	81	63 Å²	63	42%	0.424	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-57.2	177.8	-179.6	65.1	0	0	0	111.1	D223 N224 T229 S230 E231	D223-L227 PolarHBondContact O-N 3.4Å; N224-L227 PolarHBondContact O-N 2.79Å; L227-T229 PolarHBondContact O-N 3.29Å; L227-S230 PolarHBondContact O-N 3.15Å; L227-S230 VanDerWaalsContact O-N 3.12Å; L227-S230 PolarHBondContact O-OG 3.18Å; L227-E231 PolarHBondContact O-N 3.26Å; L227-E231 VanDerWaalsContact O-N 3.07Å
228	W	95.8	Very high	85.4	Confident	8 Å²	8	66.9 Å²	66.9	3%	0.03	36%	0.356	C	S	.	.	H	α-helix	trans	-66.9	-34.3	-173.4	-57.3	-29	0	0	0	113.1	V176 Y179 A188 A192 N224 S230 N232	V176-W228 HydrophobicContact CG2-CH2 4.06Å; V176-W228 HydrophobicContact CG2-CZ2 4.01Å; Y179-W228 AromaticContact CD1-CD1 3.78Å; Y179-W228 AromaticContact CD1-CE2 3.93Å; Y179-W228 HydrophobicContact CD1-CG 4.5Å; Y179-W228 HydrophobicContact CD1-CZ2 4.46Å; Y179-W228 AromaticContact CD1-NE1 3.37Å; Y179-W228 HydrophobicContact CD2-CB 4.13Å; Y179-W228 AromaticContact CD2-CD1 3.62Å; Y179-W228 AromaticContact CD2-CD2 3.76Å; Y179-W228 HydrophobicContact CD2-CD2 3.76Å; Y179-W228 AromaticContact CD2-CE2 3.89Å; Y179-W228 HydrophobicContact CD2-CE3 4.45Å; Y179-W228 AromaticContact CD2-CG 3.59Å; Y179-W228 HydrophobicContact CD2-CG 3.59Å; Y179-W228 AromaticContact CD2-NE1 3.8Å; Y179-W228 AromaticContact CE1-CD1 3.45Å; Y179-W228 VanDerWaalsContact CE1-CD1 3.45Å; Y179-W228 HydrophobicContact CE1-CG 4.35Å; Y179-W228 AromaticContact CE1-NE1 3.47Å; Y179-W228 HydrophobicContact CE2-CB 3.69Å; Y179-W228 AromaticContact CE2-CD1 3.32Å; Y179-W228 HydrophobicContact CE2-CD2 4.14Å; Y179-W228 AromaticContact CE2-CG 3.45Å; Y179-W228 HydrophobicContact CE2-CG 3.45Å; Y179-W228 VanDerWaalsContact CE2-CG 3.45Å; Y179-W228 AromaticContact CE2-NE1 3.92Å; Y179-W228 AromaticContact CG-CD1 3.86Å; Y179-W228 HydrophobicContact CG-CD2 4.03Å; Y179-W228 AromaticContact CG-CE2 3.65Å; Y179-W228 HydrophobicContact CG-CG 4.14Å; Y179-W228 HydrophobicContact CG-CZ2 4.12Å; Y179-W228 AromaticContact CG-NE1 3.55Å; Y179-W228 AromaticContact CZ-CD1 3.23Å; Y179-W228 AromaticContact CZ-CG 3.86Å; Y179-W228 AromaticContact CZ-NE1 3.76Å; A188-W228 HydrophobicContact CB-CE3 4.13Å; A188-W228 HydrophobicContact CB-CZ3 3.97Å; A192-W228 HydrophobicContact CB-CZ3 4.32Å; N224-W228 HydrophobicContact CB-CD2 4.21Å; N224-W228 HydrophobicContact CB-CE3 4.08Å; N224-W228 HydrophobicContact CB-CH2 3.68Å; N224-W228 HydrophobicContact CB-CZ2 3.8Å; N224-W228 HydrophobicContact CB-CZ3 3.81Å; N224-W228 WeakPolarHBondContact ND2-CH2 3.5Å; N224-W228 VanDerWaalsContact O-CD2 3.26Å; N224-W228 PolarHBondContact O-N 3.4Å; W228-S230 VanDerWaalsContact C-N 3.33Å; W228-N232 PolarHBondContact O-N 3.49Å; W228-N232 VanDerWaalsContact O-N 3.12Å; W228-N232 PolarHBondContact O-OD1 3.11Å
229	T	91.4	Very high	83.4	Confident	63 Å²	63	71.7 Å²	71.7	39%	0.387	38%	0.382	S	S	.	.	H	α-helix	trans	-71.8	-27.7	175.6	54.4	0	0	0	0	113	L225 T226 L227 Q233	L225-T229 WeakPolarHBondContact O-CB 3.27Å; L225-T229 WeakPolarHBondContact O-CG2 3.49Å; L225-T229 PolarHBondContact O-N 3.05Å; L225-T229 PolarHBondContact O-OG1 2.86Å; T226-T229 PolarHBondContact O-OG1 3.36Å; L227-T229 PolarHBondContact O-N 3.29Å; T229-Q233 WeakPolarHBondContact O-CG 3.3Å; T229-Q233 PolarHBondContact O-N 3.29Å; T229-Q233 PolarHBondContact O-NE2 3.21Å
230	S	89.5	Confident	81.1	Confident	66 Å²	66	71.3 Å²	71.3	46%	0.462	39%	0.389	S	S	.	.	H	α-helix	trans	-75.2	-37.3	174	72.6	0	0	0	0	112.9	T226 L227 W228 G234	T226-S230 WeakPolarHBondContact O-CB 3.44Å; T226-S230 PolarHBondContact O-N 2.78Å; T226-S230 PolarHBondContact O-OG 2.87Å; L227-S230 PolarHBondContact O-N 3.15Å; L227-S230 VanDerWaalsContact O-N 3.12Å; L227-S230 PolarHBondContact O-OG 3.18Å; W228-S230 VanDerWaalsContact C-N 3.33Å; S230-G234 PolarHBondContact O-N 3.45Å
231	E	84.3	Confident	79	Confident	81 Å²	81	74.9 Å²	74.9	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-67.2	-45.9	177.4	-70.6	177.7	164.4	0	0	111	Y179 L227 Q233 G234 E235	Y179-E231 PolarHBondContact OH-OE2 2.9Å; L227-E231 PolarHBondContact O-N 3.26Å; L227-E231 VanDerWaalsContact O-N 3.07Å; E231-Q233 VanDerWaalsContact C-N 3.32Å; E231-Q233 PolarHBondContact O-N 3.37Å; E231-G234 PolarHBondContact O-N 2.92Å; E231-G234 VanDerWaalsContact O-N 3.11Å; E231-E235 PolarHBondContact O-N 3.25Å; E231-E235 VanDerWaalsContact O-N 3.11Å
232	N	77.7	Confident	76.8	Confident	31 Å²	31	78.6 Å²	78.6	17%	0.166	43%	0.434	C	S	.	.	H	α-helix	trans	-60.6	-36.9	177.1	-81.8	36.8	0	0	0	113.5	W228 G234 E235 E236	W228-N232 PolarHBondContact O-N 3.49Å; W228-N232 VanDerWaalsContact O-N 3.12Å; W228-N232 PolarHBondContact O-OD1 3.11Å; N232-G234 VanDerWaalsContact C-N 3.32Å; N232-E235 PolarHBondContact O-N 3.27Å; N232-E236 WeakPolarHBondContact O-CG 3.5Å; N232-E236 PolarHBondContact O-N 2.98Å; N232-E236 VanDerWaalsContact O-N 3.1Å
233	Q	74.2	Confident	74.5	Confident	136 Å²	136	80 Å²	80	64%	0.636	45%	0.451	S	S	*	.	H	α-helix	trans	-68.4	-32.4	177.1	-74.4	173.7	31.2	0	0	112.5	T229 E231 A237	T229-Q233 WeakPolarHBondContact O-CG 3.3Å; T229-Q233 PolarHBondContact O-N 3.29Å; T229-Q233 PolarHBondContact O-NE2 3.21Å; E231-Q233 VanDerWaalsContact C-N 3.32Å; E231-Q233 PolarHBondContact O-N 3.37Å; Q233-A237 PolarHBondContact O-N 2.96Å
234	G	70.8	Confident	71.9	Confident	35 Å²	35	86.3 Å²	86.3	36%	0.361	49%	0.485	S	S	.	.	H	α-helix	trans	-67.5	-45.7	174.3	0	0	0	0	0	112	S230 E231 N232 E236 A237 D238	S230-G234 PolarHBondContact O-N 3.45Å; E231-G234 PolarHBondContact O-N 2.92Å; E231-G234 VanDerWaalsContact O-N 3.11Å; N232-G234 VanDerWaalsContact C-N 3.32Å; G234-E236 PolarHBondContact O-N 3.11Å; G234-A237 PolarHBondContact O-N 2.73Å; G234-D238 PolarHBondContact O-N 3.38Å
235	E	63.3	Low	70.7	Confident	122 Å²	122	88.9 Å²	88.9	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-65	-36.7	178.5	-67.9	-175	175	0	0	113	E231 N232 N239	E231-E235 PolarHBondContact O-N 3.25Å; E231-E235 VanDerWaalsContact O-N 3.11Å; N232-E235 PolarHBondContact O-N 3.27Å; E235-N239 WeakPolarHBondContact O-CB 3.43Å; E235-N239 VanDerWaalsContact O-CG 3.32Å; E235-N239 PolarHBondContact O-N 3.31Å; E235-N239 VanDerWaalsContact O-N 3.1Å; E235-N239 PolarHBondContact O-ND2 2.98Å
236	E	61.7	Low	69.3	Low	140 Å²	140	92.2 Å²	92.2	65%	0.654	52%	0.519	S	S	*	.	H	α-helix	trans	-65	-37.9	174.1	-76.1	179.9	-176.4	0	0	112.3	N232 G234 A240	N232-E236 WeakPolarHBondContact O-CG 3.5Å; N232-E236 PolarHBondContact O-N 2.98Å; N232-E236 VanDerWaalsContact O-N 3.1Å; G234-E236 PolarHBondContact O-N 3.11Å; E236-A240 WeakPolarHBondContact O-CB 3.31Å; E236-A240 PolarHBondContact O-N 2.74Å; E236-A240 VanDerWaalsContact O-N 3.16Å
237	A	52.8	Low	67.8	Low	51 Å²	51	92.6 Å²	92.6	42%	0.421	52%	0.518	S	S	.	.	H	α-helix	trans	-69	-45	177.1	0	0	0	0	0	112	Q233 G234 N239 A240 E241	Q233-A237 PolarHBondContact O-N 2.96Å; G234-A237 PolarHBondContact O-N 2.73Å; A237-N239 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 2.71Å; A237-A240 PolarHBondContact O-N 3.17Å; A237-E241 PolarHBondContact O-N 3.09Å; A237-E241 VanDerWaalsContact O-N 3.14Å
238	D	57	Low	66.2	Low	112 Å²	112	93.2 Å²	93.2	60%	0.599	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-38.7	179.4	-74.4	-11.8	0	0	0	111.9	G234 E241 A242	G234-D238 PolarHBondContact O-N 3.38Å; D238-E241 PolarHBondContact O-N 3.46Å; D238-A242 PolarHBondContact O-N 3.41Å
239	N	56.9	Low	64.3	Low	107 Å²	107	98.6 Å²	98.6	57%	0.572	56%	0.555	S	S	*	*	H	α-helix	trans	-68.8	-35.7	175.6	-73.6	-38.7	0	0	0	112.5	E235 A237 E241 A242 D243	E235-N239 WeakPolarHBondContact O-CB 3.43Å; E235-N239 VanDerWaalsContact O-CG 3.32Å; E235-N239 PolarHBondContact O-N 3.31Å; E235-N239 VanDerWaalsContact O-N 3.1Å; E235-N239 PolarHBondContact O-ND2 2.98Å; A237-N239 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 2.71Å; N239-E241 VanDerWaalsContact C-N 3.31Å; N239-E241 PolarHBondContact O-N 3.36Å; N239-A242 PolarHBondContact O-N 3.35Å; N239-D243 PolarHBondContact O-N 3.26Å
240	A	50.4	Low	62.5	Low	55 Å²	55	100.9 Å²	100.9	46%	0.455	57%	0.566	S	S	.	*	H	α-helix	trans	-70.1	-26	177.2	0	0	0	0	0	113.4	E236 A237 N244	E236-A240 WeakPolarHBondContact O-CB 3.31Å; E236-A240 PolarHBondContact O-N 2.74Å; E236-A240 VanDerWaalsContact O-N 3.16Å; A237-A240 PolarHBondContact O-N 3.17Å; A240-N244 PolarHBondContact O-ND2 3.48Å
241	E	52.5	Low	60.6	Low	151 Å²	151	103.4 Å²	103.4	71%	0.706	57%	0.573	S	S	*	*	H	α-helix	trans	-81.4	-30.2	173.7	-71.1	-171	177.2	0	0	112.9	A237 D238 N239	A237-E241 PolarHBondContact O-N 3.09Å; A237-E241 VanDerWaalsContact O-N 3.14Å; D238-E241 PolarHBondContact O-N 3.46Å; N239-E241 VanDerWaalsContact C-N 3.31Å; N239-E241 PolarHBondContact O-N 3.36Å
242	A	52.2	Low	58.7	Low	77 Å²	77	105.2 Å²	105.2	64%	0.636	59%	0.588	S	S	*	*	H	α-helix	trans	-73.4	-25.1	177.6	0	0	0	0	0	113.9	D238 N239	D238-A242 PolarHBondContact O-N 3.41Å; N239-A242 PolarHBondContact O-N 3.35Å
243	D	50.6	Low	57.2	Low	147 Å²	147	111.3 Å²	111.3	79%	0.786	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	2.2	-179.4	-79.6	-16.7	0	0	0	114.3	N239	N239-D243 PolarHBondContact O-N 3.26Å
244	N	43.6	Very low	55.6	Low	203 Å²	203	109.1 Å²	109.1	100%	1.086	62%	0.622	S	S	*	*			trans	-110	0	176.1	-79.2	-51.3	0	0	0	113	A240	A240-N244 PolarHBondContact O-ND2 3.48Å

Retrieved 244 of 244 residues in 658.6 ms (Link to these results)

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