A0A5K4F6U4_SCHMA Loading...

DUF3826 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6U4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 360 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	48.4	Very low	44	Very low	224 Å²	224	123.6 Å²	123.6	100%	1.103	66%	0.657	S	S	*	*				0	-28.7	0	-131.8	177.2	-77.7	0	0	114.7
2	K	42.5	Very low	44.1	Very low	191 Å²	191	119.8 Å²	119.8	83%	0.83	64%	0.642	S	S	*	*	H	α-helix	trans	-73	-26.3	178.4	-72.2	-176.8	176.3	179.9	0	115.6
3	A	40.2	Very low	44.6	Very low	74 Å²	74	119 Å²	119	61%	0.612	64%	0.636	S	S	*	*	H	α-helix	trans	-71.3	-37	-178.4	0	0	0	0	0	113.7	F5 M6 Q7	A3-F5 VanDerWaalsContact C-N 3.29Å; A3-F5 PolarHBondContact O-N 2.65Å; A3-M6 PolarHBondContact O-N 2.93Å; A3-Q7 PolarHBondContact O-N 3.35Å
4	C	43.5	Very low	44.4	Very low	92 Å²	92	122.6 Å²	122.6	62%	0.622	64%	0.638	S	S	*	*	H	α-helix	trans	-67	-29.8	177.2	-67.8	0	0	0	0	112.8	A8	C4-A8 VanDerWaalsContact O-CB 3.31Å; C4-A8 WeakPolarHBondContact O-CB 3.48Å; C4-A8 PolarHBondContact O-N 2.99Å
5	F	42	Very low	44.6	Very low	161 Å²	161	120.3 Å²	120.3	71%	0.706	63%	0.625	S	S	*	*	H	α-helix	trans	-72.3	-37.9	-179.4	-148.7	-90.4	0	0	0	111.8	A3 L9	A3-F5 VanDerWaalsContact C-N 3.29Å; A3-F5 PolarHBondContact O-N 2.65Å; F5-L9 WeakPolarHBondContact O-CB 3.45Å; F5-L9 PolarHBondContact O-N 3.47Å
6	M	38.7	Very low	44.4	Very low	139 Å²	139	118.6 Å²	118.6	69%	0.685	62%	0.617	S	S	*	*	H	α-helix	trans	-68.3	-40.6	173.9	-89.3	-116.8	-90.8	0	0	112.2	A3 L9 V10	A3-M6 PolarHBondContact O-N 2.93Å; M6-L9 PolarHBondContact O-N 3.11Å; M6-V10 WeakPolarHBondContact O-CB 3.38Å; M6-V10 VanDerWaalsContact O-CG2 3.22Å; M6-V10 WeakPolarHBondContact O-CG2 3.26Å; M6-V10 PolarHBondContact O-N 3.34Å
7	Q	44.2	Very low	44.2	Very low	134 Å²	134	113.2 Å²	113.2	63%	0.626	60%	0.597	S	S	*	*	H	α-helix	trans	-66.7	-39.2	175.8	-77.7	179.1	-25.9	0	0	112.3	A3 L11	A3-Q7 PolarHBondContact O-N 3.35Å; Q7-L11 WeakPolarHBondContact O-CB 3.47Å; Q7-L11 PolarHBondContact O-N 3.23Å
8	A	46.6	Very low	43.9	Very low	54 Å²	54	110.5 Å²	110.5	45%	0.446	59%	0.585	S	S	.	*	H	α-helix	trans	-66.1	-40	174	0	0	0	0	0	112.1	C4 T12	C4-A8 VanDerWaalsContact O-CB 3.31Å; C4-A8 WeakPolarHBondContact O-CB 3.48Å; C4-A8 PolarHBondContact O-N 2.99Å; A8-T12 VanDerWaalsContact O-CB 3.25Å; A8-T12 WeakPolarHBondContact O-CB 3.49Å; A8-T12 PolarHBondContact O-N 2.87Å; A8-T12 PolarHBondContact O-OG1 3.32Å
9	L	41.9	Very low	43.6	Very low	94 Å²	94	111.5 Å²	111.5	49%	0.492	59%	0.586	S	S	.	*	H	α-helix	trans	-66.4	-42.9	176.9	-156.3	90.3	0	0	0	111.4	F5 M6 T12 I13	F5-L9 WeakPolarHBondContact O-CB 3.45Å; F5-L9 PolarHBondContact O-N 3.47Å; M6-L9 PolarHBondContact O-N 3.11Å; L9-T12 PolarHBondContact O-N 2.91Å; L9-I13 HydrophobicContact CD2-CD1 4.15Å; L9-I13 HydrophobicContact CG-CD1 4.14Å; L9-I13 WeakPolarHBondContact O-CB 3.47Å; L9-I13 VanDerWaalsContact O-CG1 3.22Å; L9-I13 WeakPolarHBondContact O-CG1 3.36Å; L9-I13 PolarHBondContact O-N 3.27Å
10	V	49.3	Very low	43.2	Very low	88 Å²	88	111.1 Å²	111.1	53%	0.533	58%	0.584	S	S	.	*	H	α-helix	trans	-66.8	-44.1	177.2	172.3	0	0	0	0	111.1	M6 T12 I13 Y14	M6-V10 WeakPolarHBondContact O-CB 3.38Å; M6-V10 VanDerWaalsContact O-CG2 3.22Å; M6-V10 WeakPolarHBondContact O-CG2 3.26Å; M6-V10 PolarHBondContact O-N 3.34Å; V10-T12 VanDerWaalsContact C-N 3.33Å; V10-T12 PolarHBondContact O-N 2.89Å; V10-I13 PolarHBondContact O-N 2.72Å; V10-Y14 VanDerWaalsContact O-CB 3.25Å; V10-Y14 WeakPolarHBondContact O-CB 3.5Å; V10-Y14 PolarHBondContact O-N 3.34Å
11	L	46.6	Very low	42.8	Very low	109 Å²	109	110.2 Å²	110.2	57%	0.571	58%	0.58	S	S	*	*	H	α-helix	trans	-64	-37.7	173.8	-106.4	99.4	0	0	0	111.9	Q7 Y14 I15	Q7-L11 WeakPolarHBondContact O-CB 3.47Å; Q7-L11 PolarHBondContact O-N 3.23Å; L11-Y14 PolarHBondContact O-N 3.15Å; L11-I15 HydrophobicContact CD2-CD1 4.16Å; L11-I15 VanDerWaalsContact O-CB 3.28Å; L11-I15 WeakPolarHBondContact O-CB 3.32Å; L11-I15 WeakPolarHBondContact O-CG1 3.25Å; L11-I15 PolarHBondContact O-N 2.78Å
12	T	46	Very low	42.3	Very low	77 Å²	77	105 Å²	105	47%	0.472	56%	0.561	S	S	.	*	H	α-helix	trans	-69.6	-40	179.3	-54.4	0	0	0	0	111.1	A8 L9 V10 Y14 L16	A8-T12 VanDerWaalsContact O-CB 3.25Å; A8-T12 WeakPolarHBondContact O-CB 3.49Å; A8-T12 PolarHBondContact O-N 2.87Å; A8-T12 PolarHBondContact O-OG1 3.32Å; L9-T12 PolarHBondContact O-N 2.91Å; V10-T12 VanDerWaalsContact C-N 3.33Å; V10-T12 PolarHBondContact O-N 2.89Å; T12-Y14 VanDerWaalsContact C-N 3.35Å; T12-L16 HydrophobicContact CG2-CD1 3.82Å; T12-L16 HydrophobicContact CG2-CG 4.43Å; T12-L16 WeakPolarHBondContact O-CB 3.45Å; T12-L16 VanDerWaalsContact O-CG 3.28Å; T12-L16 WeakPolarHBondContact O-CG 3.49Å; T12-L16 PolarHBondContact O-N 2.94Å
13	I	49.8	Very low	42.2	Very low	110 Å²	110	100.2 Å²	100.2	56%	0.564	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-37.5	172.5	-68.6	165.6	0	0	0	110.8	L9 V10 G17	L9-I13 HydrophobicContact CD2-CD1 4.15Å; L9-I13 HydrophobicContact CG-CD1 4.14Å; L9-I13 WeakPolarHBondContact O-CB 3.47Å; L9-I13 VanDerWaalsContact O-CG1 3.22Å; L9-I13 WeakPolarHBondContact O-CG1 3.36Å; L9-I13 PolarHBondContact O-N 3.27Å; V10-I13 PolarHBondContact O-N 2.72Å; I13-G17 VanDerWaalsContact O-CA 3.29Å; I13-G17 WeakPolarHBondContact O-CA 3.44Å; I13-G17 PolarHBondContact O-N 2.88Å
14	Y	42	Very low	42.2	Very low	169 Å²	169	98.3 Å²	98.3	66%	0.663	53%	0.531	S	S	*	.	H	α-helix	trans	-72.3	-39.6	178.1	-155.1	-92.4	0	0	0	111.8	V10 L11 T12 G17 V18	V10-Y14 VanDerWaalsContact O-CB 3.25Å; V10-Y14 WeakPolarHBondContact O-CB 3.5Å; V10-Y14 PolarHBondContact O-N 3.34Å; L11-Y14 PolarHBondContact O-N 3.15Å; T12-Y14 VanDerWaalsContact C-N 3.35Å; Y14-G17 PolarHBondContact O-N 2.91Å; Y14-V18 HydrophobicContact CD1-CG2 3.83Å; Y14-V18 HydrophobicContact CE1-CG2 3.77Å; Y14-V18 VanDerWaalsContact O-CB 3.22Å; Y14-V18 WeakPolarHBondContact O-CB 3.43Å; Y14-V18 WeakPolarHBondContact O-CG2 3.42Å; Y14-V18 PolarHBondContact O-N 3.27Å
15	I	47.8	Very low	42.6	Very low	88 Å²	88	99.2 Å²	99.2	45%	0.451	53%	0.53	S	S	.	.	H	α-helix	trans	-71.7	-43.2	177.1	-69.1	166.4	0	0	0	110.8	L11 G17 V18 Q19	L11-I15 HydrophobicContact CD2-CD1 4.16Å; L11-I15 VanDerWaalsContact O-CB 3.28Å; L11-I15 WeakPolarHBondContact O-CB 3.32Å; L11-I15 WeakPolarHBondContact O-CG1 3.25Å; L11-I15 PolarHBondContact O-N 2.78Å; I15-G17 VanDerWaalsContact C-N 3.33Å; I15-V18 PolarHBondContact O-N 2.89Å; I15-Q19 VanDerWaalsContact O-CB 3.3Å; I15-Q19 WeakPolarHBondContact O-CB 3.45Å; I15-Q19 WeakPolarHBondContact O-CG 3.38Å; I15-Q19 PolarHBondContact O-N 3.19Å
16	L	40.5	Very low	42.9	Very low	94 Å²	94	97.1 Å²	97.1	49%	0.492	53%	0.525	S	S	.	.	H	α-helix	trans	-67.8	-34.8	172.8	-73.9	168.1	0	0	0	111.8	T12 N20	T12-L16 HydrophobicContact CG2-CD1 3.82Å; T12-L16 HydrophobicContact CG2-CG 4.43Å; T12-L16 WeakPolarHBondContact O-CB 3.45Å; T12-L16 VanDerWaalsContact O-CG 3.28Å; T12-L16 WeakPolarHBondContact O-CG 3.49Å; T12-L16 PolarHBondContact O-N 2.94Å; L16-N20 WeakPolarHBondContact O-CB 3.42Å; L16-N20 PolarHBondContact O-N 2.94Å; L16-N20 VanDerWaalsContact O-N 3.08Å; L16-N20 PolarHBondContact O-ND2 2.95Å
17	G	41	Very low	44	Very low	27 Å²	27	92.3 Å²	92.3	28%	0.278	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-50.6	173.3	0	0	0	0	0	111.1	I13 Y14 I15 N20 L21	I13-G17 VanDerWaalsContact O-CA 3.29Å; I13-G17 WeakPolarHBondContact O-CA 3.44Å; I13-G17 PolarHBondContact O-N 2.88Å; Y14-G17 PolarHBondContact O-N 2.91Å; I15-G17 VanDerWaalsContact C-N 3.33Å; G17-N20 PolarHBondContact O-N 3.23Å; G17-L21 VanDerWaalsContact O-CB 3.26Å; G17-L21 WeakPolarHBondContact O-CB 3.31Å; G17-L21 VanDerWaalsContact O-CD1 3.25Å; G17-L21 WeakPolarHBondContact O-CD1 3.43Å; G17-L21 PolarHBondContact O-N 3.39Å
18	V	39.2	Very low	45.1	Very low	64 Å²	64	88.3 Å²	88.3	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-69.5	-38.5	-179.7	171.4	0	0	0	0	112	Y14 I15 N20 L21 V22	Y14-V18 HydrophobicContact CD1-CG2 3.83Å; Y14-V18 HydrophobicContact CE1-CG2 3.77Å; Y14-V18 VanDerWaalsContact O-CB 3.22Å; Y14-V18 WeakPolarHBondContact O-CB 3.43Å; Y14-V18 WeakPolarHBondContact O-CG2 3.42Å; Y14-V18 PolarHBondContact O-N 3.27Å; I15-V18 PolarHBondContact O-N 2.89Å; V18-N20 VanDerWaalsContact C-N 3.33Å; V18-N20 PolarHBondContact O-N 3.48Å; V18-L21 PolarHBondContact O-N 3.47Å; V18-V22 HydrophobicContact CG1-CG2 4.18Å; V18-V22 WeakPolarHBondContact O-CB 3.34Å; V18-V22 WeakPolarHBondContact O-CG2 3.27Å; V18-V22 PolarHBondContact O-N 3.27Å
19	Q	37.6	Very low	46.4	Very low	130 Å²	130	90.9 Å²	90.9	61%	0.607	49%	0.493	S	S	*	.	H	α-helix	trans	-66.9	-33.6	174.6	-79.2	-177.2	-31.5	0	0	112.7	I15	I15-Q19 VanDerWaalsContact O-CB 3.3Å; I15-Q19 WeakPolarHBondContact O-CB 3.45Å; I15-Q19 WeakPolarHBondContact O-CG 3.38Å; I15-Q19 PolarHBondContact O-N 3.19Å
20	N	36.6	Very low	48.1	Very low	102 Å²	102	87.3 Å²	87.3	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-75.3	-42.1	171.4	-75	-41.7	0	0	0	111.6	L16 G17 V18 V22 T23 A24	L16-N20 WeakPolarHBondContact O-CB 3.42Å; L16-N20 PolarHBondContact O-N 2.94Å; L16-N20 VanDerWaalsContact O-N 3.08Å; L16-N20 PolarHBondContact O-ND2 2.95Å; G17-N20 PolarHBondContact O-N 3.23Å; V18-N20 VanDerWaalsContact C-N 3.33Å; V18-N20 PolarHBondContact O-N 3.48Å; N20-V22 PolarHBondContact O-N 3.43Å; N20-T23 PolarHBondContact O-N 2.84Å; N20-A24 WeakPolarHBondContact O-CA 3.46Å; N20-A24 WeakPolarHBondContact O-CB 3.3Å; N20-A24 PolarHBondContact O-N 3.2Å
21	L	34.8	Very low	49.5	Very low	93 Å²	93	85.4 Å²	85.4	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-38.7	-178.8	-97	133.9	0	0	0	113.1	G17 V18 T23 A24 D25	G17-L21 VanDerWaalsContact O-CB 3.26Å; G17-L21 WeakPolarHBondContact O-CB 3.31Å; G17-L21 VanDerWaalsContact O-CD1 3.25Å; G17-L21 WeakPolarHBondContact O-CD1 3.43Å; G17-L21 PolarHBondContact O-N 3.39Å; V18-L21 PolarHBondContact O-N 3.47Å; L21-T23 PolarHBondContact O-N 3.46Å; L21-T23 VanDerWaalsContact O-N 3.14Å; L21-A24 PolarHBondContact O-N 2.96Å; L21-D25 WeakPolarHBondContact CD2-OD1 3.44Å; L21-D25 PolarHBondContact O-N 2.88Å
22	V	36.8	Very low	51.2	Low	116 Å²	116	85.6 Å²	85.6	70%	0.703	46%	0.458	S	S	*	.	H	α-helix	trans	-70.9	-10.5	-176.9	176	0	0	0	0	113.1	V18 N20	V18-V22 HydrophobicContact CG1-CG2 4.18Å; V18-V22 WeakPolarHBondContact O-CB 3.34Å; V18-V22 WeakPolarHBondContact O-CG2 3.27Å; V18-V22 PolarHBondContact O-N 3.27Å; N20-V22 PolarHBondContact O-N 3.43Å
23	T	40.8	Very low	53.2	Low	89 Å²	89	85 Å²	85	55%	0.546	45%	0.452	S	S	.	.	H	α-helix	trans	-121.1	-9.6	168.8	44.9	0	0	0	0	114.6	N20 L21	N20-T23 PolarHBondContact O-N 2.84Å; L21-T23 PolarHBondContact O-N 3.46Å; L21-T23 VanDerWaalsContact O-N 3.14Å
24	A	41	Very low	54.9	Low	34 Å²	34	80 Å²	80	28%	0.281	43%	0.426	S	S	.	.	H	α-helix	trans	-102.9	-5.7	-173	0	0	0	0	0	115.7	N20 L21 I26 T27 S28	N20-A24 WeakPolarHBondContact O-CA 3.46Å; N20-A24 WeakPolarHBondContact O-CB 3.3Å; N20-A24 PolarHBondContact O-N 3.2Å; L21-A24 PolarHBondContact O-N 2.96Å; A24-I26 VanDerWaalsContact C-N 3.34Å; A24-I26 PolarHBondContact O-N 3.42Å; A24-T27 PolarHBondContact O-N 3.18Å; A24-S28 WeakPolarHBondContact O-CB 3.48Å; A24-S28 PolarHBondContact O-N 3.48Å
25	D	51.1	Low	57.1	Low	111 Å²	111	77.6 Å²	77.6	59%	0.594	42%	0.417	S	S	*	.	H	α-helix	trans	-63.8	-34.9	-169.3	-99.8	-17.4	0	0	0	114.5	L21	L21-D25 WeakPolarHBondContact CD2-OD1 3.44Å; L21-D25 PolarHBondContact O-N 2.88Å
26	I	49.5	Very low	59.1	Low	118 Å²	118	78.6 Å²	78.6	61%	0.605	42%	0.418	S	S	*	.	H	α-helix	trans	-87.3	-40.7	178.1	-50.4	177.9	0	0	0	111.1	A24 S28 E29 V30 M152	A24-I26 VanDerWaalsContact C-N 3.34Å; A24-I26 PolarHBondContact O-N 3.42Å; I26-S28 PolarHBondContact O-N 3.19Å; I26-E29 PolarHBondContact O-N 3.14Å; I26-V30 HydrophobicContact CG2-CG2 4.42Å; I26-V30 VanDerWaalsContact O-CG2 3.24Å; I26-V30 WeakPolarHBondContact O-CG2 3.45Å; I26-V30 PolarHBondContact O-N 3.42Å; I26-M152 HydrophobicContact CB-CE 4.33Å; I26-M152 HydrophobicContact CG2-CE 3.32Å
27	T	60	Low	61.5	Low	37 Å²	37	76.2 Å²	76.2	23%	0.227	40%	0.404	C	S	.	.	H	α-helix	trans	-64.9	-39.3	-179.8	-44.9	0	0	0	0	111.7	A24 L31 Y149	A24-T27 PolarHBondContact O-N 3.18Å; T27-L31 HydrophobicContact CG2-CD1 4.1Å; T27-L31 WeakPolarHBondContact O-CB 3.45Å; T27-L31 WeakPolarHBondContact O-CG 3.4Å; T27-L31 PolarHBondContact O-N 2.9Å; T27-Y149 HydrophobicContact CG2-CD2 4.44Å; T27-Y149 HydrophobicContact CG2-CE2 3.66Å
28	S	67.7	Low	63.9	Low	51 Å²	51	75.1 Å²	75.1	36%	0.357	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-44.8	177.7	-179.5	0	0	0	0	111.5	A24 I26 L31 K32	A24-S28 WeakPolarHBondContact O-CB 3.48Å; A24-S28 PolarHBondContact O-N 3.48Å; I26-S28 PolarHBondContact O-N 3.19Å; S28-L31 PolarHBondContact O-N 3.15Å; S28-K32 WeakPolarHBondContact O-CG 3.13Å; S28-K32 PolarHBondContact O-N 3.36Å
29	E	74.4	Confident	66.2	Low	108 Å²	108	78.7 Å²	78.7	51%	0.505	40%	0.402	S	S	.	.	H	α-helix	trans	-69.4	-38.6	-180	-163.2	58.4	-155.2	0	0	112.1	I26 K32 N33	I26-E29 PolarHBondContact O-N 3.14Å; E29-K32 PolarHBondContact O-N 3.08Å; E29-K32 IonicContact OE2-NZ 2.9Å; E29-K32 PolarHBondContact OE2-NZ 2.96Å; E29-N33 PolarHBondContact O-N 3.15Å
30	V	78.3	Confident	68.8	Low	19 Å²	19	75.5 Å²	75.5	12%	0.115	39%	0.387	C	S	.	.	H	α-helix	trans	-63.1	-43.8	173.2	173.5	0	0	0	0	111	I26 N33 I34 Y149 M152	I26-V30 HydrophobicContact CG2-CG2 4.42Å; I26-V30 VanDerWaalsContact O-CG2 3.24Å; I26-V30 WeakPolarHBondContact O-CG2 3.45Å; I26-V30 PolarHBondContact O-N 3.42Å; V30-N33 PolarHBondContact O-N 3.22Å; V30-I34 HydrophobicContact CG1-CD1 4.4Å; V30-I34 WeakPolarHBondContact O-CG1 3.31Å; V30-I34 PolarHBondContact O-N 2.85Å; V30-Y149 HydrophobicContact CG1-CD2 3.99Å; V30-Y149 HydrophobicContact CG1-CG 4.23Å; V30-M152 HydrophobicContact CG2-CE 4.45Å; V30-M152 HydrophobicContact CG2-SD 3.84Å
31	L	78.6	Confident	71.6	Confident	47 Å²	47	70.7 Å²	70.7	25%	0.246	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-41.9	175.4	-75	169.9	0	0	0	111.8	T27 S28 N33 I34 Y35 Y149	T27-L31 HydrophobicContact CG2-CD1 4.1Å; T27-L31 WeakPolarHBondContact O-CB 3.45Å; T27-L31 WeakPolarHBondContact O-CG 3.4Å; T27-L31 PolarHBondContact O-N 2.9Å; S28-L31 PolarHBondContact O-N 3.15Å; L31-N33 VanDerWaalsContact C-N 3.3Å; L31-N33 PolarHBondContact O-N 3.49Å; L31-I34 HydrophobicContact CD2-CD1 4.36Å; L31-I34 WeakPolarHBondContact O-CB 3.13Å; L31-I34 PolarHBondContact O-N 3.46Å; L31-I34 VanDerWaalsContact O-N 3.16Å; L31-Y35 HydrophobicContact CB-CE2 4.37Å; L31-Y35 WeakPolarHBondContact O-CD2 3.48Å; L31-Y35 PolarHBondContact O-N 3.06Å; L31-Y149 HydrophobicContact CD1-CE2 4.45Å; L31-Y149 HydrophobicContact CD2-CD1 4.48Å; L31-Y149 HydrophobicContact CD2-CD2 4.3Å; L31-Y149 HydrophobicContact CD2-CE1 4.12Å; L31-Y149 HydrophobicContact CD2-CE2 3.94Å; L31-Y149 HydrophobicContact CG-CD2 4.43Å; L31-Y149 HydrophobicContact CG-CE2 4.06Å
32	K	81.6	Confident	74.2	Confident	114 Å²	114	66.6 Å²	66.6	50%	0.496	34%	0.34	S	S	.	.	H	α-helix	trans	-58.3	-43.5	173.2	-75.2	-178.4	-147.4	154.5	0	111.6	S28 E29 I34 Y35 F36	S28-K32 WeakPolarHBondContact O-CG 3.13Å; S28-K32 PolarHBondContact O-N 3.36Å; E29-K32 PolarHBondContact O-N 3.08Å; E29-K32 IonicContact OE2-NZ 2.9Å; E29-K32 PolarHBondContact OE2-NZ 2.96Å; K32-I34 VanDerWaalsContact C-N 3.33Å; K32-I34 PolarHBondContact O-N 2.94Å; K32-Y35 PolarHBondContact O-N 2.88Å; K32-F36 WeakPolarHBondContact O-CB 3.24Å; K32-F36 PolarHBondContact O-N 3.4Å
33	N	88	Confident	76.8	Confident	65 Å²	65	65.1 Å²	65.1	35%	0.348	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-41.6	176.2	-177.6	51.9	0	0	0	111.4	E29 V30 L31 Y35 F36 K37	E29-N33 PolarHBondContact O-N 3.15Å; V30-N33 PolarHBondContact O-N 3.22Å; L31-N33 VanDerWaalsContact C-N 3.3Å; L31-N33 PolarHBondContact O-N 3.49Å; N33-Y35 PolarHBondContact O-N 3.25Å; N33-F36 PolarHBondContact O-N 2.91Å; N33-K37 WeakPolarHBondContact O-CG 3.43Å; N33-K37 PolarHBondContact O-N 3.38Å
34	I	86.7	Confident	79.4	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.015	32%	0.315	C	S	.	.	H	α-helix	trans	-57.4	-49.9	172.9	-71.7	170.2	0	0	0	111	V30 L31 K32 F36 K37 L38 F142 A145 Y149 I334	V30-I34 HydrophobicContact CG1-CD1 4.4Å; V30-I34 WeakPolarHBondContact O-CG1 3.31Å; V30-I34 PolarHBondContact O-N 2.85Å; L31-I34 HydrophobicContact CD2-CD1 4.36Å; L31-I34 WeakPolarHBondContact O-CB 3.13Å; L31-I34 PolarHBondContact O-N 3.46Å; L31-I34 VanDerWaalsContact O-N 3.16Å; K32-I34 VanDerWaalsContact C-N 3.33Å; K32-I34 PolarHBondContact O-N 2.94Å; I34-F36 VanDerWaalsContact C-N 3.29Å; I34-F36 PolarHBondContact O-N 2.83Å; I34-K37 PolarHBondContact O-N 3.13Å; I34-L38 WeakPolarHBondContact O-CB 3.34Å; I34-L38 PolarHBondContact O-N 2.9Å; I34-F142 HydrophobicContact CG2-CD2 4.26Å; I34-F142 HydrophobicContact CG2-CE2 3.65Å; I34-A145 HydrophobicContact CG1-CB 3.95Å; I34-Y149 VanDerWaalsContact CD1-CB 3.49Å; I34-Y149 HydrophobicContact CD1-CD1 4.08Å; I34-Y149 HydrophobicContact CD1-CG 3.85Å; I34-I334 HydrophobicContact CG2-CD1 3.52Å
35	Y	86.7	Confident	81.7	Confident	119 Å²	119	63.3 Å²	63.3	47%	0.467	30%	0.304	S	S	.	.	H	α-helix	trans	-60.8	-39.3	177.9	-73.5	-64.5	0	0	0	112.4	L31 K32 N33 L38 K39 I331	L31-Y35 HydrophobicContact CB-CE2 4.37Å; L31-Y35 WeakPolarHBondContact O-CD2 3.48Å; L31-Y35 PolarHBondContact O-N 3.06Å; K32-Y35 PolarHBondContact O-N 2.88Å; N33-Y35 PolarHBondContact O-N 3.25Å; Y35-L38 PolarHBondContact O-N 3.49Å; Y35-K39 WeakPolarHBondContact O-CB 3.39Å; Y35-K39 PolarHBondContact O-N 2.95Å; Y35-I331 HydrophobicContact CD1-CD1 4.31Å; Y35-I331 HydrophobicContact CD1-CG1 4.5Å; Y35-I331 HydrophobicContact CE1-CD1 3.65Å; Y35-I331 HydrophobicContact CE1-CG1 3.82Å
36	F	89.7	Confident	83.5	Confident	109 Å²	109	59.8 Å²	59.8	48%	0.478	28%	0.284	S	S	.	.	H	α-helix	trans	-62.7	-46.9	175.3	-178.7	-99.5	0	0	0	111.3	K32 N33 I34 L38 K39 E40	K32-F36 WeakPolarHBondContact O-CB 3.24Å; K32-F36 PolarHBondContact O-N 3.4Å; N33-F36 PolarHBondContact O-N 2.91Å; I34-F36 VanDerWaalsContact C-N 3.29Å; I34-F36 PolarHBondContact O-N 2.83Å; F36-L38 PolarHBondContact O-N 3.05Å; F36-K39 WeakPolarHBondContact O-CB 3.44Å; F36-K39 PolarHBondContact O-N 2.88Å; F36-E40 HydrophobicContact CD1-CG 4.34Å; F36-E40 HydrophobicContact CE1-CG 3.95Å; F36-E40 WeakPolarHBondContact CE1-OE1 3.4Å; F36-E40 HydrophobicContact CZ-CG 4.17Å; F36-E40 WeakPolarHBondContact CZ-OE1 3.48Å; F36-E40 WeakPolarHBondContact O-CG 3.39Å; F36-E40 PolarHBondContact O-N 2.85Å
37	K	92.3	Very high	85.5	Confident	44 Å²	44	57.1 Å²	57.1	19%	0.191	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-36.4	176.7	-64.9	-45.3	-173.9	-171.6	0	113.1	N33 I34 K39 E40 Y41 N141 F142 A145	N33-K37 WeakPolarHBondContact O-CG 3.43Å; N33-K37 PolarHBondContact O-N 3.38Å; I34-K37 PolarHBondContact O-N 3.13Å; K37-K39 VanDerWaalsContact C-N 3.35Å; K37-E40 WeakPolarHBondContact CD-OE2 3.36Å; K37-E40 IonicContact NZ-OE1 2.83Å; K37-E40 IonicContact NZ-OE2 2.92Å; K37-E40 PolarHBondContact NZ-OE2 3.22Å; K37-E40 PolarHBondContact O-N 2.68Å; K37-Y41 WeakPolarHBondContact O-CB 3.37Å; K37-Y41 PolarHBondContact O-N 3.48Å; K37-N141 HydrophobicContact CD-CB 4.37Å; K37-F142 HydrophobicContact CB-CB 3.97Å; K37-F142 HydrophobicContact CB-CD2 4.29Å; K37-A145 HydrophobicContact CG-CB 4.25Å
38	L	90.5	Very high	87	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-42.4	173	-179.8	56.3	0	0	0	111.6	I34 Y35 F36 Y41 T42 F142 E330 I331	I34-L38 WeakPolarHBondContact O-CB 3.34Å; I34-L38 PolarHBondContact O-N 2.9Å; Y35-L38 PolarHBondContact O-N 3.49Å; F36-L38 PolarHBondContact O-N 3.05Å; L38-Y41 HydrophobicContact CD1-CD1 4.28Å; L38-Y41 PolarHBondContact O-N 3.41Å; L38-T42 HydrophobicContact CD1-CG2 4.3Å; L38-T42 WeakPolarHBondContact O-CG2 3.36Å; L38-T42 PolarHBondContact O-N 3.08Å; L38-T42 PolarHBondContact O-OG1 3.46Å; L38-T42 VanDerWaalsContact O-OG1 3.04Å; L38-F142 HydrophobicContact CB-CD2 3.79Å; L38-F142 HydrophobicContact CB-CE2 3.68Å; L38-F142 HydrophobicContact CB-CZ 4.41Å; L38-F142 HydrophobicContact CD1-CD2 4.5Å; L38-F142 HydrophobicContact CD1-CE1 4.28Å; L38-F142 HydrophobicContact CD1-CE2 4.15Å; L38-F142 HydrophobicContact CD1-CZ 4.04Å; L38-F142 HydrophobicContact CD2-CE2 4.43Å; L38-F142 HydrophobicContact CG-CE2 4.3Å; L38-E330 HydrophobicContact CD1-CB 3.8Å; L38-E330 HydrophobicContact CD1-CG 4Å; L38-E330 HydrophobicContact CD2-CB 4.31Å; L38-I331 HydrophobicContact CD2-CD1 4.3Å; L38-I331 HydrophobicContact CD2-CG1 3.91Å
39	K	88.1	Confident	88	Confident	138 Å²	138	54.5 Å²	54.5	60%	0.6	25%	0.249	S	C	*	.	H	α-helix	trans	-63.2	-44.3	174.6	-172.6	-179.1	178	-176.6	0	111.3	Y35 F36 K37 Y41 T42 E43	Y35-K39 WeakPolarHBondContact O-CB 3.39Å; Y35-K39 PolarHBondContact O-N 2.95Å; F36-K39 WeakPolarHBondContact O-CB 3.44Å; F36-K39 PolarHBondContact O-N 2.88Å; K37-K39 VanDerWaalsContact C-N 3.35Å; K39-Y41 PolarHBondContact O-N 3.24Å; K39-T42 PolarHBondContact O-N 3.36Å; K39-T42 PolarHBondContact O-OG1 3.32Å; K39-T42 VanDerWaalsContact O-OG1 3.07Å; K39-E43 WeakPolarHBondContact O-CB 3.34Å; K39-E43 WeakPolarHBondContact O-CG 3.5Å; K39-E43 PolarHBondContact O-N 3.39Å
40	E	92.2	Very high	88.5	Confident	64 Å²	64	55.8 Å²	55.8	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-57.1	-49.5	174.7	-72.2	-174.2	143.8	0	0	111	F36 K37 T42 E43 K44	F36-E40 HydrophobicContact CD1-CG 4.34Å; F36-E40 HydrophobicContact CE1-CG 3.95Å; F36-E40 WeakPolarHBondContact CE1-OE1 3.4Å; F36-E40 HydrophobicContact CZ-CG 4.17Å; F36-E40 WeakPolarHBondContact CZ-OE1 3.48Å; F36-E40 WeakPolarHBondContact O-CG 3.39Å; F36-E40 PolarHBondContact O-N 2.85Å; K37-E40 WeakPolarHBondContact CD-OE2 3.36Å; K37-E40 IonicContact NZ-OE1 2.83Å; K37-E40 IonicContact NZ-OE2 2.92Å; K37-E40 PolarHBondContact NZ-OE2 3.22Å; K37-E40 PolarHBondContact O-N 2.68Å; E40-T42 PolarHBondContact O-N 3.14Å; E40-E43 PolarHBondContact O-N 3.06Å; E40-K44 WeakPolarHBondContact O-CG 3.46Å; E40-K44 PolarHBondContact O-N 3.33Å
41	Y	94.3	Very high	88.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-49.5	178.6	168.9	-120.8	0	0	0	112.6	K37 L38 K39 E43 K44 I45 K135 A138 R139 L326 E356	K37-Y41 WeakPolarHBondContact O-CB 3.37Å; K37-Y41 PolarHBondContact O-N 3.48Å; L38-Y41 HydrophobicContact CD1-CD1 4.28Å; L38-Y41 PolarHBondContact O-N 3.41Å; K39-Y41 PolarHBondContact O-N 3.24Å; Y41-E43 VanDerWaalsContact C-N 3.33Å; Y41-E43 PolarHBondContact O-N 3.47Å; Y41-K44 PolarHBondContact O-N 3.44Å; Y41-K44 VanDerWaalsContact O-N 3.08Å; Y41-I45 HydrophobicContact CD1-CD1 4.5Å; Y41-I45 HydrophobicContact CE1-CD1 3.91Å; Y41-I45 HydrophobicContact CE2-CD1 3.95Å; Y41-I45 HydrophobicContact CE2-CG1 4.09Å; Y41-I45 PolarHBondContact O-N 3.12Å; Y41-I45 VanDerWaalsContact O-N 3.07Å; Y41-K135 HydrophobicContact CD2-CG 4.49Å; Y41-K135 HydrophobicContact CE2-CG 4.05Å; Y41-A138 HydrophobicContact CD2-CB 4.48Å; Y41-R139 HydrophobicContact CD2-CB 3.79Å; Y41-R139 HydrophobicContact CE2-CB 3.69Å; Y41-R139 HydrophobicContact CE2-CG 4.27Å; Y41-L326 HydrophobicContact CE1-CD2 4.09Å; Y41-E356 PolarHBondContact OH-OE1 3.48Å; Y41-E356 PolarHBondContact OH-OE2 2.63Å
42	T	90.1	Very high	89.1	Confident	8 Å²	8	58 Å²	58	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-33.7	179.2	52.6	0	0	0	0	113.2	L38 K39 E40 I45 K46 L326	L38-T42 HydrophobicContact CD1-CG2 4.3Å; L38-T42 WeakPolarHBondContact O-CG2 3.36Å; L38-T42 PolarHBondContact O-N 3.08Å; L38-T42 PolarHBondContact O-OG1 3.46Å; L38-T42 VanDerWaalsContact O-OG1 3.04Å; K39-T42 PolarHBondContact O-N 3.36Å; K39-T42 PolarHBondContact O-OG1 3.32Å; K39-T42 VanDerWaalsContact O-OG1 3.07Å; E40-T42 PolarHBondContact O-N 3.14Å; T42-I45 PolarHBondContact O-N 3Å; T42-K46 PolarHBondContact O-N 3.11Å; T42-L326 HydrophobicContact CG2-CD2 4.11Å; T42-L326 HydrophobicContact CG2-CG 4.41Å
43	E	91.2	Very high	89	Confident	85 Å²	85	52.9 Å²	52.9	40%	0.397	23%	0.231	S	C	.	.	H	α-helix	trans	-68.7	-34.1	171.7	-71.4	-57.8	136.5	0	0	112.4	K39 E40 Y41 I45 K46 M47	K39-E43 WeakPolarHBondContact O-CB 3.34Å; K39-E43 WeakPolarHBondContact O-CG 3.5Å; K39-E43 PolarHBondContact O-N 3.39Å; E40-E43 PolarHBondContact O-N 3.06Å; Y41-E43 VanDerWaalsContact C-N 3.33Å; Y41-E43 PolarHBondContact O-N 3.47Å; E43-I45 VanDerWaalsContact C-N 3.33Å; E43-I45 PolarHBondContact O-N 3.31Å; E43-K46 PolarHBondContact O-N 2.88Å; E43-K46 IonicContact OE1-NZ 3.91Å; E43-K46 PolarHBondContact OE1-NZ 2.78Å; E43-M47 PolarHBondContact O-N 3.42Å
44	K	94.4	Very high	88.5	Confident	72 Å²	72	53.3 Å²	53.3	31%	0.313	23%	0.231	S	C	.	.	H	α-helix	trans	-67.8	-32.2	174	-62.4	-41.4	-179.1	-179	0	112.7	E40 Y41 M47 L48 T134 K135 A138	E40-K44 WeakPolarHBondContact O-CG 3.46Å; E40-K44 PolarHBondContact O-N 3.33Å; Y41-K44 PolarHBondContact O-N 3.44Å; Y41-K44 VanDerWaalsContact O-N 3.08Å; K44-M47 HydrophobicContact CD-CE 4.21Å; K44-M47 HydrophobicContact CD-SD 4.44Å; K44-M47 PolarHBondContact O-N 3.15Å; K44-L48 PolarHBondContact O-N 3.06Å; K44-T134 HydrophobicContact CD-CG2 3.75Å; K44-T134 HydrophobicContact CG-CG2 4.03Å; K44-K135 HydrophobicContact CB-CB 4.29Å; K44-A138 HydrophobicContact CB-CB 4.36Å; K44-A138 HydrophobicContact CG-CB 3.81Å
45	I	91.1	Very high	87.8	Confident	13 Å²	13	53.6 Å²	53.6	7%	0.067	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-48.9	170.3	-64.6	171.9	0	0	0	110.3	Y41 T42 E43 M47 L48 E49 K135 L326	Y41-I45 HydrophobicContact CD1-CD1 4.5Å; Y41-I45 HydrophobicContact CE1-CD1 3.91Å; Y41-I45 HydrophobicContact CE2-CD1 3.95Å; Y41-I45 HydrophobicContact CE2-CG1 4.09Å; Y41-I45 PolarHBondContact O-N 3.12Å; Y41-I45 VanDerWaalsContact O-N 3.07Å; T42-I45 PolarHBondContact O-N 3Å; E43-I45 VanDerWaalsContact C-N 3.33Å; E43-I45 PolarHBondContact O-N 3.31Å; I45-M47 VanDerWaalsContact C-N 3.27Å; I45-M47 PolarHBondContact O-N 3.35Å; I45-L48 WeakPolarHBondContact O-CB 3.44Å; I45-L48 PolarHBondContact O-N 3.47Å; I45-L48 VanDerWaalsContact O-N 3.15Å; I45-E49 HydrophobicContact CG2-CG 4.49Å; I45-E49 PolarHBondContact O-N 2.95Å; I45-K135 HydrophobicContact CG1-CD 4.42Å; I45-K135 HydrophobicContact CG1-CG 4.11Å; I45-L326 HydrophobicContact CD1-CD2 3.29Å
46	K	88.9	Confident	86.9	Confident	36 Å²	36	49 Å²	49	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-41.1	177.5	-67	177.1	-170.5	170.4	0	112.1	T42 E43 E49 R50 L319 N320 N323	T42-K46 PolarHBondContact O-N 3.11Å; E43-K46 PolarHBondContact O-N 2.88Å; E43-K46 IonicContact OE1-NZ 3.91Å; E43-K46 PolarHBondContact OE1-NZ 2.78Å; K46-E49 PolarHBondContact O-N 3.1Å; K46-R50 WeakPolarHBondContact O-CG 3.43Å; K46-R50 PolarHBondContact O-N 3.37Å; K46-L319 HydrophobicContact CG-CD2 4.47Å; K46-N320 VanDerWaalsContact CE-OD1 3.28Å; K46-N320 WeakPolarHBondContact CE-OD1 3.36Å; K46-N320 PolarHBondContact NZ-OD1 2.95Å; K46-N323 WeakPolarHBondContact CE-ND2 3.27Å; K46-N323 WeakPolarHBondContact CG-ND2 3.49Å
47	M	90.5	Very high	85.6	Confident	62 Å²	62	47.7 Å²	47.7	31%	0.305	21%	0.21	S	C	.	.	H	α-helix	trans	-61.7	-45.3	176.4	-173.7	-172.5	76.3	0	0	111.3	E43 K44 I45 R50 R51 A131 T134	E43-M47 PolarHBondContact O-N 3.42Å; K44-M47 HydrophobicContact CD-CE 4.21Å; K44-M47 HydrophobicContact CD-SD 4.44Å; K44-M47 PolarHBondContact O-N 3.15Å; I45-M47 VanDerWaalsContact C-N 3.27Å; I45-M47 PolarHBondContact O-N 3.35Å; M47-R50 PolarHBondContact O-N 3.08Å; M47-R51 VanDerWaalsContact O-CG 3.29Å; M47-R51 WeakPolarHBondContact O-CG 3.31Å; M47-R51 PolarHBondContact O-N 3.24Å; M47-A131 HydrophobicContact CE-CB 4.11Å; M47-T134 HydrophobicContact CE-CG2 4.24Å
48	L	90.9	Very high	84.1	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-48.1	175.9	172.9	61	0	0	0	111.5	K44 I45 R50 R51 K52 E78 V128 A131 V132 K135	K44-L48 PolarHBondContact O-N 3.06Å; I45-L48 WeakPolarHBondContact O-CB 3.44Å; I45-L48 PolarHBondContact O-N 3.47Å; I45-L48 VanDerWaalsContact O-N 3.15Å; L48-R50 VanDerWaalsContact C-N 3.34Å; L48-R50 PolarHBondContact O-N 3.37Å; L48-R51 PolarHBondContact O-N 3.39Å; L48-R51 VanDerWaalsContact O-N 3.16Å; L48-K52 HydrophobicContact CD1-CG 4.41Å; L48-K52 WeakPolarHBondContact O-CG 3.49Å; L48-K52 PolarHBondContact O-N 3.44Å; L48-E78 WeakPolarHBondContact CD2-OE1 3.19Å; L48-V128 HydrophobicContact CD1-CG1 3.78Å; L48-A131 HydrophobicContact CB-CB 4.47Å; L48-A131 HydrophobicContact CD1-CB 3.91Å; L48-V132 HydrophobicContact CD1-CG2 3.62Å; L48-V132 HydrophobicContact CD2-CG2 4.1Å; L48-K135 HydrophobicContact CD2-CD 3.82Å
49	E	88.8	Confident	82.2	Confident	32 Å²	32	51.4 Å²	51.4	15%	0.15	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-39.5	178.8	-70.6	-52.2	129	0	0	112.6	I45 K46 K52 I53 Y315 L319	I45-E49 HydrophobicContact CG2-CG 4.49Å; I45-E49 PolarHBondContact O-N 2.95Å; K46-E49 PolarHBondContact O-N 3.1Å; E49-K52 PolarHBondContact O-N 3.5Å; E49-K52 IonicContact OE1-NZ 2.68Å; E49-K52 PolarHBondContact OE1-NZ 3.02Å; E49-K52 IonicContact OE2-NZ 3.68Å; E49-I53 PolarHBondContact O-N 3.37Å; E49-I53 VanDerWaalsContact O-N 3.13Å; E49-Y315 WeakPolarHBondContact CB-OH 3.3Å; E49-Y315 PolarHBondContact OE2-OH 3.11Å; E49-L319 HydrophobicContact CB-CD1 4.43Å; E49-L319 HydrophobicContact CB-CD2 3.65Å; E49-L319 HydrophobicContact CG-CD1 3.88Å; E49-L319 HydrophobicContact CG-CD2 4.04Å
50	R	86	Confident	80.6	Confident	136 Å²	136	47 Å²	47	51%	0.513	22%	0.222	S	C	.	.	H	α-helix	trans	-61.6	-45.2	171.9	-74.7	178.4	-176	-154	2.3	112.1	K46 M47 L48 K52 I53 E54 F316	K46-R50 WeakPolarHBondContact O-CG 3.43Å; K46-R50 PolarHBondContact O-N 3.37Å; M47-R50 PolarHBondContact O-N 3.08Å; L48-R50 VanDerWaalsContact C-N 3.34Å; L48-R50 PolarHBondContact O-N 3.37Å; R50-K52 VanDerWaalsContact C-N 3.3Å; R50-K52 PolarHBondContact O-N 2.89Å; R50-I53 PolarHBondContact O-N 3.35Å; R50-I53 VanDerWaalsContact O-N 3.15Å; R50-E54 WeakPolarHBondContact O-CG 3.33Å; R50-E54 PolarHBondContact O-N 3.08Å; R50-F316 HydrophobicContact CG-CE1 3.59Å; R50-F316 HydrophobicContact CG-CZ 3.92Å
51	R	84.3	Confident	78.7	Confident	93 Å²	93	46 Å²	46	35%	0.351	22%	0.216	S	C	.	.	H	α-helix	trans	-62.3	-37.7	178.5	-72.5	-68.5	179.7	-162.6	-6.5	112.5	M47 L48 E54 I55 A131	M47-R51 VanDerWaalsContact O-CG 3.29Å; M47-R51 WeakPolarHBondContact O-CG 3.31Å; M47-R51 PolarHBondContact O-N 3.24Å; L48-R51 PolarHBondContact O-N 3.39Å; L48-R51 VanDerWaalsContact O-N 3.16Å; R51-E54 WeakPolarHBondContact CD-OE2 3.29Å; R51-E54 IonicContact CZ-OE2 2.86Å; R51-E54 IonicContact NE-OE2 3.73Å; R51-E54 IonicContact NH1-OE2 2.76Å; R51-E54 PolarHBondContact NH1-OE2 3.28Å; R51-E54 PolarHBondContact O-N 3.15Å; R51-I55 PolarHBondContact O-N 3.46Å; R51-A131 HydrophobicContact CG-CB 4.33Å
52	K	84.4	Confident	76.7	Confident	20 Å²	20	54.6 Å²	54.6	9%	0.087	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-50.7	172	-69.7	173.1	-175.4	171	0	110.3	L48 E49 R50 Q56 F70	L48-K52 HydrophobicContact CD1-CG 4.41Å; L48-K52 WeakPolarHBondContact O-CG 3.49Å; L48-K52 PolarHBondContact O-N 3.44Å; E49-K52 PolarHBondContact O-N 3.5Å; E49-K52 IonicContact OE1-NZ 2.68Å; E49-K52 PolarHBondContact OE1-NZ 3.02Å; E49-K52 IonicContact OE2-NZ 3.68Å; R50-K52 VanDerWaalsContact C-N 3.3Å; R50-K52 PolarHBondContact O-N 2.89Å; K52-Q56 WeakPolarHBondContact O-CG 3.26Å; K52-Q56 PolarHBondContact O-N 3.08Å; K52-F70 HydrophobicContact CG-CE1 4.42Å; K52-F70 HydrophobicContact CG-CZ 4.45Å
53	I	80.3	Confident	74.9	Confident	5 Å²	5	57.7 Å²	57.7	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-47.7	177.9	-68.9	174	0	0	0	111.6	E49 R50 I55 Q56 E57 Y194 V197 L312 Y315 F316	E49-I53 PolarHBondContact O-N 3.37Å; E49-I53 VanDerWaalsContact O-N 3.13Å; R50-I53 PolarHBondContact O-N 3.35Å; R50-I53 VanDerWaalsContact O-N 3.15Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 2.85Å; I53-Q56 PolarHBondContact O-N 2.85Å; I53-Q56 VanDerWaalsContact O-N 3.09Å; I53-E57 HydrophobicContact CG2-CG 3.92Å; I53-E57 WeakPolarHBondContact O-CG 3.43Å; I53-E57 PolarHBondContact O-N 3.06Å; I53-Y194 HydrophobicContact CG1-CD2 4.26Å; I53-Y194 HydrophobicContact CG1-CE2 3.82Å; I53-V197 HydrophobicContact CG2-CG1 4.45Å; I53-L312 HydrophobicContact CD1-CD2 4.23Å; I53-L312 HydrophobicContact CG2-CD2 3.84Å; I53-Y315 HydrophobicContact CD1-CD1 3.53Å; I53-Y315 HydrophobicContact CD1-CE1 3.26Å; I53-Y315 HydrophobicContact CD1-CG 4.41Å; I53-Y315 HydrophobicContact CG1-CE1 4.44Å; I53-F316 HydrophobicContact CD1-CE1 4.03Å; I53-F316 HydrophobicContact CD1-CE2 4.36Å; I53-F316 HydrophobicContact CD1-CZ 3.67Å
54	E	76.6	Confident	73.3	Confident	75 Å²	75	61.8 Å²	61.8	35%	0.35	29%	0.294	S	S	.	.	H	α-helix	trans	-55.1	-45	-177.9	-75.6	169.7	-160.8	0	0	112.2	R50 R51 Q56 E57 L58	R50-E54 WeakPolarHBondContact O-CG 3.33Å; R50-E54 PolarHBondContact O-N 3.08Å; R51-E54 WeakPolarHBondContact CD-OE2 3.29Å; R51-E54 IonicContact CZ-OE2 2.86Å; R51-E54 IonicContact NE-OE2 3.73Å; R51-E54 IonicContact NH1-OE2 2.76Å; R51-E54 PolarHBondContact NH1-OE2 3.28Å; R51-E54 PolarHBondContact O-N 3.15Å; E54-Q56 VanDerWaalsContact C-N 3.3Å; E54-Q56 PolarHBondContact O-N 2.96Å; E54-E57 PolarHBondContact O-N 2.79Å; E54-L58 WeakPolarHBondContact O-CB 3Å; E54-L58 WeakPolarHBondContact O-CD1 3.44Å; E54-L58 WeakPolarHBondContact O-CG 3.44Å; E54-L58 PolarHBondContact O-N 2.92Å
55	I	71.7	Confident	71.8	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.046	31%	0.307	C	S	.	.	H	α-helix	trans	-68.1	-33.7	-179.3	-73.2	165.6	0	0	0	112.1	R51 I53 S60 F70 Y124 V128	R51-I55 PolarHBondContact O-N 3.46Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 2.85Å; I55-S60 PolarHBondContact O-OG 3.31Å; I55-F70 HydrophobicContact CB-CE2 4.42Å; I55-F70 HydrophobicContact CD1-CE2 4.34Å; I55-F70 HydrophobicContact CG2-CD2 4.38Å; I55-F70 HydrophobicContact CG2-CE2 3.82Å; I55-F70 HydrophobicContact CG2-CZ 4.36Å; I55-Y124 WeakPolarHBondContact CD1-O 3.47Å; I55-Y124 HydrophobicContact CG1-CD1 4.27Å; I55-V128 HydrophobicContact CD1-CB 4.48Å; I55-V128 HydrophobicContact CD1-CG2 3.01Å; I55-V128 HydrophobicContact CG1-CG2 4.47Å
56	Q	68.6	Low	70.7	Confident	22 Å²	22	64.7 Å²	64.7	10%	0.103	31%	0.313	C	S	.	.	H	α-helix	trans	-73.8	-40.2	177.7	-62.8	-171.7	-35.3	0	0	112	K52 I53 E54 L58 G59 Y61 Y194	K52-Q56 WeakPolarHBondContact O-CG 3.26Å; K52-Q56 PolarHBondContact O-N 3.08Å; I53-Q56 PolarHBondContact O-N 2.85Å; I53-Q56 VanDerWaalsContact O-N 3.09Å; E54-Q56 VanDerWaalsContact C-N 3.3Å; E54-Q56 PolarHBondContact O-N 2.96Å; Q56-L58 VanDerWaalsContact C-N 3.3Å; Q56-G59 PolarHBondContact O-N 2.82Å; Q56-Y61 HydrophobicContact CB-CE2 4.06Å; Q56-Y61 HydrophobicContact CG-CD2 4.43Å; Q56-Y61 HydrophobicContact CG-CE2 3.42Å; Q56-Y61 VanDerWaalsContact CG-CE2 3.42Å; Q56-Y61 WeakPolarHBondContact CG-OH 3.33Å; Q56-Y61 PolarHBondContact NE2-OH 3.1Å; Q56-Y194 PolarHBondContact NE2-OH 2.95Å; Q56-Y194 PolarHBondContact OE1-OH 3.13Å
57	E	63.5	Low	69.8	Low	82 Å²	82	64.6 Å²	64.6	38%	0.383	31%	0.314	S	S	.	.	H	α-helix	trans	-66.4	-32.4	174.4	-72.6	-172.5	155.2	0	0	112.2	I53 E54 G59 A201 L312	I53-E57 HydrophobicContact CG2-CG 3.92Å; I53-E57 WeakPolarHBondContact O-CG 3.43Å; I53-E57 PolarHBondContact O-N 3.06Å; E54-E57 PolarHBondContact O-N 2.79Å; E57-G59 PolarHBondContact O-N 3.35Å; E57-G59 VanDerWaalsContact O-N 3.09Å; E57-A201 HydrophobicContact CG-CB 4.39Å; E57-L312 WeakPolarHBondContact OE1-CD1 3.39Å
58	L	58.9	Low	69.1	Low	110 Å²	110	67.2 Å²	67.2	58%	0.576	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-0.9	174.1	-73.5	168.5	0	0	0	113.7	E54 Q56 S60 Y124	E54-L58 WeakPolarHBondContact O-CB 3Å; E54-L58 WeakPolarHBondContact O-CD1 3.44Å; E54-L58 WeakPolarHBondContact O-CG 3.44Å; E54-L58 PolarHBondContact O-N 2.92Å; Q56-L58 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 3.14Å; L58-Y124 HydrophobicContact CD1-CD1 4.46Å; L58-Y124 HydrophobicContact CD1-CE1 3.86Å
59	G	52.2	Low	68.5	Low	16 Å²	16	69.9 Å²	69.9	17%	0.165	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	23	161.4	0	0	0	0	0	115.2	Q56 E57 Y61 R205	Q56-G59 PolarHBondContact O-N 2.82Å; E57-G59 PolarHBondContact O-N 3.35Å; E57-G59 VanDerWaalsContact O-N 3.09Å; G59-Y61 PolarHBondContact O-N 3.24Å; G59-R205 PolarHBondContact O-NH1 3.05Å
60	S	52.9	Low	68	Low	46 Å²	46	68.6 Å²	68.6	32%	0.322	33%	0.329	S	S	.	.			trans	-72	-8.9	178.3	48.1	0	0	0	0	114.3	I55 L58 E62	I55-S60 PolarHBondContact O-OG 3.31Å; L58-S60 PolarHBondContact O-N 3.14Å; S60-E62 PolarHBondContact O-N 3.47Å
61	Y	53.5	Low	67.7	Low	42 Å²	42	66.7 Å²	66.7	17%	0.165	32%	0.322	C	S	.	.			trans	-93.2	100.5	172.2	-52	-37.6	0	0	0	110.4	Q56 G59 D66 E67 F70	Q56-Y61 HydrophobicContact CB-CE2 4.06Å; Q56-Y61 HydrophobicContact CG-CD2 4.43Å; Q56-Y61 HydrophobicContact CG-CE2 3.42Å; Q56-Y61 VanDerWaalsContact CG-CE2 3.42Å; Q56-Y61 WeakPolarHBondContact CG-OH 3.33Å; Q56-Y61 PolarHBondContact NE2-OH 3.1Å; G59-Y61 PolarHBondContact O-N 3.24Å; Y61-D66 VanDerWaalsContact CD1-C 3.41Å; Y61-D66 HydrophobicContact CD1-CB 3.44Å; Y61-D66 VanDerWaalsContact CD1-CB 3.44Å; Y61-D66 HydrophobicContact CE1-CB 4.35Å; Y61-D66 WeakPolarHBondContact CE1-O 3.4Å; Y61-D66 HydrophobicContact CG-CB 4.1Å; Y61-E67 HydrophobicContact CD1-CB 4.48Å; Y61-E67 HydrophobicContact CD2-CB 3.85Å; Y61-E67 HydrophobicContact CD2-CG 4.03Å; Y61-E67 HydrophobicContact CE2-CB 3.95Å; Y61-E67 HydrophobicContact CE2-CG 3.78Å; Y61-E67 HydrophobicContact CG-CB 4.12Å; Y61-F70 HydrophobicContact CE1-CB 3.6Å; Y61-F70 HydrophobicContact CE1-CD2 4.5Å; Y61-F70 HydrophobicContact CE1-CG 4.12Å; Y61-F70 AromaticContact CZ-CG 3.84Å; Y61-F70 WeakPolarHBondContact OH-CB 3.46Å; Y61-F70 WeakPolarHBondContact OH-CD1 3.38Å; Y61-F70 WeakPolarHBondContact OH-CD2 3.18Å; Y61-F70 WeakPolarHBondContact OH-CE1 3.49Å; Y61-F70 WeakPolarHBondContact OH-CG 3.31Å
62	E	51.2	Low	67.7	Low	181 Å²	181	65.7 Å²	65.7	85%	0.846	32%	0.324	S	S	*	.	S	Bend	trans	-75.7	-23.6	168.3	-61.6	-172	163.8	0	0	110.3	S60 D66	S60-E62 PolarHBondContact O-N 3.47Å; E62-D66 PolarHBondContact N-OD2 3.5Å
63	T	52.2	Low	67.8	Low	74 Å²	74	65 Å²	65	45%	0.454	32%	0.321	S	S	.	.	S	Bend	trans	-140.2	161.3	-176.5	73.8	0	0	0	0	113.3	N65 D66	T63-N65 PolarHBondContact O-N 3.05Å; T63-N65 WeakPolarHBondContact OG1-CB 3.38Å; T63-N65 PolarHBondContact OG1-N 2.96Å; T63-D66 PolarHBondContact N-OD2 3.04Å; T63-D66 PolarHBondContact O-N 2.98Å; T63-D66 VanDerWaalsContact O-N 3.14Å; T63-D66 PolarHBondContact OG1-N 2.61Å; T63-D66 PolarHBondContact OG1-OD1 3.36Å; T63-D66 VanDerWaalsContact OG1-OD1 3.1Å; T63-D66 PolarHBondContact OG1-OD2 3.28Å; T63-D66 VanDerWaalsContact OG1-OD2 3.06Å
64	Q	58	Low	68.1	Low	170 Å²	170	65.1 Å²	65.1	79%	0.794	32%	0.322	S	S	*	.	H	α-helix	trans	-60	-25.7	169.6	-74	-175.5	-14.4	0	0	113	D66 K68	Q64-D66 VanDerWaalsContact C-N 3.31Å; Q64-K68 PolarHBondContact O-N 3.07Å
65	N	64.1	Low	68.7	Low	109 Å²	109	63.5 Å²	63.5	58%	0.583	32%	0.315	S	S	*	.	H	α-helix	trans	-65.5	-37.7	176	-91.8	-9.7	0	0	0	111.2	T63 E67 K68 Q69	T63-N65 PolarHBondContact O-N 3.05Å; T63-N65 WeakPolarHBondContact OG1-CB 3.38Å; T63-N65 PolarHBondContact OG1-N 2.96Å; N65-E67 VanDerWaalsContact C-N 3.35Å; N65-E67 PolarHBondContact O-N 2.93Å; N65-K68 PolarHBondContact O-N 2.85Å; N65-Q69 WeakPolarHBondContact O-CG 3.17Å; N65-Q69 PolarHBondContact O-N 2.84Å
66	D	67	Low	69.6	Low	37 Å²	37	64.2 Å²	64.2	20%	0.198	32%	0.317	C	S	.	.	H	α-helix	trans	-67.1	-39.3	-178.9	-48.6	-29.4	0	0	0	111	Y61 E62 T63 Q64 K68 Q69 F70	Y61-D66 VanDerWaalsContact CD1-C 3.41Å; Y61-D66 HydrophobicContact CD1-CB 3.44Å; Y61-D66 VanDerWaalsContact CD1-CB 3.44Å; Y61-D66 HydrophobicContact CE1-CB 4.35Å; Y61-D66 WeakPolarHBondContact CE1-O 3.4Å; Y61-D66 HydrophobicContact CG-CB 4.1Å; E62-D66 PolarHBondContact N-OD2 3.5Å; T63-D66 PolarHBondContact N-OD2 3.04Å; T63-D66 PolarHBondContact O-N 2.98Å; T63-D66 VanDerWaalsContact O-N 3.14Å; T63-D66 PolarHBondContact OG1-N 2.61Å; T63-D66 PolarHBondContact OG1-OD1 3.36Å; T63-D66 VanDerWaalsContact OG1-OD1 3.1Å; T63-D66 PolarHBondContact OG1-OD2 3.28Å; T63-D66 VanDerWaalsContact OG1-OD2 3.06Å; Q64-D66 VanDerWaalsContact C-N 3.31Å; D66-K68 VanDerWaalsContact C-N 3.34Å; D66-K68 PolarHBondContact O-N 3.16Å; D66-Q69 PolarHBondContact O-N 3.27Å; D66-F70 WeakPolarHBondContact O-CB 3.39Å; D66-F70 PolarHBondContact O-N 3.08Å
67	E	70.3	Confident	70.8	Confident	35 Å²	35	63.1 Å²	63.1	16%	0.164	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-41.4	175	-167.9	-157.8	-175.6	0	0	111.5	Y61 N65 R71 I198	Y61-E67 HydrophobicContact CD1-CB 4.48Å; Y61-E67 HydrophobicContact CD2-CB 3.85Å; Y61-E67 HydrophobicContact CD2-CG 4.03Å; Y61-E67 HydrophobicContact CE2-CB 3.95Å; Y61-E67 HydrophobicContact CE2-CG 3.78Å; Y61-E67 HydrophobicContact CG-CB 4.12Å; N65-E67 VanDerWaalsContact C-N 3.35Å; N65-E67 PolarHBondContact O-N 2.93Å; E67-R71 VanDerWaalsContact CD-CZ 3.41Å; E67-R71 WeakPolarHBondContact O-CG 3.47Å; E67-R71 PolarHBondContact O-N 3.39Å; E67-R71 IonicContact OE1-CZ 3.46Å; E67-R71 IonicContact OE1-NH1 3.25Å; E67-R71 PolarHBondContact OE1-NH1 3.49Å; E67-R71 IonicContact OE1-NH2 2.85Å; E67-R71 IonicContact OE2-CZ 3.71Å; E67-R71 IonicContact OE2-NH1 2.91Å; E67-R71 PolarHBondContact OE2-NH1 2.98Å; E67-R71 IonicContact OE2-NH2 3.58Å; E67-R71 PolarHBondContact OE2-NH2 2.99Å; E67-I198 WeakPolarHBondContact OE1-CD1 3.4Å
68	K	76.6	Confident	72.3	Confident	116 Å²	116	59.4 Å²	59.4	50%	0.504	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-47.9	175	-175.5	-174.4	172.2	-170.6	0	111.3	Q64 N65 D66 F70 R71 D72	Q64-K68 PolarHBondContact O-N 3.07Å; N65-K68 PolarHBondContact O-N 2.85Å; D66-K68 VanDerWaalsContact C-N 3.34Å; D66-K68 PolarHBondContact O-N 3.16Å; K68-F70 VanDerWaalsContact C-N 3.28Å; K68-F70 PolarHBondContact O-N 3.15Å; K68-R71 PolarHBondContact O-N 2.85Å; K68-R71 VanDerWaalsContact O-N 3.15Å; K68-D72 WeakPolarHBondContact O-CB 3.4Å; K68-D72 VanDerWaalsContact O-CG 3.31Å; K68-D72 PolarHBondContact O-N 3.35Å
69	Q	76.7	Confident	73.9	Confident	58 Å²	58	60.7 Å²	60.7	27%	0.271	29%	0.292	S	S	.	.	H	α-helix	trans	-57.7	-43.2	177.9	-74.3	178.6	8.7	0	0	111.3	N65 D66 D72 E73 S117 S118	N65-Q69 WeakPolarHBondContact O-CG 3.17Å; N65-Q69 PolarHBondContact O-N 2.84Å; D66-Q69 PolarHBondContact O-N 3.27Å; Q69-D72 PolarHBondContact O-N 3.36Å; Q69-E73 WeakPolarHBondContact O-CB 3.36Å; Q69-E73 PolarHBondContact O-N 2.94Å; Q69-S117 PolarHBondContact O-OG 3.47Å; Q69-S118 PolarHBondContact OE1-OG 3.43Å
70	F	78.4	Confident	76	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-48.1	174.6	178.7	-95.1	0	0	0	112.3	K52 I55 Y61 D66 K68 D72 E73 I74 F125 V128	K52-F70 HydrophobicContact CG-CE1 4.42Å; K52-F70 HydrophobicContact CG-CZ 4.45Å; I55-F70 HydrophobicContact CB-CE2 4.42Å; I55-F70 HydrophobicContact CD1-CE2 4.34Å; I55-F70 HydrophobicContact CG2-CD2 4.38Å; I55-F70 HydrophobicContact CG2-CE2 3.82Å; I55-F70 HydrophobicContact CG2-CZ 4.36Å; Y61-F70 HydrophobicContact CE1-CB 3.6Å; Y61-F70 HydrophobicContact CE1-CD2 4.5Å; Y61-F70 HydrophobicContact CE1-CG 4.12Å; Y61-F70 AromaticContact CZ-CG 3.84Å; Y61-F70 WeakPolarHBondContact OH-CB 3.46Å; Y61-F70 WeakPolarHBondContact OH-CD1 3.38Å; Y61-F70 WeakPolarHBondContact OH-CD2 3.18Å; Y61-F70 WeakPolarHBondContact OH-CE1 3.49Å; Y61-F70 WeakPolarHBondContact OH-CG 3.31Å; D66-F70 WeakPolarHBondContact O-CB 3.39Å; D66-F70 PolarHBondContact O-N 3.08Å; K68-F70 VanDerWaalsContact C-N 3.28Å; K68-F70 PolarHBondContact O-N 3.15Å; F70-D72 VanDerWaalsContact C-N 3.31Å; F70-D72 PolarHBondContact O-N 3.13Å; F70-E73 PolarHBondContact O-N 3.41Å; F70-I74 HydrophobicContact CD1-CG1 3.97Å; F70-I74 HydrophobicContact CE1-CD1 4.1Å; F70-I74 HydrophobicContact CE1-CG1 3.73Å; F70-I74 HydrophobicContact CE2-CD1 4.22Å; F70-I74 HydrophobicContact CZ-CD1 3.89Å; F70-I74 HydrophobicContact CZ-CG1 4.06Å; F70-I74 WeakPolarHBondContact O-CG1 3.15Å; F70-I74 PolarHBondContact O-N 3.35Å; F70-F125 HydrophobicContact CB-CE1 4.49Å; F70-F125 HydrophobicContact CB-CZ 4.17Å; F70-F125 HydrophobicContact CD2-CD1 4.38Å; F70-F125 AromaticContact CD2-CE1 3.47Å; F70-F125 HydrophobicContact CD2-CE1 3.47Å; F70-F125 VanDerWaalsContact CD2-CE1 3.47Å; F70-F125 AromaticContact CD2-CZ 3.62Å; F70-F125 HydrophobicContact CD2-CZ 3.62Å; F70-F125 HydrophobicContact CE2-CE1 4.1Å; F70-F125 HydrophobicContact CG-CE1 4.28Å; F70-F125 HydrophobicContact CG-CZ 4.33Å; F70-V128 HydrophobicContact CE2-CG2 3.98Å; F70-V128 HydrophobicContact CZ-CG2 4.11Å
71	R	80.7	Confident	78.1	Confident	97 Å²	97	59.3 Å²	59.3	37%	0.366	28%	0.276	S	S	.	.	H	α-helix	trans	-57.5	-44.9	176.3	-77.8	-174.5	-73.7	-112.3	-9.5	112.1	E67 K68 E73 I74 I75	E67-R71 VanDerWaalsContact CD-CZ 3.41Å; E67-R71 WeakPolarHBondContact O-CG 3.47Å; E67-R71 PolarHBondContact O-N 3.39Å; E67-R71 IonicContact OE1-CZ 3.46Å; E67-R71 IonicContact OE1-NH1 3.25Å; E67-R71 PolarHBondContact OE1-NH1 3.49Å; E67-R71 IonicContact OE1-NH2 2.85Å; E67-R71 IonicContact OE2-CZ 3.71Å; E67-R71 IonicContact OE2-NH1 2.91Å; E67-R71 PolarHBondContact OE2-NH1 2.98Å; E67-R71 IonicContact OE2-NH2 3.58Å; E67-R71 PolarHBondContact OE2-NH2 2.99Å; K68-R71 PolarHBondContact O-N 2.85Å; K68-R71 VanDerWaalsContact O-N 3.15Å; R71-E73 VanDerWaalsContact C-N 3.29Å; R71-E73 PolarHBondContact O-N 2.81Å; R71-I74 PolarHBondContact O-N 3.09Å; R71-I75 VanDerWaalsContact O-CG1 3.32Å; R71-I75 WeakPolarHBondContact O-CG1 3.26Å; R71-I75 PolarHBondContact O-N 3.29Å
72	D	84.4	Confident	80.2	Confident	71 Å²	71	57.3 Å²	57.3	38%	0.38	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-39	179.4	-70.2	-17	0	0	0	110.8	K68 Q69 F70 I75 R76	K68-D72 WeakPolarHBondContact O-CB 3.4Å; K68-D72 VanDerWaalsContact O-CG 3.31Å; K68-D72 PolarHBondContact O-N 3.35Å; Q69-D72 PolarHBondContact O-N 3.36Å; F70-D72 VanDerWaalsContact C-N 3.31Å; F70-D72 PolarHBondContact O-N 3.13Å; D72-I75 PolarHBondContact O-N 3.17Å; D72-R76 WeakPolarHBondContact O-CB 3.46Å; D72-R76 PolarHBondContact O-N 3.04Å
73	E	85.2	Confident	82.3	Confident	7 Å²	7	49.3 Å²	49.3	3%	0.033	23%	0.232	C	C	.	.	H	α-helix	trans	-69	-39.3	175.6	-174.1	57.8	-155.4	0	0	112.5	Q69 F70 R71 I75 R76 L77 F125	Q69-E73 WeakPolarHBondContact O-CB 3.36Å; Q69-E73 PolarHBondContact O-N 2.94Å; F70-E73 PolarHBondContact O-N 3.41Å; R71-E73 VanDerWaalsContact C-N 3.29Å; R71-E73 PolarHBondContact O-N 2.81Å; E73-I75 VanDerWaalsContact C-N 3.33Å; E73-I75 PolarHBondContact O-N 3.45Å; E73-R76 VanDerWaalsContact CD-NE 3.26Å; E73-R76 WeakPolarHBondContact O-CB 3.46Å; E73-R76 PolarHBondContact O-N 3.49Å; E73-R76 IonicContact OE1-CZ 2.72Å; E73-R76 IonicContact OE1-NE 3.71Å; E73-R76 PolarHBondContact OE1-NE 2.97Å; E73-R76 IonicContact OE1-NH2 3.79Å; E73-R76 PolarHBondContact OE1-NH2 3Å; E73-R76 WeakPolarHBondContact OE2-CD 3.36Å; E73-R76 IonicContact OE2-CZ 3.84Å; E73-R76 IonicContact OE2-NE 3.61Å; E73-R76 PolarHBondContact OE2-NE 3.26Å; E73-L77 HydrophobicContact CG-CD1 4.29Å; E73-L77 WeakPolarHBondContact O-CB 3.4Å; E73-L77 VanDerWaalsContact O-CG 3.3Å; E73-L77 WeakPolarHBondContact O-CG 3.46Å; E73-L77 PolarHBondContact O-N 3.36Å; E73-F125 HydrophobicContact CB-CD1 4.33Å; E73-F125 HydrophobicContact CB-CE1 3.65Å; E73-F125 HydrophobicContact CB-CZ 4.29Å; E73-F125 HydrophobicContact CG-CD1 3.61Å; E73-F125 HydrophobicContact CG-CE1 3.44Å; E73-F125 VanDerWaalsContact CG-CE1 3.44Å; E73-F125 HydrophobicContact CG-CZ 4.31Å
74	I	87.3	Confident	84.5	Confident	7 Å²	7	48 Å²	48	4%	0.036	22%	0.22	C	C	.	.	H	α-helix	trans	-59	-45.7	170.8	-62.6	-48.3	0	0	0	110.9	F70 R71 R76 L77 E78 V128	F70-I74 HydrophobicContact CD1-CG1 3.97Å; F70-I74 HydrophobicContact CE1-CD1 4.1Å; F70-I74 HydrophobicContact CE1-CG1 3.73Å; F70-I74 HydrophobicContact CE2-CD1 4.22Å; F70-I74 HydrophobicContact CZ-CD1 3.89Å; F70-I74 HydrophobicContact CZ-CG1 4.06Å; F70-I74 WeakPolarHBondContact O-CG1 3.15Å; F70-I74 PolarHBondContact O-N 3.35Å; R71-I74 PolarHBondContact O-N 3.09Å; I74-R76 VanDerWaalsContact C-N 3.29Å; I74-R76 PolarHBondContact O-N 3.5Å; I74-L77 PolarHBondContact O-N 3.46Å; I74-E78 HydrophobicContact CG2-CG 4.17Å; I74-E78 WeakPolarHBondContact O-CB 3.35Å; I74-E78 VanDerWaalsContact O-CG 3.27Å; I74-E78 WeakPolarHBondContact O-CG 3.23Å; I74-E78 PolarHBondContact O-N 2.74Å; I74-V128 HydrophobicContact CD1-CB 4.02Å; I74-V128 HydrophobicContact CD1-CG1 3.18Å
75	I	89.3	Confident	86.4	Confident	40 Å²	40	40.1 Å²	40.1	21%	0.205	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-42.1	177.7	-70	163.1	0	0	0	110.2	R71 D72 E73 R79 I360	R71-I75 VanDerWaalsContact O-CG1 3.32Å; R71-I75 WeakPolarHBondContact O-CG1 3.26Å; R71-I75 PolarHBondContact O-N 3.29Å; D72-I75 PolarHBondContact O-N 3.17Å; E73-I75 VanDerWaalsContact C-N 3.33Å; E73-I75 PolarHBondContact O-N 3.45Å; I75-R79 WeakPolarHBondContact O-CB 3.4Å; I75-R79 VanDerWaalsContact O-CG 3.24Å; I75-R79 WeakPolarHBondContact O-CG 3.35Å; I75-R79 PolarHBondContact O-N 3Å; I75-I360 HydrophobicContact CG1-CB 4.4Å; I75-I360 HydrophobicContact CG1-CG2 3.52Å
76	R	91.6	Very high	87.9	Confident	24 Å²	24	35.1 Å²	35.1	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-49.2	176.3	-167.8	-167.4	73.8	74.9	9.2	111.3	D72 E73 I74 R79 L80 I114	D72-R76 WeakPolarHBondContact O-CB 3.46Å; D72-R76 PolarHBondContact O-N 3.04Å; E73-R76 VanDerWaalsContact CD-NE 3.26Å; E73-R76 WeakPolarHBondContact O-CB 3.46Å; E73-R76 PolarHBondContact O-N 3.49Å; E73-R76 IonicContact OE1-CZ 2.72Å; E73-R76 IonicContact OE1-NE 3.71Å; E73-R76 PolarHBondContact OE1-NE 2.97Å; E73-R76 IonicContact OE1-NH2 3.79Å; E73-R76 PolarHBondContact OE1-NH2 3Å; E73-R76 WeakPolarHBondContact OE2-CD 3.36Å; E73-R76 IonicContact OE2-CZ 3.84Å; E73-R76 IonicContact OE2-NE 3.61Å; E73-R76 PolarHBondContact OE2-NE 3.26Å; I74-R76 VanDerWaalsContact C-N 3.29Å; I74-R76 PolarHBondContact O-N 3.5Å; R76-R79 PolarHBondContact O-N 3.03Å; R76-L80 WeakPolarHBondContact O-CB 3.32Å; R76-L80 PolarHBondContact O-N 3.33Å; R76-I114 HydrophobicContact CG-CB 4.21Å; R76-I114 HydrophobicContact CG-CG2 3.87Å; R76-I114 PolarHBondContact NH1-O 3.46Å
77	L	92.5	Very high	89.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-45.1	179	-70.3	168	0	0	0	112	E73 I74 R79 L80 Y81 E129 V132	E73-L77 HydrophobicContact CG-CD1 4.29Å; E73-L77 WeakPolarHBondContact O-CB 3.4Å; E73-L77 VanDerWaalsContact O-CG 3.3Å; E73-L77 WeakPolarHBondContact O-CG 3.46Å; E73-L77 PolarHBondContact O-N 3.36Å; I74-L77 PolarHBondContact O-N 3.46Å; L77-R79 VanDerWaalsContact C-N 3.3Å; L77-R79 PolarHBondContact O-N 3.35Å; L77-L80 WeakPolarHBondContact O-CB 3.49Å; L77-L80 PolarHBondContact O-N 3.41Å; L77-Y81 HydrophobicContact CD2-CE2 4.15Å; L77-Y81 VanDerWaalsContact O-CD2 3.29Å; L77-Y81 WeakPolarHBondContact O-CD2 3.46Å; L77-Y81 PolarHBondContact O-N 3.25Å; L77-E129 HydrophobicContact CD1-CB 3.99Å; L77-E129 HydrophobicContact CD2-CB 3.97Å; L77-E129 HydrophobicContact CD2-CG 3.71Å; L77-V132 HydrophobicContact CB-CB 4.37Å; L77-V132 HydrophobicContact CB-CG1 4.08Å; L77-V132 HydrophobicContact CB-CG2 4.34Å
78	E	94.4	Very high	90.7	Very high	4 Å²	4	34 Å²	34	2%	0.019	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-39	177.3	-75.1	-88.6	-159.7	0	0	111.6	L48 I74 G82 V132 K135 W136 L357 I360	L48-E78 WeakPolarHBondContact CD2-OE1 3.19Å; I74-E78 HydrophobicContact CG2-CG 4.17Å; I74-E78 WeakPolarHBondContact O-CB 3.35Å; I74-E78 VanDerWaalsContact O-CG 3.27Å; I74-E78 WeakPolarHBondContact O-CG 3.23Å; I74-E78 PolarHBondContact O-N 2.74Å; E78-G82 WeakPolarHBondContact O-CA 3.49Å; E78-G82 PolarHBondContact O-N 2.83Å; E78-V132 HydrophobicContact CG-CG1 4.07Å; E78-K135 IonicContact OE1-NZ 3.59Å; E78-K135 PolarHBondContact OE1-NZ 2.81Å; E78-K135 IonicContact OE2-NZ 3.67Å; E78-K135 PolarHBondContact OE2-NZ 3.14Å; E78-W136 PolarHBondContact O-NE1 2.89Å; E78-W136 PolarHBondContact OE2-NE1 3.37Å; E78-L357 HydrophobicContact CB-CD2 4.3Å; E78-I360 HydrophobicContact CB-CD1 3.29Å; E78-I360 HydrophobicContact CG-CD1 3.48Å; E78-I360 VanDerWaalsContact CG-CD1 3.48Å; E78-I360 HydrophobicContact CG-CG1 4.44Å
79	R	94.6	Very high	91.6	Very high	136 Å²	136	28.4 Å²	28.4	51%	0.513	13%	0.127	S	C	.	.	H	α-helix	trans	-66	-43.1	173.4	-73.4	172.6	-179.8	178.4	3.2	112.3	I75 R76 L77 A83 L357	I75-R79 WeakPolarHBondContact O-CB 3.4Å; I75-R79 VanDerWaalsContact O-CG 3.24Å; I75-R79 WeakPolarHBondContact O-CG 3.35Å; I75-R79 PolarHBondContact O-N 3Å; R76-R79 PolarHBondContact O-N 3.03Å; L77-R79 VanDerWaalsContact C-N 3.3Å; L77-R79 PolarHBondContact O-N 3.35Å; R79-A83 VanDerWaalsContact O-CB 3.28Å; R79-A83 WeakPolarHBondContact O-CB 3.47Å; R79-A83 PolarHBondContact O-N 3.47Å; R79-L357 HydrophobicContact CG-CD1 4.4Å; R79-L357 HydrophobicContact CG-CD2 4.07Å
80	L	95.4	Very high	92.6	Very high	13 Å²	13	25.7 Å²	25.7	7%	0.068	12%	0.115	C	C	.	.	H	α-helix	trans	-59.9	-54	178.1	174.5	60.2	0	0	0	111.4	R76 L77 A83 K84 Y108 A111	R76-L80 WeakPolarHBondContact O-CB 3.32Å; R76-L80 PolarHBondContact O-N 3.33Å; L77-L80 WeakPolarHBondContact O-CB 3.49Å; L77-L80 PolarHBondContact O-N 3.41Å; L80-A83 PolarHBondContact O-N 2.89Å; L80-K84 PolarHBondContact O-N 3.18Å; L80-Y108 HydrophobicContact CD1-CD2 3.95Å; L80-Y108 HydrophobicContact CD1-CE2 3.46Å; L80-Y108 VanDerWaalsContact CD1-CE2 3.46Å; L80-Y108 HydrophobicContact CG-CE2 4.3Å; L80-A111 HydrophobicContact CD1-CB 4.2Å
81	Y	96.9	Very high	93.4	Very high	21 Å²	21	30.3 Å²	30.3	8%	0.082	14%	0.135	C	C	.	.	H	α-helix	trans	-76.7	-26.8	-176.4	-72.9	-72.2	0	0	0	113	L77 K84 W85 E129 V132 E133	L77-Y81 HydrophobicContact CD2-CE2 4.15Å; L77-Y81 VanDerWaalsContact O-CD2 3.29Å; L77-Y81 WeakPolarHBondContact O-CD2 3.46Å; L77-Y81 PolarHBondContact O-N 3.25Å; Y81-K84 HydrophobicContact CD1-CD 4.11Å; Y81-K84 HydrophobicContact CE1-CD 4.41Å; Y81-K84 PolarHBondContact O-N 3.2Å; Y81-W85 WeakPolarHBondContact O-CB 3.33Å; Y81-W85 PolarHBondContact O-N 3.37Å; Y81-E129 HydrophobicContact CE2-CG 4.17Å; Y81-V132 HydrophobicContact CD2-CB 4.44Å; Y81-V132 HydrophobicContact CD2-CG1 3.85Å; Y81-V132 HydrophobicContact CG-CG1 4.45Å; Y81-E133 HydrophobicContact CD1-CB 3.92Å; Y81-E133 HydrophobicContact CD1-CG 3.89Å; Y81-E133 HydrophobicContact CD2-CB 4.38Å; Y81-E133 HydrophobicContact CE1-CB 3.47Å; Y81-E133 VanDerWaalsContact CE1-CB 3.47Å; Y81-E133 VanDerWaalsContact CE1-CD 3.44Å; Y81-E133 HydrophobicContact CE1-CG 3.38Å; Y81-E133 HydrophobicContact CE2-CB 3.99Å; Y81-E133 HydrophobicContact CG-CB 4.36Å; Y81-E133 PolarHBondContact OH-OE2 3.33Å
82	G	96.7	Very high	94	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.4	-43.1	166.9	0	0	0	0	0	112.4	E78 K84 W85 I86	E78-G82 WeakPolarHBondContact O-CA 3.49Å; E78-G82 PolarHBondContact O-N 2.83Å; G82-K84 VanDerWaalsContact C-N 3.32Å; G82-K84 PolarHBondContact O-N 3.25Å; G82-W85 PolarHBondContact O-N 2.9Å; G82-I86 PolarHBondContact O-N 2.92Å; G82-I86 VanDerWaalsContact O-N 3.14Å
83	A	96.5	Very high	94.4	Very high	12 Å²	12	27.3 Å²	27.3	10%	0.099	13%	0.131	C	C	.	.	H	α-helix	trans	-65.1	-35.9	174.4	0	0	0	0	0	112.3	R79 L80 I86 L87 Y108 A111	R79-A83 VanDerWaalsContact O-CB 3.28Å; R79-A83 WeakPolarHBondContact O-CB 3.47Å; R79-A83 PolarHBondContact O-N 3.47Å; L80-A83 PolarHBondContact O-N 2.89Å; A83-I86 WeakPolarHBondContact O-CG2 3.46Å; A83-L87 WeakPolarHBondContact O-CB 3.32Å; A83-L87 PolarHBondContact O-N 3.31Å; A83-Y108 HydrophobicContact CB-CD2 4.33Å; A83-A111 HydrophobicContact CB-CB 4.31Å
84	K	97.6	Very high	94.7	Very high	47 Å²	47	28.4 Å²	28.4	20%	0.204	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-48	173	-169.4	178.5	173.8	-176.6	0	111.6	L80 Y81 G82 I86 L87 D88 Y108 E133	L80-K84 PolarHBondContact O-N 3.18Å; Y81-K84 HydrophobicContact CD1-CD 4.11Å; Y81-K84 HydrophobicContact CE1-CD 4.41Å; Y81-K84 PolarHBondContact O-N 3.2Å; G82-K84 VanDerWaalsContact C-N 3.32Å; G82-K84 PolarHBondContact O-N 3.25Å; K84-I86 PolarHBondContact O-N 3.07Å; K84-L87 PolarHBondContact O-N 2.86Å; K84-D88 WeakPolarHBondContact O-CB 3.5Å; K84-D88 PolarHBondContact O-N 3.15Å; K84-Y108 HydrophobicContact CB-CD2 3.73Å; K84-Y108 HydrophobicContact CB-CE2 3.56Å; K84-Y108 HydrophobicContact CD-CE2 4.21Å; K84-Y108 HydrophobicContact CG-CD2 4.4Å; K84-Y108 HydrophobicContact CG-CE2 3.95Å; K84-E133 IonicContact NZ-OE1 3.53Å; K84-E133 PolarHBondContact NZ-OE1 3.39Å
85	W	97.6	Very high	94.9	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-55.4	-52.2	179.6	158	76.8	0	0	0	112	Y81 G82 L87 D88 L89 W136 R139 L140 D143 Y349 I352 L353	Y81-W85 WeakPolarHBondContact O-CB 3.33Å; Y81-W85 PolarHBondContact O-N 3.37Å; G82-W85 PolarHBondContact O-N 2.9Å; W85-L87 VanDerWaalsContact C-N 3.31Å; W85-L87 PolarHBondContact O-N 3.34Å; W85-D88 PolarHBondContact O-N 2.88Å; W85-L89 HydrophobicContact CZ2-CD2 4.01Å; W85-L89 VanDerWaalsContact O-CB 3.31Å; W85-L89 WeakPolarHBondContact O-CB 3.39Å; W85-L89 PolarHBondContact O-N 3.25Å; W85-W136 HydrophobicContact CB-CD2 4.38Å; W85-W136 HydrophobicContact CB-CE3 3.55Å; W85-W136 HydrophobicContact CB-CZ3 4.11Å; W85-W136 AromaticContact CD2-CE3 3.95Å; W85-W136 HydrophobicContact CD2-CE3 3.95Å; W85-W136 AromaticContact CD2-CZ3 3.64Å; W85-W136 HydrophobicContact CD2-CZ3 3.64Å; W85-W136 HydrophobicContact CE3-CE3 4.17Å; W85-W136 HydrophobicContact CE3-CH2 4.31Å; W85-W136 AromaticContact CE3-CZ3 3.5Å; W85-W136 HydrophobicContact CE3-CZ3 3.5Å; W85-W136 VanDerWaalsContact CE3-CZ3 3.5Å; W85-W136 AromaticContact CG-CE3 3.67Å; W85-W136 HydrophobicContact CG-CE3 3.67Å; W85-W136 AromaticContact CG-CZ3 3.9Å; W85-W136 HydrophobicContact CG-CZ3 3.9Å; W85-W136 HydrophobicContact CZ3-CZ3 4.16Å; W85-R139 HydrophobicContact CD2-CG 4.43Å; W85-R139 HydrophobicContact CG-CG 4.45Å; W85-R139 HydrophobicContact CZ2-CG 4.44Å; W85-L140 VanDerWaalsContact CD1-CA 3.45Å; W85-D143 VanDerWaalsContact CE2-OD2 3.22Å; W85-D143 WeakPolarHBondContact CZ2-OD2 3.4Å; W85-D143 PolarHBondContact NE1-OD2 3.49Å; W85-Y349 HydrophobicContact CZ2-CD1 4.27Å; W85-I352 HydrophobicContact CH2-CG2 4.37Å; W85-L353 HydrophobicContact CE3-CD1 3.91Å; W85-L353 HydrophobicContact CH2-CB 4.47Å; W85-L353 HydrophobicContact CZ3-CB 3.71Å; W85-L353 HydrophobicContact CZ3-CD1 3.81Å; W85-L353 HydrophobicContact CZ3-CD2 4.24Å; W85-L353 HydrophobicContact CZ3-CG 4.09Å
86	I	96.6	Very high	95.1	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-36	-176.4	-164.7	160.3	0	0	0	111.7	G82 A83 K84 F90 Y104 E350 L353	G82-I86 PolarHBondContact O-N 2.92Å; G82-I86 VanDerWaalsContact O-N 3.14Å; A83-I86 WeakPolarHBondContact O-CG2 3.46Å; K84-I86 PolarHBondContact O-N 3.07Å; I86-F90 HydrophobicContact CD1-CE2 3.79Å; I86-F90 HydrophobicContact CG1-CD2 3.65Å; I86-F90 HydrophobicContact CG1-CE2 3.28Å; I86-F90 HydrophobicContact CG1-CZ 4.22Å; I86-F90 WeakPolarHBondContact O-CD2 3.5Å; I86-F90 PolarHBondContact O-N 3.32Å; I86-Y104 HydrophobicContact CB-CD1 4.48Å; I86-Y104 HydrophobicContact CB-CE1 4.45Å; I86-Y104 HydrophobicContact CD1-CD1 4.45Å; I86-Y104 HydrophobicContact CD1-CE1 3.62Å; I86-Y104 HydrophobicContact CG1-CD1 4.18Å; I86-Y104 HydrophobicContact CG1-CE1 3.77Å; I86-Y104 HydrophobicContact CG2-CD1 3.56Å; I86-Y104 HydrophobicContact CG2-CE1 3.83Å; I86-Y104 HydrophobicContact CG2-CG 4.35Å; I86-E350 HydrophobicContact CD1-CG 4.06Å; I86-L353 HydrophobicContact CB-CD2 4.13Å; I86-L353 HydrophobicContact CD1-CB 4.49Å; I86-L353 HydrophobicContact CD1-CD2 3.76Å; I86-L353 HydrophobicContact CG2-CD2 3.94Å
87	L	97.4	Very high	95.2	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-61.9	-51.8	173.4	172.7	59.8	0	0	0	111.4	A83 K84 W85 L89 F90 K91 Y108	A83-L87 WeakPolarHBondContact O-CB 3.32Å; A83-L87 PolarHBondContact O-N 3.31Å; K84-L87 PolarHBondContact O-N 2.86Å; W85-L87 VanDerWaalsContact C-N 3.31Å; W85-L87 PolarHBondContact O-N 3.34Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 3.2Å; L87-F90 PolarHBondContact O-N 2.96Å; L87-K91 HydrophobicContact CD1-CG 4.39Å; L87-K91 WeakPolarHBondContact O-CG 3.43Å; L87-K91 PolarHBondContact O-N 3.18Å; L87-Y108 HydrophobicContact CD2-CD1 4.34Å; L87-Y108 HydrophobicContact CD2-CG 4.35Å
88	D	97.7	Very high	95.2	Very high	40 Å²	40	49.4 Å²	49.4	21%	0.214	24%	0.242	C	C	.	.	H	α-helix	trans	-70.3	-32.1	-176.1	-70.8	-20.8	0	0	0	112.3	K84 W85 K91 S92 L140	K84-D88 WeakPolarHBondContact O-CB 3.5Å; K84-D88 PolarHBondContact O-N 3.15Å; W85-D88 PolarHBondContact O-N 2.88Å; D88-K91 IonicContact OD1-NZ 2.91Å; D88-K91 PolarHBondContact OD1-NZ 3.42Å; D88-S92 PolarHBondContact O-N 3.47Å; D88-S92 PolarHBondContact O-OG 3.38Å; D88-S92 VanDerWaalsContact O-OG 3.06Å; D88-L140 HydrophobicContact CB-CD1 4.29Å; D88-L140 HydrophobicContact CB-CD2 3.89Å
89	L	97.2	Very high	95.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-52.5	169.3	-179.9	60.6	0	0	0	110.6	W85 L87 K91 S92 I93 L140 D143 L144 Y349	W85-L89 HydrophobicContact CZ2-CD2 4.01Å; W85-L89 VanDerWaalsContact O-CB 3.31Å; W85-L89 WeakPolarHBondContact O-CB 3.39Å; W85-L89 PolarHBondContact O-N 3.25Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 3.2Å; L89-K91 PolarHBondContact O-N 3.46Å; L89-S92 WeakPolarHBondContact O-CA 3.33Å; L89-S92 WeakPolarHBondContact O-CB 3.39Å; L89-S92 PolarHBondContact O-N 3.48Å; L89-I93 HydrophobicContact CD1-CG2 3.93Å; L89-I93 HydrophobicContact CG-CD1 4.42Å; L89-I93 PolarHBondContact O-N 2.89Å; L89-L140 HydrophobicContact CB-CD1 3.96Å; L89-D143 HydrophobicContact CD1-CB 4.06Å; L89-D143 HydrophobicContact CD2-CB 4.17Å; L89-L144 HydrophobicContact CD1-CD2 3.82Å; L89-L144 HydrophobicContact CD1-CG 4.26Å; L89-Y349 HydrophobicContact CD2-CD1 3.91Å; L89-Y349 HydrophobicContact CD2-CD2 4Å; L89-Y349 HydrophobicContact CD2-CE1 4.15Å; L89-Y349 HydrophobicContact CD2-CE2 4.21Å; L89-Y349 HydrophobicContact CD2-CG 3.85Å
90	F	95.8	Very high	95.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-71.7	-27	-177.3	-68.8	-47.5	0	0	0	114.5	I86 L87 S92 I93 S94 L100 L101 Y104 I346 Y349	I86-F90 HydrophobicContact CD1-CE2 3.79Å; I86-F90 HydrophobicContact CG1-CD2 3.65Å; I86-F90 HydrophobicContact CG1-CE2 3.28Å; I86-F90 HydrophobicContact CG1-CZ 4.22Å; I86-F90 WeakPolarHBondContact O-CD2 3.5Å; I86-F90 PolarHBondContact O-N 3.32Å; L87-F90 PolarHBondContact O-N 2.96Å; F90-S92 PolarHBondContact O-N 2.93Å; F90-I93 HydrophobicContact CD1-CD1 3.41Å; F90-I93 VanDerWaalsContact CD1-CD1 3.41Å; F90-I93 HydrophobicContact CD1-CG1 3.51Å; F90-I93 HydrophobicContact CE1-CD1 3.42Å; F90-I93 VanDerWaalsContact CE1-CD1 3.42Å; F90-I93 HydrophobicContact CE1-CG1 4.09Å; F90-S94 CarbonylContact O-C 3.27Å; F90-S94 VanDerWaalsContact O-C 3.27Å; F90-S94 WeakPolarHBondContact O-CA 3.4Å; F90-S94 PolarHBondContact O-N 3.31Å; F90-L100 HydrophobicContact CB-CD2 4.14Å; F90-L100 HydrophobicContact CD1-CD2 4.21Å; F90-L100 HydrophobicContact CD2-CD2 4.4Å; F90-L100 HydrophobicContact CG-CD2 4.01Å; F90-L101 HydrophobicContact CB-CD2 4.11Å; F90-Y104 AromaticContact CD2-CD2 3.56Å; F90-Y104 HydrophobicContact CD2-CD2 3.56Å; F90-Y104 AromaticContact CD2-CE2 3.2Å; F90-Y104 HydrophobicContact CD2-CE2 3.2Å; F90-Y104 HydrophobicContact CD2-CG 4.38Å; F90-Y104 AromaticContact CD2-CZ 3.8Å; F90-Y104 HydrophobicContact CE2-CD2 4.21Å; F90-Y104 HydrophobicContact CE2-CE1 4.45Å; F90-Y104 AromaticContact CE2-CE2 3.41Å; F90-Y104 HydrophobicContact CE2-CE2 3.41Å; F90-Y104 VanDerWaalsContact CE2-CE2 3.41Å; F90-Y104 AromaticContact CE2-CZ 3.57Å; F90-Y104 HydrophobicContact CG-CD2 4.45Å; F90-Y104 HydrophobicContact CG-CE2 4.26Å; F90-I346 HydrophobicContact CD1-CG1 4.27Å; F90-I346 HydrophobicContact CE1-CB 4.07Å; F90-I346 HydrophobicContact CE1-CG1 3.6Å; F90-I346 HydrophobicContact CE1-CG2 4.04Å; F90-I346 HydrophobicContact CE2-CG2 4.25Å; F90-I346 HydrophobicContact CZ-CB 4.06Å; F90-I346 HydrophobicContact CZ-CG1 4.11Å; F90-I346 HydrophobicContact CZ-CG2 3.66Å; F90-Y349 HydrophobicContact CE1-CD2 4.33Å
91	K	95.8	Very high	95.2	Very high	102 Å²	102	51.7 Å²	51.7	44%	0.443	26%	0.259	S	S	.	.	H	α-helix	trans	-56.1	-34.9	165.9	-76.5	176.3	-169.9	155.8	0	111.8	L87 D88 L89 P95 L101	L87-K91 HydrophobicContact CD1-CG 4.39Å; L87-K91 WeakPolarHBondContact O-CG 3.43Å; L87-K91 PolarHBondContact O-N 3.18Å; D88-K91 IonicContact OD1-NZ 2.91Å; D88-K91 PolarHBondContact OD1-NZ 3.42Å; L89-K91 PolarHBondContact O-N 3.46Å; K91-P95 WeakPolarHBondContact O-CB 3.18Å; K91-L101 HydrophobicContact CB-CD2 4.43Å; K91-L101 HydrophobicContact CG-CD2 3.96Å
92	S	93.8	Very high	95.2	Very high	71 Å²	71	56.2 Å²	56.2	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-83.8	-45.9	-177.8	-53.9	0	0	0	0	112.1	D88 L89 F90 L144	D88-S92 PolarHBondContact O-N 3.47Å; D88-S92 PolarHBondContact O-OG 3.38Å; D88-S92 VanDerWaalsContact O-OG 3.06Å; L89-S92 WeakPolarHBondContact O-CA 3.33Å; L89-S92 WeakPolarHBondContact O-CB 3.39Å; L89-S92 PolarHBondContact O-N 3.48Å; F90-S92 PolarHBondContact O-N 2.93Å; S92-L144 VanDerWaalsContact CB-CD2 3.46Å
93	I	92	Very high	95.2	Very high	34 Å²	34	58.6 Å²	58.6	17%	0.174	30%	0.296	C	S	.	.	H	α-helix	trans	-90.7	-17.7	-171.8	74.4	167.1	0	0	0	113.7	L89 F90 D147 Y349	L89-I93 HydrophobicContact CD1-CG2 3.93Å; L89-I93 HydrophobicContact CG-CD1 4.42Å; L89-I93 PolarHBondContact O-N 2.89Å; F90-I93 HydrophobicContact CD1-CD1 3.41Å; F90-I93 VanDerWaalsContact CD1-CD1 3.41Å; F90-I93 HydrophobicContact CD1-CG1 3.51Å; F90-I93 HydrophobicContact CE1-CD1 3.42Å; F90-I93 VanDerWaalsContact CE1-CD1 3.42Å; F90-I93 HydrophobicContact CE1-CG1 4.09Å; I93-D147 HydrophobicContact CG2-CB 3.73Å; I93-D147 VanDerWaalsContact CG2-OD2 3.29Å; I93-D147 WeakPolarHBondContact CG2-OD2 3.17Å; I93-Y349 HydrophobicContact CD1-CD2 4.43Å; I93-Y349 HydrophobicContact CD1-CE2 4.23Å
94	S	91.2	Very high	95.2	Very high	29 Å²	29	58.8 Å²	58.8	20%	0.203	29%	0.294	C	S	.	.			trans	-144.9	56.4	-179.5	-67.4	0	0	0	0	112	F90 N96 D97	F90-S94 CarbonylContact O-C 3.27Å; F90-S94 VanDerWaalsContact O-C 3.27Å; F90-S94 WeakPolarHBondContact O-CA 3.4Å; F90-S94 PolarHBondContact O-N 3.31Å; S94-N96 PolarHBondContact O-N 2.9Å; S94-D97 PolarHBondContact O-N 3.03Å; S94-D97 VanDerWaalsContact O-N 3.15Å
95	P	92	Very high	95.1	Very high	74 Å²	74	59.5 Å²	59.5	48%	0.481	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.4	-173.1	24.1	-34.7	0	0	0	114.2	K91 L101	K91-P95 WeakPolarHBondContact O-CB 3.18Å; P95-L101 WeakPolarHBondContact O-CD1 3.31Å
96	N	93.8	Very high	95.1	Very high	152 Å²	152	63.6 Å²	63.6	81%	0.813	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-9.4	-176	-63.4	-33.9	0	0	0	113.5	S94 R98	S94-N96 PolarHBondContact O-N 2.9Å; N96-R98 VanDerWaalsContact C-N 3.34Å; N96-R98 PolarHBondContact O-N 3.32Å
97	D	93.6	Very high	95	Very high	72 Å²	72	66 Å²	66	39%	0.385	34%	0.337	S	S	.	.			trans	-83.9	79.2	177.5	-166.1	-25.2	0	0	0	110.4	S94 H99 L100 L101	S94-D97 PolarHBondContact O-N 3.03Å; S94-D97 VanDerWaalsContact O-N 3.15Å; D97-H99 PolarHBondContact O-N 3.46Å; D97-H99 PolarHBondContact OD1-N 2.91Å; D97-L100 HydrophobicContact CB-CB 3.84Å; D97-L100 HydrophobicContact CB-CD2 4.38Å; D97-L100 PolarHBondContact O-N 2.84Å; D97-L100 WeakPolarHBondContact OD1-CB 3.36Å; D97-L100 PolarHBondContact OD1-N 3.31Å; D97-L101 WeakPolarHBondContact O-CG 3.41Å; D97-L101 PolarHBondContact O-N 3.28Å
98	R	93.1	Very high	95	Very high	215 Å²	215	69 Å²	69	81%	0.811	35%	0.349	S	S	*	.	H	α-helix	trans	-56.1	-37.5	-176.6	-66.6	-175.3	-176.3	174.6	1.2	112.8	N96 Q102	N96-R98 VanDerWaalsContact C-N 3.34Å; N96-R98 PolarHBondContact O-N 3.32Å; R98-Q102 VanDerWaalsContact O-CB 3.32Å; R98-Q102 WeakPolarHBondContact O-CB 3.37Å; R98-Q102 PolarHBondContact O-N 3.03Å
99	H	94.5	Very high	94.9	Very high	144 Å²	144	72.9 Å²	72.9	67%	0.667	36%	0.363	S	S	*	.	H	α-helix	trans	-68.2	-45.3	-179.2	-178	-73	0	0	0	111	D97 Q102 T103	D97-H99 PolarHBondContact O-N 3.46Å; D97-H99 PolarHBondContact OD1-N 2.91Å; H99-Q102 PolarHBondContact O-N 3.43Å; H99-T103 PolarHBondContact O-N 2.95Å; H99-T103 PolarHBondContact O-OG1 2.86Å
100	L	93.6	Very high	94.9	Very high	23 Å²	23	79.8 Å²	79.8	12%	0.12	39%	0.39	C	S	.	.	H	α-helix	trans	-59	-48.8	175.4	-170.8	74.9	0	0	0	111.1	F90 D97 Q102 T103 Y104 I346	F90-L100 HydrophobicContact CB-CD2 4.14Å; F90-L100 HydrophobicContact CD1-CD2 4.21Å; F90-L100 HydrophobicContact CD2-CD2 4.4Å; F90-L100 HydrophobicContact CG-CD2 4.01Å; D97-L100 HydrophobicContact CB-CB 3.84Å; D97-L100 HydrophobicContact CB-CD2 4.38Å; D97-L100 PolarHBondContact O-N 2.84Å; D97-L100 WeakPolarHBondContact OD1-CB 3.36Å; D97-L100 PolarHBondContact OD1-N 3.31Å; L100-Q102 VanDerWaalsContact C-N 3.35Å; L100-Q102 PolarHBondContact O-N 3.48Å; L100-T103 WeakPolarHBondContact O-CB 3.5Å; L100-T103 PolarHBondContact O-N 2.81Å; L100-Y104 HydrophobicContact CD1-CD2 4.18Å; L100-Y104 HydrophobicContact CD1-CE2 3.51Å; L100-Y104 HydrophobicContact CD2-CE2 4.47Å; L100-Y104 HydrophobicContact CG-CD2 3.93Å; L100-Y104 HydrophobicContact CG-CE2 3.7Å; L100-Y104 WeakPolarHBondContact O-CD2 3.45Å; L100-Y104 PolarHBondContact O-N 3.44Å; L100-Y104 VanDerWaalsContact O-N 3.08Å; L100-I346 HydrophobicContact CD1-CG2 4.44Å; L100-I346 HydrophobicContact CD2-CD1 4.14Å
101	L	96.2	Very high	94.7	Very high	33 Å²	33	80.3 Å²	80.3	17%	0.173	39%	0.394	C	S	.	.	H	α-helix	trans	-64.3	-38.7	-179.4	-64.8	-179.7	0	0	0	112.5	F90 K91 P95 D97 Y104 S105	F90-L101 HydrophobicContact CB-CD2 4.11Å; K91-L101 HydrophobicContact CB-CD2 4.43Å; K91-L101 HydrophobicContact CG-CD2 3.96Å; P95-L101 WeakPolarHBondContact O-CD1 3.31Å; D97-L101 WeakPolarHBondContact O-CG 3.41Å; D97-L101 PolarHBondContact O-N 3.28Å; L101-Y104 PolarHBondContact O-N 3.28Å; L101-S105 VanDerWaalsContact O-CB 3.26Å; L101-S105 WeakPolarHBondContact O-CB 3.41Å; L101-S105 PolarHBondContact O-N 2.72Å
102	Q	97.1	Very high	94.6	Very high	116 Å²	116	78.2 Å²	78.2	54%	0.542	39%	0.392	S	S	.	.	H	α-helix	trans	-62.2	-46	174.1	-179	173.2	-6.3	0	0	111.1	R98 H99 L100 Y104 S105 E106	R98-Q102 VanDerWaalsContact O-CB 3.32Å; R98-Q102 WeakPolarHBondContact O-CB 3.37Å; R98-Q102 PolarHBondContact O-N 3.03Å; H99-Q102 PolarHBondContact O-N 3.43Å; L100-Q102 VanDerWaalsContact C-N 3.35Å; L100-Q102 PolarHBondContact O-N 3.48Å; Q102-Y104 VanDerWaalsContact C-N 3.33Å; Q102-Y104 PolarHBondContact O-N 3.11Å; Q102-S105 WeakPolarHBondContact O-CB 3.39Å; Q102-S105 PolarHBondContact O-N 3.31Å; Q102-E106 WeakPolarHBondContact CG-OE1 3.32Å; Q102-E106 PolarHBondContact NE2-OE1 3.42Å; Q102-E106 WeakPolarHBondContact O-CG 3.41Å; Q102-E106 PolarHBondContact O-N 3.27Å
103	T	95.8	Very high	94.5	Very high	51 Å²	51	80.6 Å²	80.6	31%	0.313	40%	0.395	S	S	.	.	H	α-helix	trans	-55.9	-47.6	178.4	-57.3	0	0	0	0	111.2	H99 L100 E106 N107	H99-T103 PolarHBondContact O-N 2.95Å; H99-T103 PolarHBondContact O-OG1 2.86Å; L100-T103 WeakPolarHBondContact O-CB 3.5Å; L100-T103 PolarHBondContact O-N 2.81Å; T103-E106 PolarHBondContact O-N 3.16Å; T103-N107 VanDerWaalsContact O-CG 3.28Å; T103-N107 PolarHBondContact O-N 3.35Å; T103-N107 PolarHBondContact O-ND2 3.46Å
104	Y	96.1	Very high	94.2	Very high	15 Å²	15	82.9 Å²	82.9	6%	0.059	41%	0.407	C	S	.	.	H	α-helix	trans	-73.2	-31.5	180	-72.4	-61.3	0	0	0	113.9	I86 F90 L100 L101 Q102 N107 Y108 E350	I86-Y104 HydrophobicContact CB-CD1 4.48Å; I86-Y104 HydrophobicContact CB-CE1 4.45Å; I86-Y104 HydrophobicContact CD1-CD1 4.45Å; I86-Y104 HydrophobicContact CD1-CE1 3.62Å; I86-Y104 HydrophobicContact CG1-CD1 4.18Å; I86-Y104 HydrophobicContact CG1-CE1 3.77Å; I86-Y104 HydrophobicContact CG2-CD1 3.56Å; I86-Y104 HydrophobicContact CG2-CE1 3.83Å; I86-Y104 HydrophobicContact CG2-CG 4.35Å; F90-Y104 AromaticContact CD2-CD2 3.56Å; F90-Y104 HydrophobicContact CD2-CD2 3.56Å; F90-Y104 AromaticContact CD2-CE2 3.2Å; F90-Y104 HydrophobicContact CD2-CE2 3.2Å; F90-Y104 HydrophobicContact CD2-CG 4.38Å; F90-Y104 AromaticContact CD2-CZ 3.8Å; F90-Y104 HydrophobicContact CE2-CD2 4.21Å; F90-Y104 HydrophobicContact CE2-CE1 4.45Å; F90-Y104 AromaticContact CE2-CE2 3.41Å; F90-Y104 HydrophobicContact CE2-CE2 3.41Å; F90-Y104 VanDerWaalsContact CE2-CE2 3.41Å; F90-Y104 AromaticContact CE2-CZ 3.57Å; F90-Y104 HydrophobicContact CG-CD2 4.45Å; F90-Y104 HydrophobicContact CG-CE2 4.26Å; L100-Y104 HydrophobicContact CD1-CD2 4.18Å; L100-Y104 HydrophobicContact CD1-CE2 3.51Å; L100-Y104 HydrophobicContact CD2-CE2 4.47Å; L100-Y104 HydrophobicContact CG-CD2 3.93Å; L100-Y104 HydrophobicContact CG-CE2 3.7Å; L100-Y104 WeakPolarHBondContact O-CD2 3.45Å; L100-Y104 PolarHBondContact O-N 3.44Å; L100-Y104 VanDerWaalsContact O-N 3.08Å; L101-Y104 PolarHBondContact O-N 3.28Å; Q102-Y104 VanDerWaalsContact C-N 3.33Å; Q102-Y104 PolarHBondContact O-N 3.11Å; Y104-N107 PolarHBondContact O-N 2.93Å; Y104-Y108 PolarHBondContact O-N 3.07Å; Y104-E350 VanDerWaalsContact OH-CD 3.23Å; Y104-E350 WeakPolarHBondContact OH-CG 3.21Å; Y104-E350 PolarHBondContact OH-OE1 3.14Å
105	S	97.2	Very high	93.6	Very high	62 Å²	62	90.6 Å²	90.6	43%	0.434	44%	0.437	S	S	.	.	H	α-helix	trans	-62.6	-44.8	172.5	-173	0	0	0	0	111.2	L101 Q102 N107 Y108 K109	L101-S105 VanDerWaalsContact O-CB 3.26Å; L101-S105 WeakPolarHBondContact O-CB 3.41Å; L101-S105 PolarHBondContact O-N 2.72Å; Q102-S105 WeakPolarHBondContact O-CB 3.39Å; Q102-S105 PolarHBondContact O-N 3.31Å; S105-N107 PolarHBondContact O-N 3.35Å; S105-Y108 PolarHBondContact O-N 3.48Å; S105-K109 WeakPolarHBondContact O-CB 3.27Å; S105-K109 PolarHBondContact O-N 3.34Å
106	E	97.1	Very high	92.8	Very high	91 Å²	91	92.3 Å²	92.3	43%	0.425	43%	0.434	S	S	.	.	H	α-helix	trans	-66.8	-35.8	176.6	-71.3	172.8	-169.3	0	0	112.5	Q102 T103 R110	Q102-E106 WeakPolarHBondContact CG-OE1 3.32Å; Q102-E106 PolarHBondContact NE2-OE1 3.42Å; Q102-E106 WeakPolarHBondContact O-CG 3.41Å; Q102-E106 PolarHBondContact O-N 3.27Å; T103-E106 PolarHBondContact O-N 3.16Å; E106-R110 WeakPolarHBondContact O-CB 3.25Å; E106-R110 WeakPolarHBondContact O-CG 3.45Å; E106-R110 PolarHBondContact O-N 2.68Å; E106-R110 PolarHBondContact O-NE 3.48Å
107	N	94.9	Very high	91.4	Very high	54 Å²	54	87.7 Å²	87.7	29%	0.289	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-46.9	173.6	-72.8	-19.5	0	0	0	111.5	T103 Y104 S105 R110 A111	T103-N107 VanDerWaalsContact O-CG 3.28Å; T103-N107 PolarHBondContact O-N 3.35Å; T103-N107 PolarHBondContact O-ND2 3.46Å; Y104-N107 PolarHBondContact O-N 2.93Å; S105-N107 PolarHBondContact O-N 3.35Å; N107-R110 PolarHBondContact O-N 2.81Å; N107-R110 PolarHBondContact OD1-NH2 3.35Å; N107-A111 PolarHBondContact O-N 2.8Å
108	Y	96.8	Very high	89.9	Confident	71 Å²	71	86 Å²	86	28%	0.278	41%	0.407	S	S	.	.	H	α-helix	trans	-62.9	-45.2	176.9	174.5	-110.1	0	0	0	111.8	L80 A83 K84 L87 Y104 S105 R110 A111 S112	L80-Y108 HydrophobicContact CD1-CD2 3.95Å; L80-Y108 HydrophobicContact CD1-CE2 3.46Å; L80-Y108 VanDerWaalsContact CD1-CE2 3.46Å; L80-Y108 HydrophobicContact CG-CE2 4.3Å; A83-Y108 HydrophobicContact CB-CD2 4.33Å; K84-Y108 HydrophobicContact CB-CD2 3.73Å; K84-Y108 HydrophobicContact CB-CE2 3.56Å; K84-Y108 HydrophobicContact CD-CE2 4.21Å; K84-Y108 HydrophobicContact CG-CD2 4.4Å; K84-Y108 HydrophobicContact CG-CE2 3.95Å; L87-Y108 HydrophobicContact CD2-CD1 4.34Å; L87-Y108 HydrophobicContact CD2-CG 4.35Å; Y104-Y108 PolarHBondContact O-N 3.07Å; S105-Y108 PolarHBondContact O-N 3.48Å; Y108-R110 PolarHBondContact O-N 3.37Å; Y108-A111 PolarHBondContact O-N 3.05Å; Y108-A111 VanDerWaalsContact O-N 3.15Å; Y108-S112 PolarHBondContact O-N 3.27Å
109	K	96.5	Very high	88.1	Confident	121 Å²	121	84.3 Å²	84.3	53%	0.526	41%	0.414	S	S	.	.	H	α-helix	trans	-56.1	-50.4	175.6	-177.8	176.6	173.8	-179.2	0	111.2	S105 A111 S112 E113	S105-K109 WeakPolarHBondContact O-CB 3.27Å; S105-K109 PolarHBondContact O-N 3.34Å; K109-A111 VanDerWaalsContact C-N 3.3Å; K109-A111 PolarHBondContact O-N 3.12Å; K109-S112 WeakPolarHBondContact CA-OG 3.39Å; K109-S112 PolarHBondContact O-N 3.03Å; K109-S112 VanDerWaalsContact O-N 3.08Å; K109-S112 PolarHBondContact O-OG 3.38Å; K109-E113 WeakPolarHBondContact CE-OE1 3.33Å; K109-E113 WeakPolarHBondContact CG-OE1 2.86Å; K109-E113 IonicContact NZ-OE1 2.76Å; K109-E113 WeakPolarHBondContact O-CG 3.41Å; K109-E113 PolarHBondContact O-N 2.92Å
110	R	95.2	Very high	86.2	Confident	146 Å²	146	80.2 Å²	80.2	55%	0.551	40%	0.399	S	S	*	.	H	α-helix	trans	-56.2	-43.1	176.4	-81.1	-177.7	-83.3	162.6	-11.4	112.2	E106 N107 Y108 E113 I114	E106-R110 WeakPolarHBondContact O-CB 3.25Å; E106-R110 WeakPolarHBondContact O-CG 3.45Å; E106-R110 PolarHBondContact O-N 2.68Å; E106-R110 PolarHBondContact O-NE 3.48Å; N107-R110 PolarHBondContact O-N 2.81Å; N107-R110 PolarHBondContact OD1-NH2 3.35Å; Y108-R110 PolarHBondContact O-N 3.37Å; R110-E113 PolarHBondContact O-N 3.14Å; R110-I114 WeakPolarHBondContact O-CG1 3.46Å
111	A	93.1	Very high	84.4	Confident	11 Å²	11	85 Å²	85	9%	0.091	43%	0.425	C	S	.	.	H	α-helix	trans	-66.4	-36.7	177.5	0	0	0	0	0	112.7	L80 A83 N107 Y108 K109 E113 I114	L80-A111 HydrophobicContact CD1-CB 4.2Å; A83-A111 HydrophobicContact CB-CB 4.31Å; N107-A111 PolarHBondContact O-N 2.8Å; Y108-A111 PolarHBondContact O-N 3.05Å; Y108-A111 VanDerWaalsContact O-N 3.15Å; K109-A111 VanDerWaalsContact C-N 3.3Å; K109-A111 PolarHBondContact O-N 3.12Å; A111-E113 VanDerWaalsContact C-N 3.31Å; A111-E113 PolarHBondContact O-N 2.71Å; A111-I114 PolarHBondContact O-N 2.68Å
112	S	92.6	Very high	82.7	Confident	57 Å²	57	88.6 Å²	88.6	40%	0.399	44%	0.444	S	S	.	.	H	α-helix	trans	-70.7	-25.7	178.9	72.2	0	0	0	0	113.9	Y108 K109	Y108-S112 PolarHBondContact O-N 3.27Å; K109-S112 WeakPolarHBondContact CA-OG 3.39Å; K109-S112 PolarHBondContact O-N 3.03Å; K109-S112 VanDerWaalsContact O-N 3.08Å; K109-S112 PolarHBondContact O-OG 3.38Å
113	E	91.6	Very high	81.1	Confident	122 Å²	122	90.1 Å²	90.1	57%	0.57	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-9	179.3	-70.1	171.5	169.2	0	0	112.8	K109 R110 A111 K115	K109-E113 WeakPolarHBondContact CE-OE1 3.33Å; K109-E113 WeakPolarHBondContact CG-OE1 2.86Å; K109-E113 IonicContact NZ-OE1 2.76Å; K109-E113 WeakPolarHBondContact O-CG 3.41Å; K109-E113 PolarHBondContact O-N 2.92Å; R110-E113 PolarHBondContact O-N 3.14Å; A111-E113 VanDerWaalsContact C-N 3.31Å; A111-E113 PolarHBondContact O-N 2.71Å; E113-K115 PolarHBondContact O-N 3.06Å; E113-K115 VanDerWaalsContact O-N 3.11Å
114	I	87.2	Confident	79.7	Confident	82 Å²	82	91.8 Å²	91.8	42%	0.421	45%	0.447	S	S	.	.	S	Bend	trans	-66.1	114.3	174.1	-59.3	175.5	0	0	0	108.3	R76 R110 A111	R76-I114 HydrophobicContact CG-CB 4.21Å; R76-I114 HydrophobicContact CG-CG2 3.87Å; R76-I114 PolarHBondContact NH1-O 3.46Å; R110-I114 WeakPolarHBondContact O-CG1 3.46Å; A111-I114 PolarHBondContact O-N 2.68Å
115	K	77.1	Confident	78.6	Confident	190 Å²	190	92.2 Å²	92.2	83%	0.826	45%	0.45	S	S	*	.			trans	-59	142.4	177	-69.4	-172.7	176.9	-174.7	0	111	E113	E113-K115 PolarHBondContact O-N 3.06Å; E113-K115 VanDerWaalsContact O-N 3.11Å
116	R	74.9	Confident	77.7	Confident	110 Å²	110	92 Å²	92	42%	0.415	45%	0.448	S	S	.	.			trans	-57.7	145.2	168.8	-68.7	-179.2	174.7	177.1	-6.8	109.5	S118 D122 E129	R116-S118 PolarHBondContact O-N 3.25Å; R116-D122 IonicContact CZ-OD1 3.89Å; R116-D122 IonicContact NH1-OD1 2.68Å; R116-D122 PolarHBondContact NH1-OD1 3.43Å; R116-E129 IonicContact NH2-OE2 2.71Å; R116-E129 PolarHBondContact NH2-OE2 2.94Å
117	S	65.5	Low	77	Confident	55 Å²	55	91.3 Å²	91.3	39%	0.385	44%	0.444	S	S	.	.	S	Bend	trans	-68.5	-17.4	-176.6	53.5	0	0	0	0	114	Q69	Q69-S117 PolarHBondContact O-OG 3.47Å
118	S	61.8	Low	76.5	Confident	36 Å²	36	88.8 Å²	88.8	25%	0.252	43%	0.43	S	S	.	.			trans	-171.1	160.1	178.8	46.2	0	0	0	0	111.9	Q69 R116 V120	Q69-S118 PolarHBondContact OE1-OG 3.43Å; R116-S118 PolarHBondContact O-N 3.25Å; S118-V120 PolarHBondContact O-N 3.48Å; S118-V120 WeakPolarHBondContact OG-CG2 3.32Å
119	D	56.3	Low	76.1	Confident	180 Å²	180	87.3 Å²	87.3	96%	0.963	43%	0.426	S	S	*	.			trans	-74.1	34.3	167.8	-67.8	-33.6	0	0	0	111.7	D121	D119-D121 PolarHBondContact O-N 3.43Å
120	V	53.8	Low	75.9	Confident	59 Å²	59	88.5 Å²	88.5	36%	0.358	43%	0.431	S	S	.	.			trans	-71.5	122.6	-178.3	174.1	0	0	0	0	108.7	S118 D122 F125	S118-V120 PolarHBondContact O-N 3.48Å; S118-V120 WeakPolarHBondContact OG-CG2 3.32Å; V120-D122 PolarHBondContact O-N 3.47Å; V120-F125 HydrophobicContact CB-CD2 4.47Å; V120-F125 HydrophobicContact CB-CE2 3.91Å; V120-F125 HydrophobicContact CG1-CD2 4.29Å; V120-F125 HydrophobicContact CG1-CE2 3.66Å; V120-F125 WeakPolarHBondContact O-CD2 3.43Å
121	D	55.8	Low	75.8	Confident	123 Å²	123	81.8 Å²	81.8	66%	0.658	41%	0.407	S	S	*	.			trans	-5.8	101.4	-178.6	-89.2	-32.9	0	0	0	115.6	D119 Y123 Y124	D119-D121 PolarHBondContact O-N 3.43Å; D121-Y123 PolarHBondContact O-N 2.99Å; D121-Y124 PolarHBondContact O-N 3.33Å
122	D	60.1	Low	75.8	Confident	108 Å²	108	81.3 Å²	81.3	58%	0.578	40%	0.403	S	S	*	.	H	α-helix	trans	-50.8	-27.9	-176.8	-106.7	-25.9	0	0	0	113.4	R116 V120 S126	R116-D122 IonicContact CZ-OD1 3.89Å; R116-D122 IonicContact NH1-OD1 2.68Å; R116-D122 PolarHBondContact NH1-OD1 3.43Å; V120-D122 PolarHBondContact O-N 3.47Å; D122-S126 WeakPolarHBondContact O-CB 3.2Å; D122-S126 PolarHBondContact O-N 2.88Å
123	Y	64.1	Low	76	Confident	148 Å²	148	81.2 Å²	81.2	58%	0.58	40%	0.396	S	S	*	.	H	α-helix	trans	-63.2	-53.2	-173.8	-173	-106	0	0	0	112.4	D121 S126 F127	D121-Y123 PolarHBondContact O-N 2.99Å; Y123-S126 PolarHBondContact O-N 3.3Å; Y123-S126 PolarHBondContact O-OG 3.2Å; Y123-F127 HydrophobicContact CD1-CE2 4.02Å; Y123-F127 HydrophobicContact CD2-CE2 4.24Å; Y123-F127 HydrophobicContact CE1-CD2 4.41Å; Y123-F127 AromaticContact CE1-CE2 3.54Å; Y123-F127 HydrophobicContact CE1-CE2 3.54Å; Y123-F127 HydrophobicContact CE1-CZ 4.29Å; Y123-F127 AromaticContact CE2-CE2 3.77Å; Y123-F127 HydrophobicContact CE2-CE2 3.77Å; Y123-F127 HydrophobicContact CE2-CZ 4.24Å; Y123-F127 HydrophobicContact CG-CE2 4.35Å; Y123-F127 AromaticContact CZ-CE2 3.41Å; Y123-F127 VanDerWaalsContact CZ-CE2 3.41Å; Y123-F127 AromaticContact CZ-CZ 3.82Å; Y123-F127 WeakPolarHBondContact O-CD2 3.44Å
124	Y	65.8	Low	76.3	Confident	87 Å²	87	77.4 Å²	77.4	34%	0.341	38%	0.381	S	S	.	.	H	α-helix	trans	-72	-36.5	-176.2	-67.7	-70.8	0	0	0	112.3	I55 L58 D121 S126 F127	I55-Y124 WeakPolarHBondContact CD1-O 3.47Å; I55-Y124 HydrophobicContact CG1-CD1 4.27Å; L58-Y124 HydrophobicContact CD1-CD1 4.46Å; L58-Y124 HydrophobicContact CD1-CE1 3.86Å; D121-Y124 PolarHBondContact O-N 3.33Å; Y124-S126 VanDerWaalsContact C-N 3.33Å; Y124-S126 PolarHBondContact O-N 2.87Å; Y124-F127 PolarHBondContact O-N 3.29Å
125	F	73.6	Confident	76.7	Confident	24 Å²	24	74.1 Å²	74.1	11%	0.105	36%	0.364	C	S	.	.	H	α-helix	trans	-66	-35.6	176.8	-85.4	-72.7	0	0	0	112.6	F70 E73 V120 F127 V128 E129	F70-F125 HydrophobicContact CB-CE1 4.49Å; F70-F125 HydrophobicContact CB-CZ 4.17Å; F70-F125 HydrophobicContact CD2-CD1 4.38Å; F70-F125 AromaticContact CD2-CE1 3.47Å; F70-F125 HydrophobicContact CD2-CE1 3.47Å; F70-F125 VanDerWaalsContact CD2-CE1 3.47Å; F70-F125 AromaticContact CD2-CZ 3.62Å; F70-F125 HydrophobicContact CD2-CZ 3.62Å; F70-F125 HydrophobicContact CE2-CE1 4.1Å; F70-F125 HydrophobicContact CG-CE1 4.28Å; F70-F125 HydrophobicContact CG-CZ 4.33Å; E73-F125 HydrophobicContact CB-CD1 4.33Å; E73-F125 HydrophobicContact CB-CE1 3.65Å; E73-F125 HydrophobicContact CB-CZ 4.29Å; E73-F125 HydrophobicContact CG-CD1 3.61Å; E73-F125 HydrophobicContact CG-CE1 3.44Å; E73-F125 VanDerWaalsContact CG-CE1 3.44Å; E73-F125 HydrophobicContact CG-CZ 4.31Å; V120-F125 HydrophobicContact CB-CD2 4.47Å; V120-F125 HydrophobicContact CB-CE2 3.91Å; V120-F125 HydrophobicContact CG1-CD2 4.29Å; V120-F125 HydrophobicContact CG1-CE2 3.66Å; V120-F125 WeakPolarHBondContact O-CD2 3.43Å; F125-F127 PolarHBondContact O-N 2.87Å; F125-V128 PolarHBondContact O-N 3.35Å; F125-E129 WeakPolarHBondContact O-CB 3.44Å; F125-E129 PolarHBondContact O-N 2.78Å
126	S	79	Confident	77.7	Confident	58 Å²	58	65.2 Å²	65.2	41%	0.406	33%	0.325	S	S	.	.	H	α-helix	trans	-57.9	-35.1	176	77.5	0	0	0	0	112.8	D122 Y123 Y124 K130	D122-S126 WeakPolarHBondContact O-CB 3.2Å; D122-S126 PolarHBondContact O-N 2.88Å; Y123-S126 PolarHBondContact O-N 3.3Å; Y123-S126 PolarHBondContact O-OG 3.2Å; Y124-S126 VanDerWaalsContact C-N 3.33Å; Y124-S126 PolarHBondContact O-N 2.87Å; S126-K130 VanDerWaalsContact O-CB 3.3Å; S126-K130 WeakPolarHBondContact O-CB 3.4Å; S126-K130 PolarHBondContact O-N 3.41Å
127	F	81.7	Confident	78.8	Confident	76 Å²	76	62.7 Å²	62.7	33%	0.333	32%	0.32	S	S	.	.	H	α-helix	trans	-67.4	-40.1	176.1	-75.9	-81.6	0	0	0	112.3	Y123 Y124 F125 A131	Y123-F127 HydrophobicContact CD1-CE2 4.02Å; Y123-F127 HydrophobicContact CD2-CE2 4.24Å; Y123-F127 HydrophobicContact CE1-CD2 4.41Å; Y123-F127 AromaticContact CE1-CE2 3.54Å; Y123-F127 HydrophobicContact CE1-CE2 3.54Å; Y123-F127 HydrophobicContact CE1-CZ 4.29Å; Y123-F127 AromaticContact CE2-CE2 3.77Å; Y123-F127 HydrophobicContact CE2-CE2 3.77Å; Y123-F127 HydrophobicContact CE2-CZ 4.24Å; Y123-F127 HydrophobicContact CG-CE2 4.35Å; Y123-F127 AromaticContact CZ-CE2 3.41Å; Y123-F127 VanDerWaalsContact CZ-CE2 3.41Å; Y123-F127 AromaticContact CZ-CZ 3.82Å; Y123-F127 WeakPolarHBondContact O-CD2 3.44Å; Y124-F127 PolarHBondContact O-N 3.29Å; F125-F127 PolarHBondContact O-N 2.87Å; F127-A131 WeakPolarHBondContact O-CB 3.46Å; F127-A131 PolarHBondContact O-N 2.87Å
128	V	84.4	Confident	80.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-76	-41.8	179.9	-165.5	0	0	0	0	111.7	L48 I55 F70 I74 F125 K130 A131 V132	L48-V128 HydrophobicContact CD1-CG1 3.78Å; I55-V128 HydrophobicContact CD1-CB 4.48Å; I55-V128 HydrophobicContact CD1-CG2 3.01Å; I55-V128 HydrophobicContact CG1-CG2 4.47Å; F70-V128 HydrophobicContact CE2-CG2 3.98Å; F70-V128 HydrophobicContact CZ-CG2 4.11Å; I74-V128 HydrophobicContact CD1-CB 4.02Å; I74-V128 HydrophobicContact CD1-CG1 3.18Å; F125-V128 PolarHBondContact O-N 3.35Å; V128-K130 PolarHBondContact O-N 2.97Å; V128-A131 CarbonylContact O-C 3.56Å; V128-A131 WeakPolarHBondContact O-CA 3.4Å; V128-A131 WeakPolarHBondContact O-CB 2.84Å; V128-A131 PolarHBondContact O-N 3.44Å; V128-V132 HydrophobicContact CG1-CG2 4.11Å; V128-V132 WeakPolarHBondContact O-CG2 2.8Å; V128-V132 PolarHBondContact O-N 3.02Å
129	E	88.9	Confident	82	Confident	41 Å²	41	58.8 Å²	58.8	19%	0.192	29%	0.293	C	S	.	.	H	α-helix	trans	-52.1	-48.7	172.9	174.4	157.8	-145.2	0	0	110.2	L77 Y81 R116 F125 A131 V132 E133	L77-E129 HydrophobicContact CD1-CB 3.99Å; L77-E129 HydrophobicContact CD2-CB 3.97Å; L77-E129 HydrophobicContact CD2-CG 3.71Å; Y81-E129 HydrophobicContact CE2-CG 4.17Å; R116-E129 IonicContact NH2-OE2 2.71Å; R116-E129 PolarHBondContact NH2-OE2 2.94Å; F125-E129 WeakPolarHBondContact O-CB 3.44Å; F125-E129 PolarHBondContact O-N 2.78Å; E129-A131 VanDerWaalsContact C-N 3.33Å; E129-A131 PolarHBondContact O-N 2.67Å; E129-V132 PolarHBondContact O-N 2.79Å; E129-E133 WeakPolarHBondContact O-CB 3.21Å; E129-E133 PolarHBondContact O-N 3.05Å
130	K	91.4	Very high	84	Confident	146 Å²	146	51.2 Å²	51.2	64%	0.635	25%	0.252	S	S	*	.	H	α-helix	trans	-62.6	-36.9	175.5	-168.9	164.5	-173.9	171.2	0	113.3	S126 V128 T134	S126-K130 VanDerWaalsContact O-CB 3.3Å; S126-K130 WeakPolarHBondContact O-CB 3.4Å; S126-K130 PolarHBondContact O-N 3.41Å; V128-K130 PolarHBondContact O-N 2.97Å; K130-T134 VanDerWaalsContact O-CB 3.3Å; K130-T134 WeakPolarHBondContact O-CB 3.09Å; K130-T134 PolarHBondContact O-N 3.26Å; K130-T134 PolarHBondContact O-OG1 3.02Å
131	A	92.5	Very high	86.1	Confident	5 Å²	5	52 Å²	52	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-41.7	176.8	0	0	0	0	0	112.3	M47 L48 R51 F127 V128 E129 T134 K135	M47-A131 HydrophobicContact CE-CB 4.11Å; L48-A131 HydrophobicContact CB-CB 4.47Å; L48-A131 HydrophobicContact CD1-CB 3.91Å; R51-A131 HydrophobicContact CG-CB 4.33Å; F127-A131 WeakPolarHBondContact O-CB 3.46Å; F127-A131 PolarHBondContact O-N 2.87Å; V128-A131 CarbonylContact O-C 3.56Å; V128-A131 WeakPolarHBondContact O-CA 3.4Å; V128-A131 WeakPolarHBondContact O-CB 2.84Å; V128-A131 PolarHBondContact O-N 3.44Å; E129-A131 VanDerWaalsContact C-N 3.33Å; E129-A131 PolarHBondContact O-N 2.67Å; A131-T134 PolarHBondContact O-N 2.93Å; A131-K135 PolarHBondContact O-N 2.82Å
132	V	94.5	Very high	88	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-46.7	175	176.2	0	0	0	0	110.3	L48 L77 E78 Y81 V128 E129 T134 K135 W136	L48-V132 HydrophobicContact CD1-CG2 3.62Å; L48-V132 HydrophobicContact CD2-CG2 4.1Å; L77-V132 HydrophobicContact CB-CB 4.37Å; L77-V132 HydrophobicContact CB-CG1 4.08Å; L77-V132 HydrophobicContact CB-CG2 4.34Å; E78-V132 HydrophobicContact CG-CG1 4.07Å; Y81-V132 HydrophobicContact CD2-CB 4.44Å; Y81-V132 HydrophobicContact CD2-CG1 3.85Å; Y81-V132 HydrophobicContact CG-CG1 4.45Å; V128-V132 HydrophobicContact CG1-CG2 4.11Å; V128-V132 WeakPolarHBondContact O-CG2 2.8Å; V128-V132 PolarHBondContact O-N 3.02Å; E129-V132 PolarHBondContact O-N 2.79Å; V132-T134 VanDerWaalsContact C-N 3.32Å; V132-T134 PolarHBondContact O-N 3.08Å; V132-K135 WeakPolarHBondContact O-CB 3.4Å; V132-K135 PolarHBondContact O-N 3.04Å; V132-W136 PolarHBondContact O-N 3.08Å
133	E	96.3	Very high	89.7	Confident	55 Å²	55	41.2 Å²	41.2	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-56.5	-48.2	174.7	179.5	163.3	-148.4	0	0	111.3	Y81 K84 E129 K135 W136 N137	Y81-E133 HydrophobicContact CD1-CB 3.92Å; Y81-E133 HydrophobicContact CD1-CG 3.89Å; Y81-E133 HydrophobicContact CD2-CB 4.38Å; Y81-E133 HydrophobicContact CE1-CB 3.47Å; Y81-E133 VanDerWaalsContact CE1-CB 3.47Å; Y81-E133 VanDerWaalsContact CE1-CD 3.44Å; Y81-E133 HydrophobicContact CE1-CG 3.38Å; Y81-E133 HydrophobicContact CE2-CB 3.99Å; Y81-E133 HydrophobicContact CG-CB 4.36Å; Y81-E133 PolarHBondContact OH-OE2 3.33Å; K84-E133 IonicContact NZ-OE1 3.53Å; K84-E133 PolarHBondContact NZ-OE1 3.39Å; E129-E133 WeakPolarHBondContact O-CB 3.21Å; E129-E133 PolarHBondContact O-N 3.05Å; E133-K135 VanDerWaalsContact C-N 3.31Å; E133-K135 PolarHBondContact O-N 3.18Å; E133-W136 PolarHBondContact O-N 3.09Å; E133-N137 WeakPolarHBondContact CG-ND2 3.45Å; E133-N137 WeakPolarHBondContact O-CB 3.45Å; E133-N137 VanDerWaalsContact O-CG 3.28Å; E133-N137 PolarHBondContact O-N 3.42Å; E133-N137 PolarHBondContact O-ND2 2.94Å
134	T	96.9	Very high	91.2	Very high	42 Å²	42	36.5 Å²	36.5	26%	0.258	18%	0.182	S	C	.	.	H	α-helix	trans	-64	-37.1	-178.1	-56.7	0	0	0	0	111.7	K44 M47 K130 A131 V132 A138	K44-T134 HydrophobicContact CD-CG2 3.75Å; K44-T134 HydrophobicContact CG-CG2 4.03Å; M47-T134 HydrophobicContact CE-CG2 4.24Å; K130-T134 VanDerWaalsContact O-CB 3.3Å; K130-T134 WeakPolarHBondContact O-CB 3.09Å; K130-T134 PolarHBondContact O-N 3.26Å; K130-T134 PolarHBondContact O-OG1 3.02Å; A131-T134 PolarHBondContact O-N 2.93Å; V132-T134 VanDerWaalsContact C-N 3.32Å; V132-T134 PolarHBondContact O-N 3.08Å; T134-A138 WeakPolarHBondContact O-CB 3.46Å; T134-A138 PolarHBondContact O-N 2.91Å
135	K	96.6	Very high	92.4	Very high	13 Å²	13	32.8 Å²	32.8	6%	0.057	17%	0.168	C	C	.	.	H	α-helix	trans	-59.1	-52.8	172.4	172.5	-154.2	165.3	-164.7	0	110.8	Y41 K44 I45 L48 E78 A131 V132 E133 N137 A138 R139 E356	Y41-K135 HydrophobicContact CD2-CG 4.49Å; Y41-K135 HydrophobicContact CE2-CG 4.05Å; K44-K135 HydrophobicContact CB-CB 4.29Å; I45-K135 HydrophobicContact CG1-CD 4.42Å; I45-K135 HydrophobicContact CG1-CG 4.11Å; L48-K135 HydrophobicContact CD2-CD 3.82Å; E78-K135 IonicContact OE1-NZ 3.59Å; E78-K135 PolarHBondContact OE1-NZ 2.81Å; E78-K135 IonicContact OE2-NZ 3.67Å; E78-K135 PolarHBondContact OE2-NZ 3.14Å; A131-K135 PolarHBondContact O-N 2.82Å; V132-K135 WeakPolarHBondContact O-CB 3.4Å; V132-K135 PolarHBondContact O-N 3.04Å; E133-K135 VanDerWaalsContact C-N 3.31Å; E133-K135 PolarHBondContact O-N 3.18Å; K135-N137 PolarHBondContact O-N 3.09Å; K135-A138 WeakPolarHBondContact O-CB 3.48Å; K135-A138 PolarHBondContact O-N 3.35Å; K135-R139 PolarHBondContact O-N 3.43Å; K135-E356 IonicContact NZ-OE2 3.98Å
136	W	97.9	Very high	93.3	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.011	16%	0.164	C	C	.	.	H	α-helix	trans	-68.3	-34.3	-177.5	-81	105.8	0	0	0	113.3	E78 W85 V132 E133 A138 R139 L140 L353 E356 L357	E78-W136 PolarHBondContact O-NE1 2.89Å; E78-W136 PolarHBondContact OE2-NE1 3.37Å; W85-W136 HydrophobicContact CB-CD2 4.38Å; W85-W136 HydrophobicContact CB-CE3 3.55Å; W85-W136 HydrophobicContact CB-CZ3 4.11Å; W85-W136 AromaticContact CD2-CE3 3.95Å; W85-W136 HydrophobicContact CD2-CE3 3.95Å; W85-W136 AromaticContact CD2-CZ3 3.64Å; W85-W136 HydrophobicContact CD2-CZ3 3.64Å; W85-W136 HydrophobicContact CE3-CE3 4.17Å; W85-W136 HydrophobicContact CE3-CH2 4.31Å; W85-W136 AromaticContact CE3-CZ3 3.5Å; W85-W136 HydrophobicContact CE3-CZ3 3.5Å; W85-W136 VanDerWaalsContact CE3-CZ3 3.5Å; W85-W136 AromaticContact CG-CE3 3.67Å; W85-W136 HydrophobicContact CG-CE3 3.67Å; W85-W136 AromaticContact CG-CZ3 3.9Å; W85-W136 HydrophobicContact CG-CZ3 3.9Å; W85-W136 HydrophobicContact CZ3-CZ3 4.16Å; V132-W136 PolarHBondContact O-N 3.08Å; E133-W136 PolarHBondContact O-N 3.09Å; W136-A138 VanDerWaalsContact C-N 3.31Å; W136-A138 PolarHBondContact O-N 2.96Å; W136-R139 HydrophobicContact CE3-CB 4.17Å; W136-R139 HydrophobicContact CE3-CG 4.1Å; W136-R139 HydrophobicContact CZ3-CG 4.12Å; W136-R139 WeakPolarHBondContact O-CB 3.33Å; W136-R139 PolarHBondContact O-N 3.43Å; W136-L140 PolarHBondContact O-N 2.85Å; W136-L353 HydrophobicContact CH2-CD1 3.58Å; W136-L353 HydrophobicContact CZ2-CD1 4.28Å; W136-L353 HydrophobicContact CZ3-CD1 4.16Å; W136-E356 HydrophobicContact CH2-CB 4.27Å; W136-L357 HydrophobicContact CZ2-CD2 4.47Å
137	N	98.2	Very high	93.8	Very high	57 Å²	57	30.2 Å²	30.2	31%	0.305	15%	0.151	S	C	.	.	H	α-helix	trans	-64.4	-37.6	171.6	-71.7	-19.6	0	0	0	111.6	E133 K135 L140 N141	E133-N137 WeakPolarHBondContact CG-ND2 3.45Å; E133-N137 WeakPolarHBondContact O-CB 3.45Å; E133-N137 VanDerWaalsContact O-CG 3.28Å; E133-N137 PolarHBondContact O-N 3.42Å; E133-N137 PolarHBondContact O-ND2 2.94Å; K135-N137 PolarHBondContact O-N 3.09Å; N137-L140 PolarHBondContact O-N 2.9Å; N137-N141 VanDerWaalsContact O-CG 3.28Å; N137-N141 PolarHBondContact O-N 3.38Å; N137-N141 PolarHBondContact O-ND2 2.91Å
138	A	97.5	Very high	94.2	Very high	9 Å²	9	32.9 Å²	32.9	7%	0.074	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-39	173.9	0	0	0	0	0	111.9	Y41 K44 T134 K135 W136 N141 F142	Y41-A138 HydrophobicContact CD2-CB 4.48Å; K44-A138 HydrophobicContact CB-CB 4.36Å; K44-A138 HydrophobicContact CG-CB 3.81Å; T134-A138 WeakPolarHBondContact O-CB 3.46Å; T134-A138 PolarHBondContact O-N 2.91Å; K135-A138 WeakPolarHBondContact O-CB 3.48Å; K135-A138 PolarHBondContact O-N 3.35Å; W136-A138 VanDerWaalsContact C-N 3.31Å; W136-A138 PolarHBondContact O-N 2.96Å; A138-N141 PolarHBondContact O-N 2.93Å; A138-F142 PolarHBondContact O-N 2.89Å
139	R	97.1	Very high	94.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.8	-49.5	171.2	-179.1	71.2	-159.3	-159.4	27	111.2	Y41 W85 K135 W136 N141 F142 D143 E330 E356	Y41-R139 HydrophobicContact CD2-CB 3.79Å; Y41-R139 HydrophobicContact CE2-CB 3.69Å; Y41-R139 HydrophobicContact CE2-CG 4.27Å; W85-R139 HydrophobicContact CD2-CG 4.43Å; W85-R139 HydrophobicContact CG-CG 4.45Å; W85-R139 HydrophobicContact CZ2-CG 4.44Å; K135-R139 PolarHBondContact O-N 3.43Å; W136-R139 HydrophobicContact CE3-CB 4.17Å; W136-R139 HydrophobicContact CE3-CG 4.1Å; W136-R139 HydrophobicContact CZ3-CG 4.12Å; W136-R139 WeakPolarHBondContact O-CB 3.33Å; W136-R139 PolarHBondContact O-N 3.43Å; R139-N141 VanDerWaalsContact C-N 3.34Å; R139-N141 PolarHBondContact O-N 3.34Å; R139-F142 WeakPolarHBondContact O-CB 3.16Å; R139-F142 PolarHBondContact O-N 3.27Å; R139-F142 VanDerWaalsContact O-N 3.12Å; R139-D143 WeakPolarHBondContact CG-OD2 3.48Å; R139-D143 IonicContact CZ-OD1 2.75Å; R139-D143 IonicContact CZ-OD2 2.71Å; R139-D143 IonicContact NE-OD1 3.3Å; R139-D143 PolarHBondContact NE-OD1 3.44Å; R139-D143 IonicContact NE-OD2 3.3Å; R139-D143 PolarHBondContact NE-OD2 3.19Å; R139-D143 IonicContact NH2-OD1 3.4Å; R139-D143 PolarHBondContact NH2-OD1 3.4Å; R139-D143 IonicContact NH2-OD2 2.7Å; R139-D143 PolarHBondContact O-N 2.89Å; R139-E330 IonicContact CZ-OE1 3.55Å; R139-E330 IonicContact CZ-OE2 3.99Å; R139-E330 VanDerWaalsContact NH1-CD 3.33Å; R139-E330 IonicContact NH1-OE1 2.81Å; R139-E330 PolarHBondContact NH1-OE1 3.18Å; R139-E330 IonicContact NH1-OE2 3.74Å; R139-E330 IonicContact NH2-OE1 3.39Å; R139-E330 IonicContact NH2-OE2 2.89Å; R139-E330 PolarHBondContact NH2-OE2 2.96Å; R139-E356 IonicContact CZ-OE1 2.78Å; R139-E356 IonicContact NE-OE1 2.76Å; R139-E356 IonicContact NH1-OE1 3.85Å; R139-E356 PolarHBondContact NH1-OE1 2.78Å
140	L	97.9	Very high	94.3	Very high	21 Å²	21	31.8 Å²	31.8	11%	0.11	16%	0.157	C	C	.	.	H	α-helix	trans	-54.3	-49.8	177	-178.3	58.8	0	0	0	111.6	W85 D88 L89 W136 N137 F142 D143 L144	W85-L140 VanDerWaalsContact CD1-CA 3.45Å; D88-L140 HydrophobicContact CB-CD1 4.29Å; D88-L140 HydrophobicContact CB-CD2 3.89Å; L89-L140 HydrophobicContact CB-CD1 3.96Å; W136-L140 PolarHBondContact O-N 2.85Å; N137-L140 PolarHBondContact O-N 2.9Å; L140-F142 VanDerWaalsContact C-N 3.27Å; L140-F142 PolarHBondContact O-N 2.67Å; L140-D143 PolarHBondContact O-N 2.96Å; L140-L144 HydrophobicContact CD1-CD1 3.89Å; L140-L144 HydrophobicContact CD1-CG 3.95Å; L140-L144 HydrophobicContact CD2-CD1 4.48Å; L140-L144 HydrophobicContact CG-CD1 3.78Å; L140-L144 HydrophobicContact CG-CG 4.27Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 VanDerWaalsContact O-CG 3.25Å; L140-L144 WeakPolarHBondContact O-CG 3.3Å; L140-L144 PolarHBondContact O-N 3.41Å
141	N	97.6	Very high	94	Very high	75 Å²	75	27.7 Å²	27.7	40%	0.401	15%	0.147	S	C	.	.	H	α-helix	trans	-62.5	-35.9	-180	-71.1	-30	0	0	0	112.6	K37 N137 A138 R139 A145	K37-N141 HydrophobicContact CD-CB 4.37Å; N137-N141 VanDerWaalsContact O-CG 3.28Å; N137-N141 PolarHBondContact O-N 3.38Å; N137-N141 PolarHBondContact O-ND2 2.91Å; A138-N141 PolarHBondContact O-N 2.93Å; R139-N141 VanDerWaalsContact C-N 3.34Å; R139-N141 PolarHBondContact O-N 3.34Å; N141-A145 WeakPolarHBondContact O-CB 3.38Å; N141-A145 PolarHBondContact O-N 2.9Å; N141-A145 VanDerWaalsContact O-N 3.08Å
142	F	95	Very high	93.5	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.009	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-48.3	174.6	167.7	-112.7	0	0	0	112.2	I34 K37 L38 A138 R139 L140 A145 T146 E330 I334	I34-F142 HydrophobicContact CG2-CD2 4.26Å; I34-F142 HydrophobicContact CG2-CE2 3.65Å; K37-F142 HydrophobicContact CB-CB 3.97Å; K37-F142 HydrophobicContact CB-CD2 4.29Å; L38-F142 HydrophobicContact CB-CD2 3.79Å; L38-F142 HydrophobicContact CB-CE2 3.68Å; L38-F142 HydrophobicContact CB-CZ 4.41Å; L38-F142 HydrophobicContact CD1-CD2 4.5Å; L38-F142 HydrophobicContact CD1-CE1 4.28Å; L38-F142 HydrophobicContact CD1-CE2 4.15Å; L38-F142 HydrophobicContact CD1-CZ 4.04Å; L38-F142 HydrophobicContact CD2-CE2 4.43Å; L38-F142 HydrophobicContact CG-CE2 4.3Å; A138-F142 PolarHBondContact O-N 2.89Å; R139-F142 WeakPolarHBondContact O-CB 3.16Å; R139-F142 PolarHBondContact O-N 3.27Å; R139-F142 VanDerWaalsContact O-N 3.12Å; L140-F142 VanDerWaalsContact C-N 3.27Å; L140-F142 PolarHBondContact O-N 2.67Å; F142-A145 PolarHBondContact O-N 2.89Å; F142-T146 PolarHBondContact O-N 3.27Å; F142-T146 PolarHBondContact O-OG1 3.47Å; F142-E330 HydrophobicContact CE1-CB 4.06Å; F142-E330 HydrophobicContact CE1-CG 4.24Å; F142-E330 HydrophobicContact CZ-CB 3.94Å; F142-I334 HydrophobicContact CE2-CD1 4.28Å; F142-I334 HydrophobicContact CZ-CD1 4.15Å
143	D	95.9	Very high	92.7	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-69.2	-35.3	-179.5	-63.7	-46.2	0	0	0	111.8	W85 L89 R139 L140 T146 D147 Y349	W85-D143 VanDerWaalsContact CE2-OD2 3.22Å; W85-D143 WeakPolarHBondContact CZ2-OD2 3.4Å; W85-D143 PolarHBondContact NE1-OD2 3.49Å; L89-D143 HydrophobicContact CD1-CB 4.06Å; L89-D143 HydrophobicContact CD2-CB 4.17Å; R139-D143 WeakPolarHBondContact CG-OD2 3.48Å; R139-D143 IonicContact CZ-OD1 2.75Å; R139-D143 IonicContact CZ-OD2 2.71Å; R139-D143 IonicContact NE-OD1 3.3Å; R139-D143 PolarHBondContact NE-OD1 3.44Å; R139-D143 IonicContact NE-OD2 3.3Å; R139-D143 PolarHBondContact NE-OD2 3.19Å; R139-D143 IonicContact NH2-OD1 3.4Å; R139-D143 PolarHBondContact NH2-OD1 3.4Å; R139-D143 IonicContact NH2-OD2 2.7Å; R139-D143 PolarHBondContact O-N 2.89Å; L140-D143 PolarHBondContact O-N 2.96Å; D143-T146 WeakPolarHBondContact O-CB 3.43Å; D143-T146 PolarHBondContact O-N 3.36Å; D143-D147 PolarHBondContact O-N 3.13Å; D143-Y349 HydrophobicContact CB-CE1 4.07Å
144	L	95.8	Very high	91.8	Very high	50 Å²	50	33.6 Å²	33.6	26%	0.262	19%	0.187	S	C	.	.	H	α-helix	trans	-65	-39.5	172.7	-72.1	174.4	0	0	0	112.3	L89 S92 L140 T146 D147 K148	L89-L144 HydrophobicContact CD1-CD2 3.82Å; L89-L144 HydrophobicContact CD1-CG 4.26Å; S92-L144 VanDerWaalsContact CB-CD2 3.46Å; L140-L144 HydrophobicContact CD1-CD1 3.89Å; L140-L144 HydrophobicContact CD1-CG 3.95Å; L140-L144 HydrophobicContact CD2-CD1 4.48Å; L140-L144 HydrophobicContact CG-CD1 3.78Å; L140-L144 HydrophobicContact CG-CG 4.27Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 VanDerWaalsContact O-CG 3.25Å; L140-L144 WeakPolarHBondContact O-CG 3.3Å; L140-L144 PolarHBondContact O-N 3.41Å; L144-T146 VanDerWaalsContact C-N 3.29Å; L144-T146 PolarHBondContact O-N 3.48Å; L144-D147 PolarHBondContact O-N 3.44Å; L144-K148 WeakPolarHBondContact O-CB 3.46Å; L144-K148 PolarHBondContact O-N 3.3Å
145	A	92	Very high	90.6	Very high	8 Å²	8	35.8 Å²	35.8	7%	0.066	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-39.1	173.6	0	0	0	0	0	111.2	I34 K37 N141 F142 Y149	I34-A145 HydrophobicContact CG1-CB 3.95Å; K37-A145 HydrophobicContact CG-CB 4.25Å; N141-A145 WeakPolarHBondContact O-CB 3.38Å; N141-A145 PolarHBondContact O-N 2.9Å; N141-A145 VanDerWaalsContact O-N 3.08Å; F142-A145 PolarHBondContact O-N 2.89Å; A145-Y149 PolarHBondContact O-N 3.45Å; A145-Y149 VanDerWaalsContact O-N 3.16Å
146	T	91.2	Very high	89.2	Confident	1 Å²	1	39 Å²	39	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-46.9	175.1	-60.6	0	0	0	0	111.6	F142 D143 L144 K148 Y149 L150 I334 L337	F142-T146 PolarHBondContact O-N 3.27Å; F142-T146 PolarHBondContact O-OG1 3.47Å; D143-T146 WeakPolarHBondContact O-CB 3.43Å; D143-T146 PolarHBondContact O-N 3.36Å; L144-T146 VanDerWaalsContact C-N 3.29Å; L144-T146 PolarHBondContact O-N 3.48Å; T146-K148 VanDerWaalsContact C-N 3.33Å; T146-K148 PolarHBondContact O-N 3.06Å; T146-Y149 VanDerWaalsContact O-CB 3.31Å; T146-Y149 WeakPolarHBondContact O-CB 3.49Å; T146-Y149 PolarHBondContact O-N 3.32Å; T146-Y149 VanDerWaalsContact O-N 3.16Å; T146-L150 HydrophobicContact CG2-CD1 4Å; T146-L150 HydrophobicContact CG2-CG 4.34Å; T146-L150 VanDerWaalsContact O-CG 3.3Å; T146-L150 WeakPolarHBondContact O-CG 2.84Å; T146-L150 PolarHBondContact O-N 3Å; T146-I334 HydrophobicContact CG2-CD1 4.28Å; T146-I334 HydrophobicContact CG2-CG1 3.82Å; T146-I334 HydrophobicContact CG2-CG2 4.45Å; T146-L337 HydrophobicContact CG2-CD1 4.25Å
147	D	91.3	Very high	86.9	Confident	27 Å²	27	48.4 Å²	48.4	14%	0.144	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-39.3	178.7	-173.1	77.7	0	0	0	112.3	I93 D143 L144 Y149 L150 S151	I93-D147 HydrophobicContact CG2-CB 3.73Å; I93-D147 VanDerWaalsContact CG2-OD2 3.29Å; I93-D147 WeakPolarHBondContact CG2-OD2 3.17Å; D143-D147 PolarHBondContact O-N 3.13Å; L144-D147 PolarHBondContact O-N 3.44Å; D147-Y149 VanDerWaalsContact C-N 3.29Å; D147-Y149 PolarHBondContact O-N 3.01Å; D147-L150 PolarHBondContact O-N 3.02Å; D147-S151 WeakPolarHBondContact O-CB 3.31Å; D147-S151 PolarHBondContact O-N 2.7Å; D147-S151 PolarHBondContact O-OG 3.32Å
148	K	89.8	Confident	84.2	Confident	132 Å²	132	55 Å²	55	57%	0.574	29%	0.292	S	S	*	.	H	α-helix	trans	-56	-45.3	172.9	-175.9	177.8	-179.6	179.6	0	111.4	L144 T146 S151 M152	L144-K148 WeakPolarHBondContact O-CB 3.46Å; L144-K148 PolarHBondContact O-N 3.3Å; T146-K148 VanDerWaalsContact C-N 3.33Å; T146-K148 PolarHBondContact O-N 3.06Å; K148-S151 PolarHBondContact O-N 3.43Å; K148-M152 VanDerWaalsContact O-CG 3.31Å; K148-M152 WeakPolarHBondContact O-CG 3.49Å; K148-M152 PolarHBondContact O-N 3.2Å
149	Y	87.7	Confident	81.4	Confident	19 Å²	19	56.9 Å²	56.9	8%	0.075	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-49.6	174.7	169.2	-114.9	0	0	0	112.7	T27 V30 L31 I34 A145 T146 D147 S151 M152 L153 I334 E338	T27-Y149 HydrophobicContact CG2-CD2 4.44Å; T27-Y149 HydrophobicContact CG2-CE2 3.66Å; V30-Y149 HydrophobicContact CG1-CD2 3.99Å; V30-Y149 HydrophobicContact CG1-CG 4.23Å; L31-Y149 HydrophobicContact CD1-CE2 4.45Å; L31-Y149 HydrophobicContact CD2-CD1 4.48Å; L31-Y149 HydrophobicContact CD2-CD2 4.3Å; L31-Y149 HydrophobicContact CD2-CE1 4.12Å; L31-Y149 HydrophobicContact CD2-CE2 3.94Å; L31-Y149 HydrophobicContact CG-CD2 4.43Å; L31-Y149 HydrophobicContact CG-CE2 4.06Å; I34-Y149 VanDerWaalsContact CD1-CB 3.49Å; I34-Y149 HydrophobicContact CD1-CD1 4.08Å; I34-Y149 HydrophobicContact CD1-CG 3.85Å; A145-Y149 PolarHBondContact O-N 3.45Å; A145-Y149 VanDerWaalsContact O-N 3.16Å; T146-Y149 VanDerWaalsContact O-CB 3.31Å; T146-Y149 WeakPolarHBondContact O-CB 3.49Å; T146-Y149 PolarHBondContact O-N 3.32Å; T146-Y149 VanDerWaalsContact O-N 3.16Å; D147-Y149 VanDerWaalsContact C-N 3.29Å; D147-Y149 PolarHBondContact O-N 3.01Å; Y149-S151 VanDerWaalsContact C-N 3.28Å; Y149-S151 PolarHBondContact O-N 3.12Å; Y149-M152 WeakPolarHBondContact O-CB 3.32Å; Y149-M152 PolarHBondContact O-N 3.21Å; Y149-M152 VanDerWaalsContact O-N 3.15Å; Y149-L153 HydrophobicContact CD1-CD1 4.21Å; Y149-L153 HydrophobicContact CD2-CG 4.37Å; Y149-L153 HydrophobicContact CE1-CD1 3.55Å; Y149-L153 HydrophobicContact CE1-CG 4.36Å; Y149-L153 HydrophobicContact CE2-CD1 3.92Å; Y149-L153 HydrophobicContact CE2-CD2 4.19Å; Y149-L153 HydrophobicContact CE2-CG 3.88Å; Y149-L153 PolarHBondContact O-N 3.38Å; Y149-I334 HydrophobicContact CD1-CG2 4.2Å; Y149-I334 HydrophobicContact CE1-CG2 4.01Å; Y149-E338 HydrophobicContact CE1-CG 4.36Å; Y149-E338 PolarHBondContact OH-OE1 3.41Å
150	L	86.4	Confident	78.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-36.2	-179.2	-65.7	172.4	0	0	0	112.1	T146 D147 A154 L337 E338	T146-L150 HydrophobicContact CG2-CD1 4Å; T146-L150 HydrophobicContact CG2-CG 4.34Å; T146-L150 VanDerWaalsContact O-CG 3.3Å; T146-L150 WeakPolarHBondContact O-CG 2.84Å; T146-L150 PolarHBondContact O-N 3Å; D147-L150 PolarHBondContact O-N 3.02Å; L150-A154 PolarHBondContact O-N 3.25Å; L150-A154 VanDerWaalsContact O-N 3.09Å; L150-L337 HydrophobicContact CD1-CB 3.8Å; L150-L337 HydrophobicContact CD1-CD1 4.36Å; L150-L337 HydrophobicContact CD2-CB 4.26Å; L150-E338 HydrophobicContact CD2-CB 4.46Å; L150-E338 HydrophobicContact CD2-CG 3.97Å
151	S	85.2	Confident	76	Confident	59 Å²	59	65.3 Å²	65.3	41%	0.413	36%	0.358	S	S	.	.	H	α-helix	trans	-67.2	-40.8	174.7	-71.2	0	0	0	0	111.9	D147 K148 Y149 A154 S155	D147-S151 WeakPolarHBondContact O-CB 3.31Å; D147-S151 PolarHBondContact O-N 2.7Å; D147-S151 PolarHBondContact O-OG 3.32Å; K148-S151 PolarHBondContact O-N 3.43Å; Y149-S151 VanDerWaalsContact C-N 3.28Å; Y149-S151 PolarHBondContact O-N 3.12Å; S151-A154 PolarHBondContact O-N 2.77Å; S151-S155 PolarHBondContact O-N 3.2Å
152	M	82.9	Confident	73.4	Confident	60 Å²	60	64.8 Å²	64.8	30%	0.296	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-43.3	174.4	-73.9	-177.2	69.4	0	0	112.2	I26 V30 K148 Y149 A154 S155 T156	I26-M152 HydrophobicContact CB-CE 4.33Å; I26-M152 HydrophobicContact CG2-CE 3.32Å; V30-M152 HydrophobicContact CG2-CE 4.45Å; V30-M152 HydrophobicContact CG2-SD 3.84Å; K148-M152 VanDerWaalsContact O-CG 3.31Å; K148-M152 WeakPolarHBondContact O-CG 3.49Å; K148-M152 PolarHBondContact O-N 3.2Å; Y149-M152 WeakPolarHBondContact O-CB 3.32Å; Y149-M152 PolarHBondContact O-N 3.21Å; Y149-M152 VanDerWaalsContact O-N 3.15Å; M152-A154 VanDerWaalsContact C-N 3.35Å; M152-A154 PolarHBondContact O-N 3.03Å; M152-S155 PolarHBondContact O-N 2.92Å; M152-S155 PolarHBondContact O-OG 3.17Å; M152-T156 PolarHBondContact O-N 3.23Å; M152-T156 PolarHBondContact O-OG1 2.79Å
153	L	77.9	Confident	70.8	Confident	54 Å²	54	68 Å²	68	28%	0.283	39%	0.385	S	S	.	.	H	α-helix	trans	-58.7	-44.4	173.9	-77.1	178.9	0	0	0	112.2	Y149 S155 T156 E338	Y149-L153 HydrophobicContact CD1-CD1 4.21Å; Y149-L153 HydrophobicContact CD2-CG 4.37Å; Y149-L153 HydrophobicContact CE1-CD1 3.55Å; Y149-L153 HydrophobicContact CE1-CG 4.36Å; Y149-L153 HydrophobicContact CE2-CD1 3.92Å; Y149-L153 HydrophobicContact CE2-CD2 4.19Å; Y149-L153 HydrophobicContact CE2-CG 3.88Å; Y149-L153 PolarHBondContact O-N 3.38Å; L153-S155 VanDerWaalsContact C-N 3.33Å; L153-S155 PolarHBondContact O-N 3.09Å; L153-T156 PolarHBondContact O-N 3.35Å; L153-T156 PolarHBondContact O-OG1 3.4Å; L153-E338 HydrophobicContact CD1-CG 4.01Å
154	A	77.2	Confident	68.2	Low	70 Å²	70	75.3 Å²	75.3	58%	0.579	42%	0.423	S	S	*	.	H	α-helix	trans	-64.4	-38.6	178.9	0	0	0	0	0	112.2	L150 S151 M152 T156	L150-A154 PolarHBondContact O-N 3.25Å; L150-A154 VanDerWaalsContact O-N 3.09Å; S151-A154 PolarHBondContact O-N 2.77Å; M152-A154 VanDerWaalsContact C-N 3.35Å; M152-A154 PolarHBondContact O-N 3.03Å; A154-T156 VanDerWaalsContact C-N 3.33Å; A154-T156 PolarHBondContact O-N 3.34Å
155	S	72.6	Confident	66.1	Low	88 Å²	88	77.8 Å²	77.8	62%	0.615	44%	0.437	S	S	*	.	H	α-helix	trans	-69.6	-26.5	-178.3	72.6	0	0	0	0	114.1	S151 M152 L153 K157	S151-S155 PolarHBondContact O-N 3.2Å; M152-S155 PolarHBondContact O-N 2.92Å; M152-S155 PolarHBondContact O-OG 3.17Å; L153-S155 VanDerWaalsContact C-N 3.33Å; L153-S155 PolarHBondContact O-N 3.09Å; S155-K157 VanDerWaalsContact C-N 3.25Å; S155-K157 PolarHBondContact O-N 3.19Å
156	T	66.7	Low	64.5	Low	82 Å²	82	89.2 Å²	89.2	50%	0.503	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-9	-171.5	24.1	0	0	0	0	113.7	M152 L153 A154 K158	M152-T156 PolarHBondContact O-N 3.23Å; M152-T156 PolarHBondContact O-OG1 2.79Å; L153-T156 PolarHBondContact O-N 3.35Å; L153-T156 PolarHBondContact O-OG1 3.4Å; A154-T156 VanDerWaalsContact C-N 3.33Å; A154-T156 PolarHBondContact O-N 3.34Å; T156-K158 PolarHBondContact O-N 2.93Å
157	K	49.6	Very low	63.5	Low	200 Å²	200	94.5 Å²	94.5	87%	0.87	50%	0.501	S	S	*	.			trans	42	-0.5	169.7	-100.5	-174.1	179.9	-179	0	119.4	S155	S155-K157 VanDerWaalsContact C-N 3.25Å; S155-K157 PolarHBondContact O-N 3.19Å
158	K	40.3	Very low	63.2	Low	195 Å²	195	95.7 Å²	95.7	85%	0.848	51%	0.512	S	S	*	.			trans	-155.4	80.4	-178.6	-89	-173	176	178.9	0	108	T156	T156-K158 PolarHBondContact O-N 2.93Å
159	S	39.2	Very low	63.1	Low	49 Å²	49	92 Å²	92	34%	0.343	50%	0.498	S	S	.	.			trans	-176	110	142.5	55.4	0	0	0	0	105.6	L161	S159-L161 PolarHBondContact O-N 3.27Å; S159-L161 WeakPolarHBondContact OG-CD1 3.48Å
160	S	39.5	Very low	63.2	Low	101 Å²	101	94.5 Å²	94.5	71%	0.706	52%	0.518	S	S	*	.				36.2	3.7	75.1	82.8	0	0	0	0	116.7	T162 A163	S160-T162 PolarHBondContact O-N 3.44Å; S160-A163 WeakPolarHBondContact O-CB 3.41Å; S160-A163 PolarHBondContact O-N 3.35Å
161	L	42.7	Very low	63.3	Low	96 Å²	96	98.3 Å²	98.3	50%	0.503	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-4.8	174.5	-86.8	168	0	0	0	112.9	S159	S159-L161 PolarHBondContact O-N 3.27Å; S159-L161 WeakPolarHBondContact OG-CD1 3.48Å
162	T	43.3	Very low	63.5	Low	65 Å²	65	96.2 Å²	96.2	40%	0.399	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	6.1	159.2	47.1	0	0	0	0	113.8	S160 N164 N165	S160-T162 PolarHBondContact O-N 3.44Å; T162-N164 PolarHBondContact O-N 2.96Å; T162-N165 PolarHBondContact O-N 2.92Å
163	A	39.4	Very low	63.9	Low	70 Å²	70	97.4 Å²	97.4	58%	0.579	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.4	175.4	0	0	0	0	0	113.3	S160	S160-A163 WeakPolarHBondContact O-CB 3.41Å; S160-A163 PolarHBondContact O-N 3.35Å
164	N	42.5	Very low	64.7	Low	155 Å²	155	100 Å²	100	83%	0.829	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	3.4	175.1	-79.1	-14.1	0	0	0	115.6	T162	T162-N164 PolarHBondContact O-N 2.96Å
165	N	51.1	Low	65.3	Low	103 Å²	103	98.7 Å²	98.7	55%	0.551	52%	0.521	S	S	*	.			trans	-115.7	88.8	169.3	-100.5	-19.7	0	0	0	109.9	T162 K167	T162-N165 PolarHBondContact O-N 2.92Å; N165-K167 PolarHBondContact O-N 3.26Å
166	R	58.4	Low	66.2	Low	248 Å²	248	94.8 Å²	94.8	94%	0.936	49%	0.493	S	S	*	.			trans	-54.9	-1.7	179.1	-69.7	-177.4	-177.6	176.1	0.6	115.8	S168	R166-S168 PolarHBondContact O-N 3.4Å
167	K	69.5	Low	67.6	Low	111 Å²	111	96.5 Å²	96.5	48%	0.483	50%	0.496	S	S	.	.			trans	-79.9	116.4	-176	-70.7	-171.5	177.6	-173.5	0	111.1	N165 E171 R172	N165-K167 PolarHBondContact O-N 3.26Å; K167-E171 VanDerWaalsContact CA-OE2 3.26Å; K167-E171 WeakPolarHBondContact CA-OE2 3.4Å; K167-E171 HydrophobicContact CB-CB 4.14Å; K167-E171 HydrophobicContact CG-CB 4.37Å; K167-R172 HydrophobicContact CB-CG 4.16Å; K167-R172 PolarHBondContact O-NE 2.9Å
168	S	84.9	Confident	69.8	Low	53 Å²	53	91.6 Å²	91.6	37%	0.371	48%	0.476	S	S	.	.			trans	-58.2	161.7	170.3	63.8	0	0	0	0	112.1	R166 S170 E171 R172	R166-S168 PolarHBondContact O-N 3.4Å; S168-S170 PolarHBondContact O-N 3.37Å; S168-S170 PolarHBondContact OG-OG 2.68Å; S168-E171 WeakPolarHBondContact CB-OE2 3.49Å; S168-E171 PolarHBondContact N-OE2 3.15Å; S168-E171 PolarHBondContact O-N 2.87Å; S168-E171 VanDerWaalsContact O-N 3.15Å; S168-E171 WeakPolarHBondContact OG-CG 3.35Å; S168-E171 PolarHBondContact OG-N 3.3Å; S168-E171 PolarHBondContact OG-OE2 2.9Å; S168-R172 WeakPolarHBondContact O-CG 3.45Å; S168-R172 PolarHBondContact O-N 3.13Å
169	L	88	Confident	72.2	Confident	54 Å²	54	83.8 Å²	83.8	28%	0.283	44%	0.443	S	S	.	.	H	α-helix	trans	-55.4	-36.5	174.6	178.1	59.6	0	0	0	112	R172 K173 V336 L339 L340	L169-R172 PolarHBondContact O-N 2.86Å; L169-K173 HydrophobicContact CD1-CD 4.34Å; L169-K173 HydrophobicContact CD1-CG 4.23Å; L169-K173 HydrophobicContact CG-CD 4.28Å; L169-K173 WeakPolarHBondContact O-CB 3.47Å; L169-K173 WeakPolarHBondContact O-CG 3.5Å; L169-K173 PolarHBondContact O-N 3.44Å; L169-V336 HydrophobicContact CD1-CG1 4.1Å; L169-L339 HydrophobicContact CB-CD1 4.06Å; L169-L339 HydrophobicContact CD1-CB 4.03Å; L169-L339 HydrophobicContact CD1-CD1 4.26Å; L169-L340 HydrophobicContact CD1-CD2 4.2Å; L169-L340 HydrophobicContact CD2-CD2 4.17Å
170	S	90.8	Very high	74.8	Confident	71 Å²	71	82.5 Å²	82.5	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-67	-43	178.3	77.2	0	0	0	0	111.5	S168 R172 K173 M174	S168-S170 PolarHBondContact O-N 3.37Å; S168-S170 PolarHBondContact OG-OG 2.68Å; S170-R172 VanDerWaalsContact C-N 3.35Å; S170-R172 PolarHBondContact O-N 2.97Å; S170-K173 PolarHBondContact O-N 3.29Å; S170-M174 WeakPolarHBondContact O-CG 3.46Å; S170-M174 PolarHBondContact O-N 2.86Å
171	E	88.6	Confident	77.4	Confident	80 Å²	80	83.4 Å²	83.4	37%	0.374	42%	0.423	S	S	.	.	H	α-helix	trans	-64.9	-37.9	177.5	-71.3	165.6	123	0	0	112.4	K167 S168 M174 S175	K167-E171 VanDerWaalsContact CA-OE2 3.26Å; K167-E171 WeakPolarHBondContact CA-OE2 3.4Å; K167-E171 HydrophobicContact CB-CB 4.14Å; K167-E171 HydrophobicContact CG-CB 4.37Å; S168-E171 WeakPolarHBondContact CB-OE2 3.49Å; S168-E171 PolarHBondContact N-OE2 3.15Å; S168-E171 PolarHBondContact O-N 2.87Å; S168-E171 VanDerWaalsContact O-N 3.15Å; S168-E171 WeakPolarHBondContact OG-CG 3.35Å; S168-E171 PolarHBondContact OG-N 3.3Å; S168-E171 PolarHBondContact OG-OE2 2.9Å; E171-M174 HydrophobicContact CG-CE 4.14Å; E171-S175 PolarHBondContact O-N 3.47Å; E171-S175 PolarHBondContact O-OG 3.29Å
172	R	88	Confident	79.9	Confident	15 Å²	15	82 Å²	82	6%	0.057	41%	0.414	C	S	.	.	H	α-helix	trans	-65.2	-46	173.9	-65.2	-175.8	-171.7	-153.1	-2.3	111	K167 S168 L169 S170 S175 L176 D335 V336 E338	K167-R172 HydrophobicContact CB-CG 4.16Å; K167-R172 PolarHBondContact O-NE 2.9Å; S168-R172 WeakPolarHBondContact O-CG 3.45Å; S168-R172 PolarHBondContact O-N 3.13Å; L169-R172 PolarHBondContact O-N 2.86Å; S170-R172 VanDerWaalsContact C-N 3.35Å; S170-R172 PolarHBondContact O-N 2.97Å; R172-S175 PolarHBondContact O-N 2.93Å; R172-L176 PolarHBondContact O-N 3.2Å; R172-D335 VanDerWaalsContact CD-O 3.27Å; R172-D335 WeakPolarHBondContact CD-O 3.41Å; R172-D335 PolarHBondContact NH1-O 3.04Å; R172-V336 HydrophobicContact CB-CG2 3.92Å; R172-E338 IonicContact NH1-OE2 2.81Å; R172-E338 PolarHBondContact NH1-OE2 3.21Å
173	K	92.9	Very high	82.2	Confident	85 Å²	85	79.8 Å²	79.8	37%	0.37	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-42.6	175.5	-77.7	-177	175.4	-178.1	0	112.5	L169 S170 S175 L176 Q177 V336	L169-K173 HydrophobicContact CD1-CD 4.34Å; L169-K173 HydrophobicContact CD1-CG 4.23Å; L169-K173 HydrophobicContact CG-CD 4.28Å; L169-K173 WeakPolarHBondContact O-CB 3.47Å; L169-K173 WeakPolarHBondContact O-CG 3.5Å; L169-K173 PolarHBondContact O-N 3.44Å; S170-K173 PolarHBondContact O-N 3.29Å; K173-S175 PolarHBondContact O-N 2.93Å; K173-L176 PolarHBondContact O-N 2.99Å; K173-Q177 WeakPolarHBondContact O-CB 3.43Å; K173-Q177 VanDerWaalsContact O-CG 3.27Å; K173-Q177 WeakPolarHBondContact O-CG 3.34Å; K173-Q177 PolarHBondContact O-N 3.45Å; K173-V336 HydrophobicContact CG-CG1 4.16Å; K173-V336 HydrophobicContact CG-CG2 4.28Å
174	M	93.7	Very high	84.7	Confident	110 Å²	110	81.8 Å²	81.8	54%	0.542	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.3	-75.3	-169.2	-65	0	0	111.9	S170 E171 L176 Q177 Q178	S170-M174 WeakPolarHBondContact O-CG 3.46Å; S170-M174 PolarHBondContact O-N 2.86Å; E171-M174 HydrophobicContact CG-CE 4.14Å; M174-L176 VanDerWaalsContact C-N 3.31Å; M174-L176 PolarHBondContact O-N 3.31Å; M174-Q177 PolarHBondContact O-N 3.19Å; M174-Q178 PolarHBondContact O-N 3.4Å; M174-Q178 VanDerWaalsContact O-N 3.09Å
175	S	89.9	Confident	87.2	Confident	42 Å²	42	79 Å²	79	29%	0.294	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-40.9	176.7	-56	0	0	0	0	111.5	E171 R172 K173 L179	E171-S175 PolarHBondContact O-N 3.47Å; E171-S175 PolarHBondContact O-OG 3.29Å; R172-S175 PolarHBondContact O-N 2.93Å; K173-S175 PolarHBondContact O-N 2.93Å; S175-L179 PolarHBondContact O-N 2.8Å
176	L	91.8	Very high	89.2	Confident	5 Å²	5	74.1 Å²	74.1	3%	0.026	35%	0.35	C	S	.	.	H	α-helix	trans	-65	-46.4	175.6	175.2	59.6	0	0	0	111.9	R172 K173 M174 Q178 L179 E180 M329 K332 R333 V336 M348	R172-L176 PolarHBondContact O-N 3.2Å; K173-L176 PolarHBondContact O-N 2.99Å; M174-L176 VanDerWaalsContact C-N 3.31Å; M174-L176 PolarHBondContact O-N 3.31Å; L176-Q178 VanDerWaalsContact C-N 3.25Å; L176-Q178 PolarHBondContact O-N 2.85Å; L176-L179 PolarHBondContact O-N 2.98Å; L176-L179 VanDerWaalsContact O-N 3.09Å; L176-E180 HydrophobicContact CD1-CG 4.12Å; L176-E180 HydrophobicContact CG-CG 4.32Å; L176-E180 WeakPolarHBondContact O-CG 3.45Å; L176-E180 PolarHBondContact O-N 3.33Å; L176-M329 HydrophobicContact CD1-CG 3.64Å; L176-M329 WeakPolarHBondContact CD1-O 3.44Å; L176-K332 HydrophobicContact CB-CB 4.35Å; L176-K332 HydrophobicContact CD1-CB 4.07Å; L176-R333 HydrophobicContact CD1-CG 3.68Å; L176-R333 HydrophobicContact CD2-CG 3.76Å; L176-R333 HydrophobicContact CG-CG 4.39Å; L176-V336 HydrophobicContact CB-CG2 4.46Å; L176-V336 HydrophobicContact CD2-CG2 4.03Å; L176-M348 HydrophobicContact CD2-CE 3.47Å; L176-M348 VanDerWaalsContact CD2-CE 3.47Å
177	Q	95.2	Very high	90.6	Very high	118 Å²	118	63.9 Å²	63.9	55%	0.551	31%	0.312	S	S	*	.	H	α-helix	trans	-59.1	-36	179.1	-76.9	172.6	-20.3	0	0	112.7	K173 M174 E180 K181	K173-Q177 WeakPolarHBondContact O-CB 3.43Å; K173-Q177 VanDerWaalsContact O-CG 3.27Å; K173-Q177 WeakPolarHBondContact O-CG 3.34Å; K173-Q177 PolarHBondContact O-N 3.45Å; M174-Q177 PolarHBondContact O-N 3.19Å; Q177-E180 PolarHBondContact O-N 3.34Å; Q177-K181 WeakPolarHBondContact O-CB 3.46Å; Q177-K181 PolarHBondContact O-N 3.23Å
178	Q	95.2	Very high	91.6	Very high	98 Å²	98	62 Å²	62	46%	0.458	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-45.5	175	180	57.6	31.4	0	0	111.5	M174 L176 K181 E182	M174-Q178 PolarHBondContact O-N 3.4Å; M174-Q178 VanDerWaalsContact O-N 3.09Å; L176-Q178 VanDerWaalsContact C-N 3.25Å; L176-Q178 PolarHBondContact O-N 2.85Å; Q178-K181 WeakPolarHBondContact O-CB 3.24Å; Q178-K181 PolarHBondContact O-N 3.06Å; Q178-E182 PolarHBondContact NE2-OE1 3.44Å; Q178-E182 WeakPolarHBondContact O-CG 3.43Å; Q178-E182 PolarHBondContact O-N 3.41Å
179	L	91.7	Very high	92.1	Very high	30 Å²	30	64.7 Å²	64.7	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-38.2	175.3	-72.9	171.2	0	0	0	112.4	S175 L176 K181 E182 Y183 N328 M329 K332	S175-L179 PolarHBondContact O-N 2.8Å; L176-L179 PolarHBondContact O-N 2.98Å; L176-L179 VanDerWaalsContact O-N 3.09Å; L179-K181 VanDerWaalsContact C-N 3.28Å; L179-K181 PolarHBondContact O-N 3.27Å; L179-E182 PolarHBondContact O-N 2.99Å; L179-Y183 VanDerWaalsContact O-CB 3.3Å; L179-Y183 WeakPolarHBondContact O-CB 3.5Å; L179-Y183 PolarHBondContact O-N 2.89Å; L179-N328 HydrophobicContact CD1-CB 4.24Å; L179-N328 HydrophobicContact CD2-CB 4.48Å; L179-M329 HydrophobicContact CB-CB 4.19Å; L179-M329 HydrophobicContact CB-CG 4.32Å; L179-K332 HydrophobicContact CD1-CB 4.24Å; L179-K332 HydrophobicContact CD1-CG 3.61Å
180	E	93.8	Very high	92.2	Very high	23 Å²	23	62.7 Å²	62.7	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-38.2	174.7	-76.2	172.6	167.1	0	0	111.5	L176 Q177 K184 M329 R333	L176-E180 HydrophobicContact CD1-CG 4.12Å; L176-E180 HydrophobicContact CG-CG 4.32Å; L176-E180 WeakPolarHBondContact O-CG 3.45Å; L176-E180 PolarHBondContact O-N 3.33Å; Q177-E180 PolarHBondContact O-N 3.34Å; E180-K184 WeakPolarHBondContact O-CB 3.27Å; E180-K184 VanDerWaalsContact O-CG 3.26Å; E180-K184 WeakPolarHBondContact O-CG 3.46Å; E180-K184 PolarHBondContact O-N 3.08Å; E180-M329 HydrophobicContact CB-SD 4.23Å; E180-M329 HydrophobicContact CG-CG 3.99Å; E180-M329 HydrophobicContact CG-SD 3.46Å; E180-M329 WeakPolarHBondContact CG-SD 3.32Å; E180-R333 IonicContact OE1-CZ 3.71Å; E180-R333 IonicContact OE1-NE 3.61Å; E180-R333 IonicContact OE1-NH2 2.87Å; E180-R333 PolarHBondContact OE1-NH2 3.06Å
181	K	94.2	Very high	91.9	Very high	119 Å²	119	64.9 Å²	64.9	52%	0.517	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-46.2	174	-175.4	-179.1	177.7	-177.4	0	111.7	Q177 Q178 L179 Y183 K184 Q185	Q177-K181 WeakPolarHBondContact O-CB 3.46Å; Q177-K181 PolarHBondContact O-N 3.23Å; Q178-K181 WeakPolarHBondContact O-CB 3.24Å; Q178-K181 PolarHBondContact O-N 3.06Å; L179-K181 VanDerWaalsContact C-N 3.28Å; L179-K181 PolarHBondContact O-N 3.27Å; K181-Y183 VanDerWaalsContact C-N 3.32Å; K181-Y183 PolarHBondContact O-N 3.03Å; K181-K184 PolarHBondContact O-N 2.9Å; K181-Q185 WeakPolarHBondContact O-CG 3.41Å; K181-Q185 PolarHBondContact O-N 2.7Å
182	E	94.5	Very high	92	Very high	68 Å²	68	65 Å²	65	32%	0.318	31%	0.308	S	S	.	.	H	α-helix	trans	-61.3	-41.7	176.5	-73	171	-153.4	0	0	111.6	Q178 L179 Q185 S186 I325	Q178-E182 PolarHBondContact NE2-OE1 3.44Å; Q178-E182 WeakPolarHBondContact O-CG 3.43Å; Q178-E182 PolarHBondContact O-N 3.41Å; L179-E182 PolarHBondContact O-N 2.99Å; E182-Q185 PolarHBondContact O-N 3.06Å; E182-S186 WeakPolarHBondContact O-CB 3.36Å; E182-S186 PolarHBondContact O-N 3Å; E182-I325 HydrophobicContact CB-CG2 4.25Å
183	Y	92.4	Very high	92.2	Very high	18 Å²	18	65.9 Å²	65.9	7%	0.071	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-43.7	176.8	-175.5	-116.2	0	0	0	112	L179 K181 Q185 S186 K187 Q322 I325 L326 M329	L179-Y183 VanDerWaalsContact O-CB 3.3Å; L179-Y183 WeakPolarHBondContact O-CB 3.5Å; L179-Y183 PolarHBondContact O-N 2.89Å; K181-Y183 VanDerWaalsContact C-N 3.32Å; K181-Y183 PolarHBondContact O-N 3.03Å; Y183-Q185 VanDerWaalsContact C-N 3.35Å; Y183-Q185 PolarHBondContact O-N 3.45Å; Y183-S186 PolarHBondContact O-N 3.45Å; Y183-K187 HydrophobicContact CE1-CD 3.99Å; Y183-K187 HydrophobicContact CE1-CG 4.48Å; Y183-K187 VanDerWaalsContact CE1-NZ 3.29Å; Y183-K187 PolarHBondContact O-N 3.1Å; Y183-K187 WeakPolarHBondContact OH-CE 3.37Å; Y183-K187 PolarHBondContact OH-NZ 3.36Å; Y183-K187 VanDerWaalsContact OH-NZ 3.08Å; Y183-Q322 HydrophobicContact CD2-CG 3.86Å; Y183-Q322 HydrophobicContact CE2-CG 3.61Å; Y183-Q322 PolarHBondContact OH-NE2 3.16Å; Y183-I325 HydrophobicContact CD2-CG2 4.33Å; Y183-L326 HydrophobicContact CD2-CB 4.18Å; Y183-L326 HydrophobicContact CE1-CD1 4.43Å; Y183-L326 HydrophobicContact CE2-CB 3.67Å; Y183-L326 HydrophobicContact CE2-CD1 4.15Å; Y183-L326 HydrophobicContact CE2-CD2 4.44Å; Y183-L326 HydrophobicContact CE2-CG 4.3Å; Y183-M329 HydrophobicContact CD1-CE 3.83Å; Y183-M329 HydrophobicContact CD1-SD 4.09Å; Y183-M329 HydrophobicContact CE1-CE 4.04Å; Y183-M329 HydrophobicContact CG-CE 4.19Å; Y183-M329 HydrophobicContact CG-SD 4.22Å
184	K	92	Very high	91.9	Very high	112 Å²	112	63.4 Å²	63.4	49%	0.487	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-42.5	174.5	-76.9	167.8	-176	163.9	0	111.8	E180 K181 K187 S188 E355	E180-K184 WeakPolarHBondContact O-CB 3.27Å; E180-K184 VanDerWaalsContact O-CG 3.26Å; E180-K184 WeakPolarHBondContact O-CG 3.46Å; E180-K184 PolarHBondContact O-N 3.08Å; K181-K184 PolarHBondContact O-N 2.9Å; K184-K187 PolarHBondContact O-N 3.32Å; K184-S188 PolarHBondContact O-N 3.2Å; K184-S188 VanDerWaalsContact O-N 3.11Å; K184-E355 WeakPolarHBondContact CE-OE1 3.36Å; K184-E355 IonicContact NZ-OE1 2.9Å; K184-E355 PolarHBondContact NZ-OE1 3.15Å
185	Q	93.7	Very high	91.4	Very high	97 Å²	97	60.9 Å²	60.9	45%	0.453	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-44	175.6	-71.7	175.5	-9.2	0	0	112	K181 E182 Y183 S188 R189	K181-Q185 WeakPolarHBondContact O-CG 3.41Å; K181-Q185 PolarHBondContact O-N 2.7Å; E182-Q185 PolarHBondContact O-N 3.06Å; Y183-Q185 VanDerWaalsContact C-N 3.35Å; Y183-Q185 PolarHBondContact O-N 3.45Å; Q185-S188 WeakPolarHBondContact O-CB 3.41Å; Q185-S188 PolarHBondContact O-N 3.11Å; Q185-R189 PolarHBondContact O-N 3.3Å; Q185-R189 VanDerWaalsContact O-N 3.08Å
186	S	93	Very high	91.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-40.5	177.1	-175.4	0	0	0	0	112	E182 Y183 S188 R189 I190 E318 Q322	E182-S186 WeakPolarHBondContact O-CB 3.36Å; E182-S186 PolarHBondContact O-N 3Å; Y183-S186 PolarHBondContact O-N 3.45Å; S186-S188 VanDerWaalsContact C-N 3.31Å; S186-S188 PolarHBondContact O-N 3.33Å; S186-R189 WeakPolarHBondContact O-CB 3.19Å; S186-R189 PolarHBondContact O-N 2.9Å; S186-R189 VanDerWaalsContact O-N 3.1Å; S186-I190 WeakPolarHBondContact O-CG1 3.47Å; S186-I190 PolarHBondContact O-N 3.49Å; S186-E318 PolarHBondContact OG-OE1 3.46Å; S186-Q322 VanDerWaalsContact OG-CB 3.27Å; S186-Q322 WeakPolarHBondContact OG-CB 3.45Å; S186-Q322 WeakPolarHBondContact OG-CG 3.45Å
187	K	89.7	Confident	91.1	Very high	32 Å²	32	61.5 Å²	61.5	14%	0.139	30%	0.296	C	S	.	.	H	α-helix	trans	-55.7	-44	170.7	-85	-166.6	170.4	165.4	0	112.8	Y183 K184 R189 I190 R191 Q322 S359	Y183-K187 HydrophobicContact CE1-CD 3.99Å; Y183-K187 HydrophobicContact CE1-CG 4.48Å; Y183-K187 VanDerWaalsContact CE1-NZ 3.29Å; Y183-K187 PolarHBondContact O-N 3.1Å; Y183-K187 WeakPolarHBondContact OH-CE 3.37Å; Y183-K187 PolarHBondContact OH-NZ 3.36Å; Y183-K187 VanDerWaalsContact OH-NZ 3.08Å; K184-K187 PolarHBondContact O-N 3.32Å; K187-R189 VanDerWaalsContact C-N 3.32Å; K187-R189 PolarHBondContact O-N 2.9Å; K187-I190 PolarHBondContact O-N 3.08Å; K187-R191 PolarHBondContact O-N 3.34Å; K187-Q322 VanDerWaalsContact CE-NE2 3.33Å; K187-S359 PolarHBondContact NZ-OG 2.76Å
188	S	90.5	Very high	90.4	Very high	71 Å²	71	57.2 Å²	57.2	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-41.2	176.4	-170.1	0	0	0	0	111.9	K184 Q185 S186 R191 T192	K184-S188 PolarHBondContact O-N 3.2Å; K184-S188 VanDerWaalsContact O-N 3.11Å; Q185-S188 WeakPolarHBondContact O-CB 3.41Å; Q185-S188 PolarHBondContact O-N 3.11Å; S186-S188 VanDerWaalsContact C-N 3.31Å; S186-S188 PolarHBondContact O-N 3.33Å; S188-R191 PolarHBondContact O-N 3.3Å; S188-T192 PolarHBondContact O-N 3.44Å; S188-T192 PolarHBondContact O-OG1 2.79Å
189	R	93.5	Very high	89.9	Confident	110 Å²	110	59.5 Å²	59.5	42%	0.415	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-43.1	176.5	-69.9	-171	-64.8	-100.8	1.5	111.9	Q185 S186 K187 R191 T192 L193 E318	Q185-R189 PolarHBondContact O-N 3.3Å; Q185-R189 VanDerWaalsContact O-N 3.08Å; S186-R189 WeakPolarHBondContact O-CB 3.19Å; S186-R189 PolarHBondContact O-N 2.9Å; S186-R189 VanDerWaalsContact O-N 3.1Å; K187-R189 VanDerWaalsContact C-N 3.32Å; K187-R189 PolarHBondContact O-N 2.9Å; R189-R191 VanDerWaalsContact C-N 3.33Å; R189-R191 PolarHBondContact O-N 3.41Å; R189-T192 PolarHBondContact O-N 3.06Å; R189-L193 WeakPolarHBondContact O-CG 3.41Å; R189-L193 PolarHBondContact O-N 2.75Å; R189-E318 HydrophobicContact CB-CG 4.23Å; R189-E318 IonicContact CZ-OE1 2.67Å; R189-E318 VanDerWaalsContact CZ-OE1 3.3Å; R189-E318 IonicContact NE-OE1 3.2Å; R189-E318 PolarHBondContact NE-OE1 2.94Å; R189-E318 IonicContact NE-OE2 3.91Å; R189-E318 IonicContact NH2-OE1 2.84Å; R189-E318 PolarHBondContact NH2-OE1 2.93Å
190	I	90.8	Very high	89.7	Confident	12 Å²	12	58.8 Å²	58.8	6%	0.062	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-43	177	-75.2	175.2	0	0	0	111.3	S186 K187 T192 L193 Y194 Y315 E318 L319 Q322	S186-I190 WeakPolarHBondContact O-CG1 3.47Å; S186-I190 PolarHBondContact O-N 3.49Å; K187-I190 PolarHBondContact O-N 3.08Å; I190-T192 VanDerWaalsContact C-N 3.33Å; I190-T192 PolarHBondContact O-N 2.87Å; I190-L193 PolarHBondContact O-N 2.88Å; I190-Y194 WeakPolarHBondContact O-CB 3.48Å; I190-Y194 PolarHBondContact O-N 3.2Å; I190-Y315 HydrophobicContact CG2-CD2 4.35Å; I190-Y315 HydrophobicContact CG2-CE2 3.6Å; I190-E318 HydrophobicContact CD1-CG 4.13Å; I190-E318 HydrophobicContact CG1-CB 4.09Å; I190-E318 HydrophobicContact CG1-CG 3.47Å; I190-E318 VanDerWaalsContact CG1-CG 3.47Å; I190-L319 HydrophobicContact CD1-CB 4.35Å; I190-L319 HydrophobicContact CD1-CD1 4.15Å; I190-Q322 HydrophobicContact CD1-CB 3.51Å; I190-Q322 HydrophobicContact CD1-CG 3.73Å
191	R	85.4	Confident	89.3	Confident	117 Å²	117	58.4 Å²	58.4	44%	0.442	28%	0.279	S	S	.	.	H	α-helix	trans	-58.2	-45	175.3	-75.9	176.3	174.2	174.2	-10.7	111.9	K187 S188 R189 Y194 S195 S359 I360	K187-R191 PolarHBondContact O-N 3.34Å; S188-R191 PolarHBondContact O-N 3.3Å; R189-R191 VanDerWaalsContact C-N 3.33Å; R189-R191 PolarHBondContact O-N 3.41Å; R191-Y194 WeakPolarHBondContact O-CB 3.36Å; R191-Y194 PolarHBondContact O-N 2.89Å; R191-S195 PolarHBondContact O-N 2.87Å; R191-S195 VanDerWaalsContact O-N 3.09Å; R191-S195 PolarHBondContact O-OG 2.66Å; R191-S359 PolarHBondContact NH2-O 3.46Å; R191-I360 PolarHBondContact NH2-O 3.49Å; R191-I360 PolarHBondContact NH2-OXT 2.86Å
192	T	89.4	Confident	88.7	Confident	82 Å²	82	56.4 Å²	56.4	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-48.6	176.2	-55.9	0	0	0	0	111.7	S188 R189 I190 Y194 S195 D196	S188-T192 PolarHBondContact O-N 3.44Å; S188-T192 PolarHBondContact O-OG1 2.79Å; R189-T192 PolarHBondContact O-N 3.06Å; I190-T192 VanDerWaalsContact C-N 3.33Å; I190-T192 PolarHBondContact O-N 2.87Å; T192-Y194 VanDerWaalsContact C-N 3.26Å; T192-Y194 PolarHBondContact O-N 3.43Å; T192-S195 WeakPolarHBondContact O-CB 3.4Å; T192-S195 PolarHBondContact O-N 2.67Å; T192-D196 PolarHBondContact O-N 3.26Å
193	L	92.6	Very high	88.3	Confident	34 Å²	34	55.8 Å²	55.8	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-34.7	178.8	-70.8	172.4	0	0	0	112.1	R189 I190 D196 V197 K314 Y315 E318	R189-L193 WeakPolarHBondContact O-CG 3.41Å; R189-L193 PolarHBondContact O-N 2.75Å; I190-L193 PolarHBondContact O-N 2.88Å; L193-D196 WeakPolarHBondContact O-CB 3.3Å; L193-D196 PolarHBondContact O-N 2.99Å; L193-V197 WeakPolarHBondContact O-CG2 3.45Å; L193-V197 PolarHBondContact O-N 3.41Å; L193-K314 HydrophobicContact CD2-CB 4.13Å; L193-Y315 HydrophobicContact CB-CD2 4.08Å; L193-E318 HydrophobicContact CD1-CB 3.62Å; L193-E318 HydrophobicContact CD1-CG 4.04Å
194	Y	86.6	Confident	88.1	Confident	33 Å²	33	57.5 Å²	57.5	13%	0.129	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-46.2	175.1	-175.1	-115.1	0	0	0	111.3	I53 Q56 I190 R191 T192 D196 V197 I198 Y315	I53-Y194 HydrophobicContact CG1-CD2 4.26Å; I53-Y194 HydrophobicContact CG1-CE2 3.82Å; Q56-Y194 PolarHBondContact NE2-OH 2.95Å; Q56-Y194 PolarHBondContact OE1-OH 3.13Å; I190-Y194 WeakPolarHBondContact O-CB 3.48Å; I190-Y194 PolarHBondContact O-N 3.2Å; R191-Y194 WeakPolarHBondContact O-CB 3.36Å; R191-Y194 PolarHBondContact O-N 2.89Å; T192-Y194 VanDerWaalsContact C-N 3.26Å; T192-Y194 PolarHBondContact O-N 3.43Å; Y194-D196 PolarHBondContact O-N 3.46Å; Y194-V197 WeakPolarHBondContact O-CB 3.34Å; Y194-V197 PolarHBondContact O-N 2.96Å; Y194-I198 HydrophobicContact CD1-CD1 3.91Å; Y194-I198 HydrophobicContact CE1-CD1 3.64Å; Y194-I198 WeakPolarHBondContact O-CG1 3.41Å; Y194-I198 PolarHBondContact O-N 3.39Å; Y194-Y315 HydrophobicContact CD2-CD2 4.45Å; Y194-Y315 AromaticContact CD2-CE2 3.78Å; Y194-Y315 HydrophobicContact CD2-CE2 3.78Å; Y194-Y315 HydrophobicContact CG-CE2 4.2Å
195	S	82.9	Confident	87.8	Confident	57 Å²	57	57.5 Å²	57.5	40%	0.399	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-34.7	172.9	-62.2	0	0	0	0	112.5	R191 T192 R199	R191-S195 PolarHBondContact O-N 2.87Å; R191-S195 VanDerWaalsContact O-N 3.09Å; R191-S195 PolarHBondContact O-OG 2.66Å; T192-S195 WeakPolarHBondContact O-CB 3.4Å; T192-S195 PolarHBondContact O-N 2.67Å; S195-R199 WeakPolarHBondContact O-CB 3.18Å; S195-R199 PolarHBondContact O-N 3.39Å
196	D	88.5	Confident	87.5	Confident	58 Å²	58	57.8 Å²	57.8	31%	0.31	29%	0.285	S	S	.	.	H	α-helix	trans	-67.6	-41	175	-69.9	-19.7	0	0	0	112.1	T192 L193 Y194 R199 S200	T192-D196 PolarHBondContact O-N 3.26Å; L193-D196 WeakPolarHBondContact O-CB 3.3Å; L193-D196 PolarHBondContact O-N 2.99Å; Y194-D196 PolarHBondContact O-N 3.46Å; D196-R199 PolarHBondContact O-N 2.7Å; D196-R199 IonicContact OD1-CZ 2.98Å; D196-R199 IonicContact OD1-NH1 2.81Å; D196-R199 PolarHBondContact OD1-NH1 2.89Å; D196-R199 IonicContact OD1-NH2 2.61Å; D196-S200 WeakPolarHBondContact O-CB 3.38Å; D196-S200 PolarHBondContact O-N 2.95Å; D196-S200 PolarHBondContact O-OG 2.75Å
197	V	88.4	Confident	87.3	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-48	172.9	167.3	0	0	0	0	111	I53 L193 Y194 R199 S200 A201 A311 L312 Y315	I53-V197 HydrophobicContact CG2-CG1 4.45Å; L193-V197 WeakPolarHBondContact O-CG2 3.45Å; L193-V197 PolarHBondContact O-N 3.41Å; Y194-V197 WeakPolarHBondContact O-CB 3.34Å; Y194-V197 PolarHBondContact O-N 2.96Å; V197-R199 VanDerWaalsContact C-N 3.33Å; V197-R199 PolarHBondContact O-N 2.71Å; V197-S200 WeakPolarHBondContact CA-OG 3.5Å; V197-S200 PolarHBondContact O-N 3.16Å; V197-S200 PolarHBondContact O-OG 2.71Å; V197-A201 WeakPolarHBondContact O-CB 3.33Å; V197-A201 PolarHBondContact O-N 3.45Å; V197-A311 HydrophobicContact CG2-CB 4.03Å; V197-L312 HydrophobicContact CG1-CD2 3.52Å; V197-L312 HydrophobicContact CG1-CG 4.19Å; V197-L312 HydrophobicContact CG2-CD2 4.17Å; V197-L312 HydrophobicContact CG2-CG 4.46Å; V197-Y315 HydrophobicContact CG2-CG 4.22Å
198	I	80.3	Confident	87.4	Confident	27 Å²	27	61.3 Å²	61.3	14%	0.138	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-47.6	177.8	-66.7	172.3	0	0	0	109.9	E67 Y194 S200 A201 V202	E67-I198 WeakPolarHBondContact OE1-CD1 3.4Å; Y194-I198 HydrophobicContact CD1-CD1 3.91Å; Y194-I198 HydrophobicContact CE1-CD1 3.64Å; Y194-I198 WeakPolarHBondContact O-CG1 3.41Å; Y194-I198 PolarHBondContact O-N 3.39Å; I198-S200 VanDerWaalsContact C-N 3.34Å; I198-S200 PolarHBondContact O-N 2.96Å; I198-A201 PolarHBondContact O-N 2.94Å; I198-V202 HydrophobicContact CG2-CG2 4.37Å; I198-V202 WeakPolarHBondContact O-CG2 3.15Å; I198-V202 PolarHBondContact O-N 3.43Å
199	R	84	Confident	87.4	Confident	146 Å²	146	62.3 Å²	62.3	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-61.1	-43.1	-180	-166.9	-174.8	-54.6	115.1	7.3	111.7	S195 D196 V197 T203	S195-R199 WeakPolarHBondContact O-CB 3.18Å; S195-R199 PolarHBondContact O-N 3.39Å; D196-R199 PolarHBondContact O-N 2.7Å; D196-R199 IonicContact OD1-CZ 2.98Å; D196-R199 IonicContact OD1-NH1 2.81Å; D196-R199 PolarHBondContact OD1-NH1 2.89Å; D196-R199 IonicContact OD1-NH2 2.61Å; V197-R199 VanDerWaalsContact C-N 3.33Å; V197-R199 PolarHBondContact O-N 2.71Å; R199-T203 WeakPolarHBondContact O-CB 3.43Å; R199-T203 PolarHBondContact O-N 2.86Å; R199-T203 PolarHBondContact O-OG1 2.98Å
200	S	88.5	Confident	87.4	Confident	15 Å²	15	60.2 Å²	60.2	11%	0.105	30%	0.3	C	S	.	.	H	α-helix	trans	-68.5	-38.1	178.3	60.1	0	0	0	0	112.4	D196 V197 I198 T203 Y204 N308 A311	D196-S200 WeakPolarHBondContact O-CB 3.38Å; D196-S200 PolarHBondContact O-N 2.95Å; D196-S200 PolarHBondContact O-OG 2.75Å; V197-S200 WeakPolarHBondContact CA-OG 3.5Å; V197-S200 PolarHBondContact O-N 3.16Å; V197-S200 PolarHBondContact O-OG 2.71Å; I198-S200 VanDerWaalsContact C-N 3.34Å; I198-S200 PolarHBondContact O-N 2.96Å; S200-T203 PolarHBondContact O-N 3.07Å; S200-Y204 VanDerWaalsContact O-CB 3.27Å; S200-Y204 WeakPolarHBondContact O-CB 3.46Å; S200-Y204 PolarHBondContact O-N 2.7Å; S200-N308 PolarHBondContact OG-OD1 3.49Å; S200-A311 WeakPolarHBondContact OG-CB 3.31Å
201	A	84.4	Confident	87.6	Confident	16 Å²	16	60.1 Å²	60.1	13%	0.132	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-45.5	176.8	0	0	0	0	0	111.7	E57 V197 I198 T203 Y204 R205 N308	E57-A201 HydrophobicContact CG-CB 4.39Å; V197-A201 WeakPolarHBondContact O-CB 3.33Å; V197-A201 PolarHBondContact O-N 3.45Å; I198-A201 PolarHBondContact O-N 2.94Å; A201-T203 PolarHBondContact O-N 3.26Å; A201-Y204 PolarHBondContact O-N 3.4Å; A201-R205 WeakPolarHBondContact O-CB 3.16Å; A201-R205 PolarHBondContact O-N 3.37Å; A201-N308 PolarHBondContact N-OD1 3.33Å
202	V	81	Confident	87.9	Confident	77 Å²	77	57 Å²	57	47%	0.467	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-45.5	175.2	170.9	0	0	0	0	111	I198 Y204 R205 I206	I198-V202 HydrophobicContact CG2-CG2 4.37Å; I198-V202 WeakPolarHBondContact O-CG2 3.15Å; I198-V202 PolarHBondContact O-N 3.43Å; V202-Y204 PolarHBondContact O-N 3.44Å; V202-R205 PolarHBondContact O-N 2.86Å; V202-I206 HydrophobicContact CG1-CD1 3.89Å; V202-I206 WeakPolarHBondContact O-CG1 3.49Å; V202-I206 PolarHBondContact O-N 2.92Å
203	T	87.4	Confident	88.1	Confident	55 Å²	55	59.4 Å²	59.4	34%	0.337	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-45.4	178.4	-54.8	0	0	0	0	111.1	R199 S200 A201 R205 I206 V207	R199-T203 WeakPolarHBondContact O-CB 3.43Å; R199-T203 PolarHBondContact O-N 2.86Å; R199-T203 PolarHBondContact O-OG1 2.98Å; S200-T203 PolarHBondContact O-N 3.07Å; A201-T203 PolarHBondContact O-N 3.26Å; T203-R205 VanDerWaalsContact C-N 3.31Å; T203-R205 PolarHBondContact O-N 3.41Å; T203-I206 PolarHBondContact O-N 3.28Å; T203-V207 WeakPolarHBondContact O-CG2 3.45Å; T203-V207 PolarHBondContact O-N 3Å
204	Y	88.3	Confident	88.2	Confident	54 Å²	54	61.8 Å²	61.8	21%	0.212	31%	0.307	C	S	.	.	H	α-helix	trans	-57.4	-44.1	175.5	172	-105.7	0	0	0	111.8	S200 A201 V202 V207 Y208 L301 E304 N305	S200-Y204 VanDerWaalsContact O-CB 3.27Å; S200-Y204 WeakPolarHBondContact O-CB 3.46Å; S200-Y204 PolarHBondContact O-N 2.7Å; A201-Y204 PolarHBondContact O-N 3.4Å; V202-Y204 PolarHBondContact O-N 3.44Å; Y204-V207 PolarHBondContact O-N 2.95Å; Y204-Y208 WeakPolarHBondContact O-CB 3.16Å; Y204-Y208 PolarHBondContact O-N 3.38Å; Y204-L301 HydrophobicContact CD2-CD1 3.84Å; Y204-L301 HydrophobicContact CE2-CD1 3.31Å; Y204-L301 HydrophobicContact CE2-CG 3.79Å; Y204-E304 HydrophobicContact CD2-CB 4.07Å; Y204-N305 HydrophobicContact CD2-CB 3.93Å; Y204-N305 HydrophobicContact CE2-CB 3.5Å
205	R	84.7	Confident	88.6	Confident	112 Å²	112	61.3 Å²	61.3	42%	0.423	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-46.8	177.4	-177.2	179.7	173.7	177.2	7.1	112.5	G59 A201 V202 T203 V207 Y208 E209	G59-R205 PolarHBondContact O-NH1 3.05Å; A201-R205 WeakPolarHBondContact O-CB 3.16Å; A201-R205 PolarHBondContact O-N 3.37Å; V202-R205 PolarHBondContact O-N 2.86Å; T203-R205 VanDerWaalsContact C-N 3.31Å; T203-R205 PolarHBondContact O-N 3.41Å; R205-V207 VanDerWaalsContact C-N 3.27Å; R205-V207 PolarHBondContact O-N 3.36Å; R205-Y208 WeakPolarHBondContact O-CB 3.38Å; R205-Y208 PolarHBondContact O-N 3.5Å; R205-Y208 VanDerWaalsContact O-N 3.14Å; R205-E209 HydrophobicContact CG-CG 4.44Å; R205-E209 WeakPolarHBondContact CG-OE1 3.44Å; R205-E209 IonicContact CZ-OE1 3.51Å; R205-E209 IonicContact NE-OE1 2.8Å; R205-E209 PolarHBondContact NE-OE1 2.98Å; R205-E209 IonicContact NH2-OE1 2.78Å; R205-E209 WeakPolarHBondContact O-CG 3.29Å; R205-E209 PolarHBondContact O-N 3.46Å
206	I	86.8	Confident	89	Confident	102 Å²	102	62.1 Å²	62.1	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-58.3	-43.4	177.5	-69.5	167.1	0	0	0	110.6	V202 T203 S210	V202-I206 HydrophobicContact CG1-CD1 3.89Å; V202-I206 WeakPolarHBondContact O-CG1 3.49Å; V202-I206 PolarHBondContact O-N 2.92Å; T203-I206 PolarHBondContact O-N 3.28Å; I206-S210 WeakPolarHBondContact O-CB 3.36Å; I206-S210 PolarHBondContact O-N 3.22Å; I206-S210 VanDerWaalsContact O-N 3.08Å
207	V	90.7	Very high	89.2	Confident	34 Å²	34	66 Å²	66	21%	0.206	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-40.9	177.1	173	0	0	0	0	111.2	T203 Y204 R205 S210 V211 E300 L301 E304	T203-V207 WeakPolarHBondContact O-CG2 3.45Å; T203-V207 PolarHBondContact O-N 3Å; Y204-V207 PolarHBondContact O-N 2.95Å; R205-V207 VanDerWaalsContact C-N 3.27Å; R205-V207 PolarHBondContact O-N 3.36Å; V207-S210 PolarHBondContact O-N 3.44Å; V207-V211 HydrophobicContact CG1-CG2 4.13Å; V207-V211 WeakPolarHBondContact O-CB 3.28Å; V207-V211 VanDerWaalsContact O-CG2 3.23Å; V207-V211 WeakPolarHBondContact O-CG2 3.48Å; V207-V211 PolarHBondContact O-N 2.95Å; V207-E300 HydrophobicContact CG1-CB 4.21Å; V207-L301 HydrophobicContact CG1-CD1 4.35Å; V207-E304 HydrophobicContact CB-CG 4.23Å; V207-E304 HydrophobicContact CG1-CG 4.28Å; V207-E304 HydrophobicContact CG2-CG 3.95Å
208	Y	90.6	Very high	89.4	Confident	73 Å²	73	69.6 Å²	69.6	29%	0.286	34%	0.341	S	S	.	.	H	α-helix	trans	-55.1	-54.9	174.2	-176.4	-79	0	0	0	111.4	Y204 R205 S210 V211 E212 L295 L301	Y204-Y208 WeakPolarHBondContact O-CB 3.16Å; Y204-Y208 PolarHBondContact O-N 3.38Å; R205-Y208 WeakPolarHBondContact O-CB 3.38Å; R205-Y208 PolarHBondContact O-N 3.5Å; R205-Y208 VanDerWaalsContact O-N 3.14Å; Y208-S210 VanDerWaalsContact C-N 3.3Å; Y208-S210 PolarHBondContact O-N 2.68Å; Y208-V211 PolarHBondContact O-N 3.21Å; Y208-E212 HydrophobicContact CE1-CB 4.43Å; Y208-E212 WeakPolarHBondContact CE1-OE2 3.48Å; Y208-E212 WeakPolarHBondContact O-CB 3.29Å; Y208-E212 PolarHBondContact O-N 3.3Å; Y208-L295 HydrophobicContact CE1-CD1 4.48Å; Y208-L295 HydrophobicContact CE2-CD1 3.72Å; Y208-L295 HydrophobicContact CE2-CD2 4.2Å; Y208-L295 HydrophobicContact CE2-CG 4.45Å; Y208-L295 WeakPolarHBondContact OH-CD1 3.41Å; Y208-L301 HydrophobicContact CD2-CD1 4.01Å; Y208-L301 HydrophobicContact CD2-CD2 3.83Å; Y208-L301 HydrophobicContact CE2-CD2 4.37Å; Y208-L301 HydrophobicContact CG-CD1 4.33Å
209	E	90	Very high	90.1	Very high	92 Å²	92	70.1 Å²	70.1	43%	0.43	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-39.1	-178.3	-70.2	172.6	-176.4	0	0	111.6	R205 K213	R205-E209 HydrophobicContact CG-CG 4.44Å; R205-E209 WeakPolarHBondContact CG-OE1 3.44Å; R205-E209 IonicContact CZ-OE1 3.51Å; R205-E209 IonicContact NE-OE1 2.8Å; R205-E209 PolarHBondContact NE-OE1 2.98Å; R205-E209 IonicContact NH2-OE1 2.78Å; R205-E209 WeakPolarHBondContact O-CG 3.29Å; R205-E209 PolarHBondContact O-N 3.46Å; E209-K213 VanDerWaalsContact O-CB 3.25Å; E209-K213 WeakPolarHBondContact O-CB 3.44Å; E209-K213 PolarHBondContact O-N 2.81Å
210	S	93.6	Very high	90.6	Very high	65 Å²	65	66.6 Å²	66.6	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-47.8	175.8	-175.4	0	0	0	0	112.3	I206 V207 Y208 K213 N214	I206-S210 WeakPolarHBondContact O-CB 3.36Å; I206-S210 PolarHBondContact O-N 3.22Å; I206-S210 VanDerWaalsContact O-N 3.08Å; V207-S210 PolarHBondContact O-N 3.44Å; Y208-S210 VanDerWaalsContact C-N 3.3Å; Y208-S210 PolarHBondContact O-N 2.68Å; S210-K213 PolarHBondContact O-N 2.95Å; S210-N214 PolarHBondContact O-N 2.94Å; S210-N214 PolarHBondContact O-ND2 2.88Å
211	V	94.7	Very high	90.9	Very high	11 Å²	11	71.7 Å²	71.7	7%	0.067	36%	0.36	C	S	.	.	H	α-helix	trans	-62.5	-47.1	177.6	170.3	0	0	0	0	110	V207 Y208 K213 N214 L215 L295	V207-V211 HydrophobicContact CG1-CG2 4.13Å; V207-V211 WeakPolarHBondContact O-CB 3.28Å; V207-V211 VanDerWaalsContact O-CG2 3.23Å; V207-V211 WeakPolarHBondContact O-CG2 3.48Å; V207-V211 PolarHBondContact O-N 2.95Å; Y208-V211 PolarHBondContact O-N 3.21Å; V211-K213 PolarHBondContact O-N 2.92Å; V211-N214 PolarHBondContact O-N 3.32Å; V211-N214 VanDerWaalsContact O-N 3.15Å; V211-L215 HydrophobicContact CG1-CD1 4.12Å; V211-L215 HydrophobicContact CG1-CG 4.32Å; V211-L215 WeakPolarHBondContact O-CG 3.47Å; V211-L215 PolarHBondContact O-N 2.76Å; V211-L295 HydrophobicContact CG1-CD2 4.1Å
212	E	93.1	Very high	91.4	Very high	52 Å²	52	71 Å²	71	24%	0.243	35%	0.354	C	S	.	.	H	α-helix	trans	-58.6	-48.6	178.7	-165.6	-168.6	175.9	0	0	111.2	Y208 N214 L215 W216 L291 L295	Y208-E212 HydrophobicContact CE1-CB 4.43Å; Y208-E212 WeakPolarHBondContact CE1-OE2 3.48Å; Y208-E212 WeakPolarHBondContact O-CB 3.29Å; Y208-E212 PolarHBondContact O-N 3.3Å; E212-N214 VanDerWaalsContact C-N 3.26Å; E212-N214 PolarHBondContact O-N 3Å; E212-L215 WeakPolarHBondContact O-CB 3.44Å; E212-L215 PolarHBondContact O-N 2.89Å; E212-L215 VanDerWaalsContact O-N 3.08Å; E212-W216 PolarHBondContact O-N 3.3Å; E212-W216 PolarHBondContact OE1-NE1 2.9Å; E212-L291 HydrophobicContact CG-CD1 4.5Å; E212-L295 HydrophobicContact CB-CD2 4.11Å; E212-L295 HydrophobicContact CG-CD2 4.46Å
213	K	93.4	Very high	92	Very high	132 Å²	132	72.4 Å²	72.4	57%	0.574	35%	0.351	S	S	*	.	H	α-helix	trans	-57.8	-38.9	176.2	-175.5	176.5	-175.5	174.1	0	112.3	E209 S210 V211 K217	E209-K213 VanDerWaalsContact O-CB 3.25Å; E209-K213 WeakPolarHBondContact O-CB 3.44Å; E209-K213 PolarHBondContact O-N 2.81Å; S210-K213 PolarHBondContact O-N 2.95Å; V211-K213 PolarHBondContact O-N 2.92Å; K213-K217 WeakPolarHBondContact O-CG 3.37Å; K213-K217 PolarHBondContact O-N 3.05Å
214	N	94.2	Very high	92.4	Very high	83 Å²	83	74.6 Å²	74.6	44%	0.444	36%	0.361	S	S	.	.	H	α-helix	trans	-69.9	-39.9	175.9	-73.6	-24.7	0	0	0	111.8	S210 V211 E212 W216 K217 S218	S210-N214 PolarHBondContact O-N 2.94Å; S210-N214 PolarHBondContact O-ND2 2.88Å; V211-N214 PolarHBondContact O-N 3.32Å; V211-N214 VanDerWaalsContact O-N 3.15Å; E212-N214 VanDerWaalsContact C-N 3.26Å; E212-N214 PolarHBondContact O-N 3Å; N214-W216 VanDerWaalsContact C-N 3.34Å; N214-W216 PolarHBondContact O-N 3.48Å; N214-K217 WeakPolarHBondContact O-CB 3.3Å; N214-K217 PolarHBondContact O-N 3.46Å; N214-K217 VanDerWaalsContact O-N 3.11Å; N214-S218 WeakPolarHBondContact O-CB 3.4Å; N214-S218 PolarHBondContact O-N 3.33Å; N214-S218 PolarHBondContact O-OG 2.96Å
215	L	94.4	Very high	92.8	Very high	23 Å²	23	73.7 Å²	73.7	12%	0.12	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-44.7	175.1	-71.2	173.5	0	0	0	111.3	V211 E212 K217 S218 N219 L222 L294 L295	V211-L215 HydrophobicContact CG1-CD1 4.12Å; V211-L215 HydrophobicContact CG1-CG 4.32Å; V211-L215 WeakPolarHBondContact O-CG 3.47Å; V211-L215 PolarHBondContact O-N 2.76Å; E212-L215 WeakPolarHBondContact O-CB 3.44Å; E212-L215 PolarHBondContact O-N 2.89Å; E212-L215 VanDerWaalsContact O-N 3.08Å; L215-K217 PolarHBondContact O-N 3.31Å; L215-S218 PolarHBondContact O-N 3.4Å; L215-N219 WeakPolarHBondContact CA-ND2 3.26Å; L215-N219 VanDerWaalsContact CD2-ND2 3.34Å; L215-N219 WeakPolarHBondContact CD2-ND2 3.36Å; L215-N219 VanDerWaalsContact O-CB 3.31Å; L215-N219 WeakPolarHBondContact O-CB 3.48Å; L215-N219 PolarHBondContact O-N 2.96Å; L215-N219 PolarHBondContact O-ND2 2.78Å; L215-N219 VanDerWaalsContact O-ND2 3.08Å; L215-L222 HydrophobicContact CB-CD2 4.38Å; L215-L294 HydrophobicContact CD1-CB 3.81Å; L215-L294 HydrophobicContact CD2-CB 4.08Å; L215-L294 HydrophobicContact CD2-CD1 4.45Å; L215-L295 HydrophobicContact CD1-CD2 3.71Å; L215-L295 HydrophobicContact CD1-CG 3.95Å
216	W	92.9	Very high	93.3	Very high	74 Å²	74	71 Å²	71	28%	0.28	35%	0.35	S	S	.	.	H	α-helix	trans	-58.1	-33.5	174.9	-80.4	112	0	0	0	113.2	E212 N214 L222 R223 K226 F287	E212-W216 PolarHBondContact O-N 3.3Å; E212-W216 PolarHBondContact OE1-NE1 2.9Å; N214-W216 VanDerWaalsContact C-N 3.34Å; N214-W216 PolarHBondContact O-N 3.48Å; W216-L222 HydrophobicContact CD2-CD2 3.75Å; W216-L222 HydrophobicContact CD2-CG 4.42Å; W216-L222 HydrophobicContact CE3-CD2 3.87Å; W216-L222 HydrophobicContact CE3-CG 4.09Å; W216-L222 HydrophobicContact CG-CD2 4.18Å; W216-L222 HydrophobicContact CH2-CD2 4.47Å; W216-L222 HydrophobicContact CH2-CG 4.23Å; W216-L222 HydrophobicContact CZ2-CD2 4.37Å; W216-L222 HydrophobicContact CZ3-CD2 4.23Å; W216-L222 HydrophobicContact CZ3-CG 4Å; W216-R223 HydrophobicContact CE3-CG 4.02Å; W216-R223 HydrophobicContact CZ3-CG 4.32Å; W216-R223 PolarHBondContact O-NH1 3.14Å; W216-K226 HydrophobicContact CH2-CB 3.7Å; W216-K226 HydrophobicContact CH2-CD 4.2Å; W216-K226 HydrophobicContact CH2-CG 3.68Å; W216-K226 HydrophobicContact CZ3-CB 3.83Å; W216-K226 HydrophobicContact CZ3-CG 4.05Å; W216-F287 AromaticContact CH2-CE2 3.81Å; W216-F287 HydrophobicContact CH2-CE2 3.81Å; W216-F287 AromaticContact CH2-CZ 3.58Å; W216-F287 HydrophobicContact CH2-CZ 3.58Å; W216-F287 HydrophobicContact CZ2-CE2 4.37Å; W216-F287 AromaticContact CZ2-CZ 3.77Å; W216-F287 HydrophobicContact CZ2-CZ 3.77Å
217	K	91.9	Very high	93.8	Very high	139 Å²	139	72 Å²	72	60%	0.604	35%	0.351	S	S	*	.	H	α-helix	trans	-78.1	-41.6	176	-70.9	177.3	178.9	-176.7	0	112.5	K213 N214 L215 R223	K213-K217 WeakPolarHBondContact O-CG 3.37Å; K213-K217 PolarHBondContact O-N 3.05Å; N214-K217 WeakPolarHBondContact O-CB 3.3Å; N214-K217 PolarHBondContact O-N 3.46Å; N214-K217 VanDerWaalsContact O-N 3.11Å; L215-K217 PolarHBondContact O-N 3.31Å; K217-R223 VanDerWaalsContact C-NH1 3.33Å; K217-R223 PolarHBondContact O-NH1 3.39Å
218	S	92.9	Very high	94	Very high	80 Å²	80	74.8 Å²	74.8	56%	0.559	36%	0.361	S	S	*	.	H	α-helix	trans	-93.4	-13.5	-169.5	61.9	0	0	0	0	115.1	N214 L215 P220	N214-S218 WeakPolarHBondContact O-CB 3.4Å; N214-S218 PolarHBondContact O-N 3.33Å; N214-S218 PolarHBondContact O-OG 2.96Å; L215-S218 PolarHBondContact O-N 3.4Å; S218-P220 VanDerWaalsContact O-CD 3.32Å; S218-P220 WeakPolarHBondContact O-CD 3.43Å
219	N	94.4	Very high	94.3	Very high	38 Å²	38	71.3 Å²	71.3	20%	0.203	35%	0.348	C	S	.	.			trans	-114.5	95.1	-176.4	-66.6	-88.6	0	0	0	111.9	L215 K221 L222 L294	L215-N219 WeakPolarHBondContact CA-ND2 3.26Å; L215-N219 VanDerWaalsContact CD2-ND2 3.34Å; L215-N219 WeakPolarHBondContact CD2-ND2 3.36Å; L215-N219 VanDerWaalsContact O-CB 3.31Å; L215-N219 WeakPolarHBondContact O-CB 3.48Å; L215-N219 PolarHBondContact O-N 2.96Å; L215-N219 PolarHBondContact O-ND2 2.78Å; L215-N219 VanDerWaalsContact O-ND2 3.08Å; N219-K221 VanDerWaalsContact C-N 3.29Å; N219-K221 PolarHBondContact O-N 3.18Å; N219-L222 HydrophobicContact CB-CB 3.93Å; N219-L222 WeakPolarHBondContact O-CB 3.32Å; N219-L222 PolarHBondContact O-N 3.43Å; N219-L222 VanDerWaalsContact O-N 3.15Å; N219-L294 HydrophobicContact CB-CD1 4.48Å
220	P	94.3	Very high	94.6	Very high	71 Å²	71	69.9 Å²	69.9	46%	0.461	34%	0.343	S	S	.	.	H	α-helix	trans	-54.7	-43.8	175.2	-23.7	32.1	0	0	0	112.6	S218 L222 R223 D224	S218-P220 VanDerWaalsContact O-CD 3.32Å; S218-P220 WeakPolarHBondContact O-CD 3.43Å; P220-L222 PolarHBondContact O-N 3.48Å; P220-R223 WeakPolarHBondContact O-CA 3.42Å; P220-R223 WeakPolarHBondContact O-CB 3.27Å; P220-R223 PolarHBondContact O-N 2.81Å; P220-D224 VanDerWaalsContact O-CG 3.29Å; P220-D224 PolarHBondContact O-N 3Å
221	K	95.2	Very high	94.7	Very high	123 Å²	123	71 Å²	71	54%	0.535	34%	0.341	S	S	.	.	H	α-helix	trans	-56.5	-36.4	178.8	-175.9	174.5	179	-179.8	0	113.4	N219 R223 D224 M225 F290	N219-K221 VanDerWaalsContact C-N 3.29Å; N219-K221 PolarHBondContact O-N 3.18Å; K221-R223 VanDerWaalsContact C-N 3.32Å; K221-D224 PolarHBondContact O-N 3.21Å; K221-M225 HydrophobicContact CG-CG 4.39Å; K221-M225 HydrophobicContact CG-SD 4.2Å; K221-M225 WeakPolarHBondContact O-CB 3.43Å; K221-M225 VanDerWaalsContact O-CG 3.29Å; K221-M225 WeakPolarHBondContact O-CG 3.36Å; K221-M225 PolarHBondContact O-N 2.92Å; K221-F290 HydrophobicContact CB-CE1 4.47Å; K221-F290 HydrophobicContact CB-CZ 4.49Å; K221-F290 HydrophobicContact CD-CE1 4.35Å; K221-F290 HydrophobicContact CD-CE2 4.22Å; K221-F290 HydrophobicContact CD-CZ 3.84Å; K221-F290 HydrophobicContact CG-CE1 4.23Å; K221-F290 HydrophobicContact CG-CZ 4.19Å
222	L	94.2	Very high	94.7	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-41.1	176.8	-175.5	70.6	0	0	0	110.8	L215 W216 N219 P220 K226 F287 F290 L291	L215-L222 HydrophobicContact CB-CD2 4.38Å; W216-L222 HydrophobicContact CD2-CD2 3.75Å; W216-L222 HydrophobicContact CD2-CG 4.42Å; W216-L222 HydrophobicContact CE3-CD2 3.87Å; W216-L222 HydrophobicContact CE3-CG 4.09Å; W216-L222 HydrophobicContact CG-CD2 4.18Å; W216-L222 HydrophobicContact CH2-CD2 4.47Å; W216-L222 HydrophobicContact CH2-CG 4.23Å; W216-L222 HydrophobicContact CZ2-CD2 4.37Å; W216-L222 HydrophobicContact CZ3-CD2 4.23Å; W216-L222 HydrophobicContact CZ3-CG 4Å; N219-L222 HydrophobicContact CB-CB 3.93Å; N219-L222 WeakPolarHBondContact O-CB 3.32Å; N219-L222 PolarHBondContact O-N 3.43Å; N219-L222 VanDerWaalsContact O-N 3.15Å; P220-L222 PolarHBondContact O-N 3.48Å; L222-K226 WeakPolarHBondContact O-CB 3.5Å; L222-K226 PolarHBondContact O-N 2.88Å; L222-F287 HydrophobicContact CD1-CD2 4.26Å; L222-F287 HydrophobicContact CD1-CE2 3.61Å; L222-F287 HydrophobicContact CD1-CZ 4.28Å; L222-F287 HydrophobicContact CG-CE2 4.2Å; L222-F290 HydrophobicContact CB-CE1 4.34Å; L222-F290 HydrophobicContact CD1-CD1 3.98Å; L222-F290 HydrophobicContact CD1-CE1 4.4Å; L222-L291 HydrophobicContact CD1-CB 4.04Å; L222-L291 HydrophobicContact CD1-CD1 4.03Å; L222-L291 HydrophobicContact CD2-CD1 3.99Å
223	R	94.2	Very high	94.9	Very high	108 Å²	108	73.8 Å²	73.8	41%	0.408	35%	0.35	S	S	.	.	H	α-helix	trans	-67.2	-41.9	175.6	-63.7	-173.5	-66.9	-108.1	5.3	111.9	W216 K217 P220 K221 K226 K227	W216-R223 HydrophobicContact CE3-CG 4.02Å; W216-R223 HydrophobicContact CZ3-CG 4.32Å; W216-R223 PolarHBondContact O-NH1 3.14Å; K217-R223 VanDerWaalsContact C-NH1 3.33Å; K217-R223 PolarHBondContact O-NH1 3.39Å; P220-R223 WeakPolarHBondContact O-CA 3.42Å; P220-R223 WeakPolarHBondContact O-CB 3.27Å; P220-R223 PolarHBondContact O-N 2.81Å; K221-R223 VanDerWaalsContact C-N 3.32Å; R223-K226 PolarHBondContact O-N 3.21Å; R223-K227 WeakPolarHBondContact O-CB 3.5Å; R223-K227 PolarHBondContact O-N 3.38Å
224	D	95.6	Very high	95.1	Very high	101 Å²	101	73.3 Å²	73.3	54%	0.54	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-45.8	179.2	-59.5	-26.4	0	0	0	111	P220 K221 K226 K227 E228	P220-D224 VanDerWaalsContact O-CG 3.29Å; P220-D224 PolarHBondContact O-N 3Å; K221-D224 PolarHBondContact O-N 3.21Å; D224-K226 VanDerWaalsContact C-N 3.33Å; D224-K226 PolarHBondContact O-N 2.96Å; D224-K227 WeakPolarHBondContact O-CB 3.04Å; D224-K227 PolarHBondContact O-N 3.11Å; D224-E228 PolarHBondContact O-N 2.97Å
225	M	96.8	Very high	95.1	Very high	34 Å²	34	72.2 Å²	72.2	17%	0.167	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-38	175.8	-70.5	179.7	75	0	0	112.3	K221 E228 V229 N286 F287 F290	K221-M225 HydrophobicContact CG-CG 4.39Å; K221-M225 HydrophobicContact CG-SD 4.2Å; K221-M225 WeakPolarHBondContact O-CB 3.43Å; K221-M225 VanDerWaalsContact O-CG 3.29Å; K221-M225 WeakPolarHBondContact O-CG 3.36Å; K221-M225 PolarHBondContact O-N 2.92Å; M225-E228 PolarHBondContact O-N 3.15Å; M225-V229 WeakPolarHBondContact O-CG2 3.49Å; M225-V229 PolarHBondContact O-N 3.48Å; M225-V229 VanDerWaalsContact O-N 3.08Å; M225-N286 HydrophobicContact CE-CB 4.13Å; M225-F287 HydrophobicContact CB-CD2 3.99Å; M225-F290 HydrophobicContact CE-CB 4.06Å; M225-F290 HydrophobicContact CE-CG 4.49Å; M225-F290 HydrophobicContact SD-CB 4.08Å; M225-F290 HydrophobicContact SD-CD1 3.78Å; M225-F290 HydrophobicContact SD-CE1 4.38Å; M225-F290 HydrophobicContact SD-CG 3.89Å
226	K	96.1	Very high	95.2	Very high	55 Å²	55	74.4 Å²	74.4	24%	0.239	35%	0.35	C	S	.	.	H	α-helix	trans	-64.8	-44.1	175.5	-179.9	57	173.3	130.5	0	111.6	W216 L222 R223 D224 E228 V229 D230 F287	W216-K226 HydrophobicContact CH2-CB 3.7Å; W216-K226 HydrophobicContact CH2-CD 4.2Å; W216-K226 HydrophobicContact CH2-CG 3.68Å; W216-K226 HydrophobicContact CZ3-CB 3.83Å; W216-K226 HydrophobicContact CZ3-CG 4.05Å; L222-K226 WeakPolarHBondContact O-CB 3.5Å; L222-K226 PolarHBondContact O-N 2.88Å; R223-K226 PolarHBondContact O-N 3.21Å; D224-K226 VanDerWaalsContact C-N 3.33Å; D224-K226 PolarHBondContact O-N 2.96Å; K226-E228 VanDerWaalsContact C-N 3.33Å; K226-E228 PolarHBondContact O-N 3.34Å; K226-V229 PolarHBondContact O-N 3.24Å; K226-D230 VanDerWaalsContact CE-OD2 3.26Å; K226-D230 WeakPolarHBondContact CE-OD2 3.46Å; K226-D230 IonicContact NZ-OD1 3.62Å; K226-D230 PolarHBondContact NZ-OD1 3.43Å; K226-D230 IonicContact NZ-OD2 3.79Å; K226-D230 PolarHBondContact NZ-OD2 3.49Å; K226-D230 PolarHBondContact O-N 3.08Å; K226-F287 HydrophobicContact CB-CD2 4.31Å; K226-F287 HydrophobicContact CB-CE2 3.77Å; K226-F287 HydrophobicContact CB-CZ 4.31Å; K226-F287 HydrophobicContact CD-CE1 4.38Å; K226-F287 HydrophobicContact CD-CE2 4.3Å; K226-F287 HydrophobicContact CD-CZ 4.06Å
227	K	95.9	Very high	95.4	Very high	124 Å²	124	76.3 Å²	76.3	54%	0.539	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-44.3	176.1	-169.9	177.1	-173.1	-90.5	0	111.2	R223 D224 V229 D230 E231	R223-K227 WeakPolarHBondContact O-CB 3.5Å; R223-K227 PolarHBondContact O-N 3.38Å; D224-K227 WeakPolarHBondContact O-CB 3.04Å; D224-K227 PolarHBondContact O-N 3.11Å; K227-V229 PolarHBondContact O-N 3.35Å; K227-D230 PolarHBondContact O-N 3.3Å; K227-E231 WeakPolarHBondContact CE-OE1 3.32Å; K227-E231 HydrophobicContact CG-CG 4.42Å; K227-E231 WeakPolarHBondContact CG-OE1 3.42Å; K227-E231 IonicContact NZ-OE1 2.65Å; K227-E231 PolarHBondContact NZ-OE1 2.98Å; K227-E231 WeakPolarHBondContact O-CB 3.36Å; K227-E231 VanDerWaalsContact O-CG 3.31Å; K227-E231 WeakPolarHBondContact O-CG 3.39Å; K227-E231 PolarHBondContact O-N 3.39Å
228	E	95.5	Very high	95.6	Very high	92 Å²	92	74.1 Å²	74.1	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-60.4	-43.3	175.8	-176.4	-179	-178.1	0	0	112.2	D224 M225 K226 D230 M232	D224-E228 PolarHBondContact O-N 2.97Å; M225-E228 PolarHBondContact O-N 3.15Å; K226-E228 VanDerWaalsContact C-N 3.33Å; K226-E228 PolarHBondContact O-N 3.34Å; E228-D230 VanDerWaalsContact C-N 3.34Å; E228-D230 PolarHBondContact O-N 3.29Å; E228-M232 HydrophobicContact CG-CE 3.77Å; E228-M232 WeakPolarHBondContact O-CB 3.39Å; E228-M232 WeakPolarHBondContact O-CG 3.36Å; E228-M232 PolarHBondContact O-N 2.96Å; E228-M232 VanDerWaalsContact OE1-CE 3.31Å; E228-M232 WeakPolarHBondContact OE1-CE 3.46Å
229	V	97	Very high	95.8	Very high	1 Å²	1	72.4 Å²	72.4	1%	0.006	34%	0.339	C	S	.	.	H	α-helix	trans	-62	-42.4	175.1	168.2	0	0	0	0	111.4	M225 K226 K227 R233 L280 F287	M225-V229 WeakPolarHBondContact O-CG2 3.49Å; M225-V229 PolarHBondContact O-N 3.48Å; M225-V229 VanDerWaalsContact O-N 3.08Å; K226-V229 PolarHBondContact O-N 3.24Å; K227-V229 PolarHBondContact O-N 3.35Å; V229-R233 WeakPolarHBondContact O-CB 3.36Å; V229-R233 PolarHBondContact O-N 3.22Å; V229-L280 HydrophobicContact CG1-CD1 4.16Å; V229-L280 WeakPolarHBondContact O-CD1 3.06Å; V229-F287 HydrophobicContact CG2-CB 4.08Å
230	D	96.7	Very high	96	Very high	62 Å²	62	72.8 Å²	72.8	33%	0.332	34%	0.341	S	S	.	.	H	α-helix	trans	-69.8	-41.6	-179.1	-69.3	-25.8	0	0	0	111.7	K226 K227 E228 R233 E234	K226-D230 VanDerWaalsContact CE-OD2 3.26Å; K226-D230 WeakPolarHBondContact CE-OD2 3.46Å; K226-D230 IonicContact NZ-OD1 3.62Å; K226-D230 PolarHBondContact NZ-OD1 3.43Å; K226-D230 IonicContact NZ-OD2 3.79Å; K226-D230 PolarHBondContact NZ-OD2 3.49Å; K226-D230 PolarHBondContact O-N 3.08Å; K227-D230 PolarHBondContact O-N 3.3Å; E228-D230 VanDerWaalsContact C-N 3.34Å; E228-D230 PolarHBondContact O-N 3.29Å; D230-R233 WeakPolarHBondContact O-CB 3.49Å; D230-R233 PolarHBondContact O-N 3.33Å; D230-E234 PolarHBondContact O-N 3.34Å
231	E	96.1	Very high	96.1	Very high	88 Å²	88	77 Å²	77	41%	0.411	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-42.2	174.1	-72.6	171.6	179.6	0	0	111.6	K227 R233 E234 I235	K227-E231 WeakPolarHBondContact CE-OE1 3.32Å; K227-E231 HydrophobicContact CG-CG 4.42Å; K227-E231 WeakPolarHBondContact CG-OE1 3.42Å; K227-E231 IonicContact NZ-OE1 2.65Å; K227-E231 PolarHBondContact NZ-OE1 2.98Å; K227-E231 WeakPolarHBondContact O-CB 3.36Å; K227-E231 VanDerWaalsContact O-CG 3.31Å; K227-E231 WeakPolarHBondContact O-CG 3.39Å; K227-E231 PolarHBondContact O-N 3.39Å; E231-R233 VanDerWaalsContact C-N 3.29Å; E231-R233 PolarHBondContact O-N 3.07Å; E231-E234 PolarHBondContact O-N 3.47Å; E231-I235 WeakPolarHBondContact O-CG1 3.39Å; E231-I235 PolarHBondContact O-N 3.26Å; E231-I235 VanDerWaalsContact O-N 3.14Å
232	M	95	Very high	96.2	Very high	32 Å²	32	73.9 Å²	73.9	16%	0.158	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-33.4	174.8	-74.6	-174.6	-171.3	0	0	112.9	E228 Y236 K279 L280 S283	E228-M232 HydrophobicContact CG-CE 3.77Å; E228-M232 WeakPolarHBondContact O-CB 3.39Å; E228-M232 WeakPolarHBondContact O-CG 3.36Å; E228-M232 PolarHBondContact O-N 2.96Å; E228-M232 VanDerWaalsContact OE1-CE 3.31Å; E228-M232 WeakPolarHBondContact OE1-CE 3.46Å; M232-Y236 WeakPolarHBondContact O-CB 3.41Å; M232-Y236 PolarHBondContact O-N 3.5Å; M232-Y236 VanDerWaalsContact O-N 3.07Å; M232-K279 HydrophobicContact SD-CB 4.03Å; M232-L280 HydrophobicContact CB-CD1 4.04Å; M232-S283 PolarHBondContact SD-OG 3.4Å
233	R	96.7	Very high	96.4	Very high	90 Å²	90	74.8 Å²	74.8	34%	0.34	34%	0.342	S	S	.	.	H	α-helix	trans	-70	-44	177.3	-173.6	-178.5	-58.1	-164.7	-2.1	111.3	V229 D230 E231 I235 Y236 E237 L280	V229-R233 WeakPolarHBondContact O-CB 3.36Å; V229-R233 PolarHBondContact O-N 3.22Å; D230-R233 WeakPolarHBondContact O-CB 3.49Å; D230-R233 PolarHBondContact O-N 3.33Å; E231-R233 VanDerWaalsContact C-N 3.29Å; E231-R233 PolarHBondContact O-N 3.07Å; R233-I235 PolarHBondContact O-N 2.95Å; R233-Y236 WeakPolarHBondContact O-CB 3.43Å; R233-Y236 PolarHBondContact O-N 2.61Å; R233-E237 HydrophobicContact CG-CG 4.49Å; R233-E237 WeakPolarHBondContact CG-OE1 3.45Å; R233-E237 WeakPolarHBondContact O-CG 3.41Å; R233-E237 PolarHBondContact O-N 3.14Å; R233-L280 HydrophobicContact CB-CD1 4.07Å; R233-L280 HydrophobicContact CB-CD2 4.4Å; R233-L280 HydrophobicContact CG-CD2 4.46Å
234	E	96.4	Very high	96.5	Very high	122 Å²	122	73.6 Å²	73.6	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-58	-47.9	176.1	-171	174.4	-171.5	0	0	110.8	D230 E231 Y236 E237 D238	D230-E234 PolarHBondContact O-N 3.34Å; E231-E234 PolarHBondContact O-N 3.47Å; E234-Y236 VanDerWaalsContact C-N 3.32Å; E234-Y236 PolarHBondContact O-N 2.87Å; E234-E237 PolarHBondContact O-N 3.23Å; E234-E237 VanDerWaalsContact O-N 3.15Å; E234-D238 PolarHBondContact O-N 3.5Å
235	I	95.9	Very high	96.6	Very high	60 Å²	60	70.9 Å²	70.9	31%	0.308	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-39.6	176.5	-62.3	164.1	0	0	0	111.9	E231 R233 Y239 Y276	E231-I235 WeakPolarHBondContact O-CG1 3.39Å; E231-I235 PolarHBondContact O-N 3.26Å; E231-I235 VanDerWaalsContact O-N 3.14Å; R233-I235 PolarHBondContact O-N 2.95Å; I235-Y239 HydrophobicContact CG2-CD2 3.77Å; I235-Y239 HydrophobicContact CG2-CE2 3.5Å; I235-Y239 VanDerWaalsContact CG2-CE2 3.5Å; I235-Y239 VanDerWaalsContact O-CD2 3.27Å; I235-Y239 WeakPolarHBondContact O-CD2 3.2Å; I235-Y239 PolarHBondContact O-N 3.47Å; I235-Y239 VanDerWaalsContact O-N 3.08Å; I235-Y276 HydrophobicContact CB-CD1 4.22Å; I235-Y276 HydrophobicContact CB-CE1 3.85Å; I235-Y276 HydrophobicContact CD1-CE1 3.94Å; I235-Y276 HydrophobicContact CG2-CD1 4Å; I235-Y276 HydrophobicContact CG2-CD2 4.21Å; I235-Y276 HydrophobicContact CG2-CE1 3.56Å; I235-Y276 HydrophobicContact CG2-CE2 3.79Å; I235-Y276 HydrophobicContact CG2-CG 4.3Å; I235-Y276 VanDerWaalsContact CG2-CZ 3.43Å
236	Y	95.9	Very high	96.6	Very high	68 Å²	68	69.7 Å²	69.7	27%	0.267	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-42.3	175.5	168.6	-93.8	0	0	0	112.1	M232 R233 E234 N240 I273 T277	M232-Y236 WeakPolarHBondContact O-CB 3.41Å; M232-Y236 PolarHBondContact O-N 3.5Å; M232-Y236 VanDerWaalsContact O-N 3.07Å; R233-Y236 WeakPolarHBondContact O-CB 3.43Å; R233-Y236 PolarHBondContact O-N 2.61Å; E234-Y236 VanDerWaalsContact C-N 3.32Å; E234-Y236 PolarHBondContact O-N 2.87Å; Y236-N240 WeakPolarHBondContact CE1-ND2 3.5Å; Y236-N240 WeakPolarHBondContact CE2-ND2 3.42Å; Y236-N240 PolarHBondContact O-N 2.89Å; Y236-N240 VanDerWaalsContact O-N 3.16Å; Y236-N240 PolarHBondContact O-ND2 3.41Å; Y236-I273 HydrophobicContact CD2-CG2 4.35Å; Y236-I273 HydrophobicContact CE2-CG2 3.75Å; Y236-T277 VanDerWaalsContact CE2-OG1 3.31Å; Y236-T277 WeakPolarHBondContact CE2-OG1 3.49Å
237	E	95.9	Very high	96.6	Very high	114 Å²	114	69.8 Å²	69.8	53%	0.533	33%	0.327	S	S	.	.	H	α-helix	trans	-66.8	-42.5	178.4	-73.1	174.1	-173.3	0	0	111.3	R233 E234 Y239 N240 W241	R233-E237 HydrophobicContact CG-CG 4.49Å; R233-E237 WeakPolarHBondContact CG-OE1 3.45Å; R233-E237 WeakPolarHBondContact O-CG 3.41Å; R233-E237 PolarHBondContact O-N 3.14Å; E234-E237 PolarHBondContact O-N 3.23Å; E234-E237 VanDerWaalsContact O-N 3.15Å; E237-Y239 PolarHBondContact O-N 2.94Å; E237-N240 PolarHBondContact O-N 3.17Å; E237-W241 PolarHBondContact O-N 3.36Å
238	D	97.3	Very high	96.6	Very high	94 Å²	94	68.6 Å²	68.6	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-58.9	-47.2	175.2	-79.2	-12.6	0	0	0	111.8	E234 N240 W241 D242	E234-D238 PolarHBondContact O-N 3.5Å; D238-N240 VanDerWaalsContact C-N 3.32Å; D238-N240 PolarHBondContact O-N 3.39Å; D238-W241 WeakPolarHBondContact O-CB 3.3Å; D238-W241 PolarHBondContact O-N 3.48Å; D238-W241 VanDerWaalsContact O-N 3.15Å; D238-D242 PolarHBondContact O-N 3.04Å
239	Y	97.6	Very high	96.7	Very high	43 Å²	43	69.6 Å²	69.6	17%	0.169	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-35.4	177.5	-76.5	-47.9	0	0	0	113.3	I235 E237 W241 L243 Y268 F269 E272 Y276	I235-Y239 HydrophobicContact CG2-CD2 3.77Å; I235-Y239 HydrophobicContact CG2-CE2 3.5Å; I235-Y239 VanDerWaalsContact CG2-CE2 3.5Å; I235-Y239 VanDerWaalsContact O-CD2 3.27Å; I235-Y239 WeakPolarHBondContact O-CD2 3.2Å; I235-Y239 PolarHBondContact O-N 3.47Å; I235-Y239 VanDerWaalsContact O-N 3.08Å; E237-Y239 PolarHBondContact O-N 2.94Å; Y239-W241 VanDerWaalsContact C-N 3.33Å; Y239-L243 VanDerWaalsContact O-CB 3.3Å; Y239-L243 WeakPolarHBondContact O-CB 3.26Å; Y239-L243 PolarHBondContact O-N 3.08Å; Y239-Y268 HydrophobicContact CE1-CE1 4.44Å; Y239-F269 AromaticContact CD1-CD1 3.65Å; Y239-F269 HydrophobicContact CD1-CD1 3.65Å; Y239-F269 HydrophobicContact CD1-CE1 4.07Å; Y239-F269 HydrophobicContact CE1-CD1 4.13Å; Y239-F269 HydrophobicContact CE1-CE1 4.31Å; Y239-E272 HydrophobicContact CD1-CB 4.3Å; Y239-E272 HydrophobicContact CD2-CB 3.86Å; Y239-E272 HydrophobicContact CE1-CB 4.16Å; Y239-E272 HydrophobicContact CE1-CG 4.25Å; Y239-E272 HydrophobicContact CE2-CB 3.7Å; Y239-E272 HydrophobicContact CE2-CG 4.22Å; Y239-E272 HydrophobicContact CG-CB 4.15Å; Y239-Y276 HydrophobicContact CD2-CD2 4.08Å; Y239-Y276 HydrophobicContact CD2-CE2 4.39Å; Y239-Y276 AromaticContact CE2-CD2 3.77Å; Y239-Y276 HydrophobicContact CE2-CD2 3.77Å; Y239-Y276 AromaticContact CE2-CE2 3.66Å; Y239-Y276 HydrophobicContact CE2-CE2 3.66Å
240	N	97	Very high	96.5	Very high	46 Å²	46	70 Å²	70	25%	0.246	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-39.3	173.6	-83	-67.1	0	0	0	111.9	Y236 E237 D238 T244	Y236-N240 WeakPolarHBondContact CE1-ND2 3.5Å; Y236-N240 WeakPolarHBondContact CE2-ND2 3.42Å; Y236-N240 PolarHBondContact O-N 2.89Å; Y236-N240 VanDerWaalsContact O-N 3.16Å; Y236-N240 PolarHBondContact O-ND2 3.41Å; E237-N240 PolarHBondContact O-N 3.17Å; D238-N240 VanDerWaalsContact C-N 3.32Å; D238-N240 PolarHBondContact O-N 3.39Å; N240-T244 WeakPolarHBondContact O-CB 3.46Å; N240-T244 PolarHBondContact O-N 2.93Å; N240-T244 PolarHBondContact O-OG1 3.32Å
241	W	97.7	Very high	96.4	Very high	160 Å²	160	75.5 Å²	75.5	61%	0.606	34%	0.344	S	S	*	.	H	α-helix	trans	-64.7	-48.8	175.5	-173.8	92.9	0	0	0	111.3	E237 D238 Y239 L243 T244 E245	E237-W241 PolarHBondContact O-N 3.36Å; D238-W241 WeakPolarHBondContact O-CB 3.3Å; D238-W241 PolarHBondContact O-N 3.48Å; D238-W241 VanDerWaalsContact O-N 3.15Å; Y239-W241 VanDerWaalsContact C-N 3.33Å; W241-L243 VanDerWaalsContact C-N 3.33Å; W241-L243 PolarHBondContact O-N 2.85Å; W241-T244 WeakPolarHBondContact O-CB 3.45Å; W241-T244 PolarHBondContact O-N 3.28Å; W241-T244 VanDerWaalsContact O-N 3.13Å; W241-E245 HydrophobicContact CD2-CG 4.21Å; W241-E245 HydrophobicContact CE3-CG 4.39Å; W241-E245 HydrophobicContact CH2-CB 4.49Å; W241-E245 HydrophobicContact CH2-CG 3.91Å; W241-E245 HydrophobicContact CZ2-CG 3.71Å; W241-E245 HydrophobicContact CZ3-CB 4.45Å; W241-E245 HydrophobicContact CZ3-CG 4.24Å; W241-E245 PolarHBondContact O-N 3.28Å
242	D	97.5	Very high	96.4	Very high	58 Å²	58	77.4 Å²	77.4	31%	0.31	36%	0.357	S	S	.	.	H	α-helix	trans	-60.1	-41.2	177.8	-87.9	-18.3	0	0	0	112.1	D238 T246 F269	D238-D242 PolarHBondContact O-N 3.04Å; D242-T246 WeakPolarHBondContact O-CB 3.49Å; D242-T246 PolarHBondContact O-N 3.44Å; D242-T246 PolarHBondContact O-OG1 3.21Å; D242-F269 HydrophobicContact CB-CD1 4.15Å; D242-F269 HydrophobicContact CB-CD2 4.21Å; D242-F269 HydrophobicContact CB-CE1 3.84Å; D242-F269 HydrophobicContact CB-CE2 3.93Å; D242-F269 HydrophobicContact CB-CG 4.33Å; D242-F269 HydrophobicContact CB-CZ 3.73Å
243	L	98	Very high	96.3	Very high	19 Å²	19	77 Å²	77	10%	0.099	36%	0.356	C	S	.	.	H	α-helix	trans	-58.4	-51.2	173.1	174.5	60.1	0	0	0	110.8	Y239 W241 E245 T246 E247 A266 F269 K270 I273	Y239-L243 VanDerWaalsContact O-CB 3.3Å; Y239-L243 WeakPolarHBondContact O-CB 3.26Å; Y239-L243 PolarHBondContact O-N 3.08Å; W241-L243 VanDerWaalsContact C-N 3.33Å; W241-L243 PolarHBondContact O-N 2.85Å; L243-E245 PolarHBondContact O-N 3.39Å; L243-T246 PolarHBondContact O-N 3.04Å; L243-E247 HydrophobicContact CD1-CG 3.86Å; L243-E247 HydrophobicContact CG-CG 4.5Å; L243-E247 WeakPolarHBondContact O-CG 3.47Å; L243-E247 PolarHBondContact O-N 3.42Å; L243-A266 HydrophobicContact CD1-CB 3.73Å; L243-A266 WeakPolarHBondContact CD1-O 3.14Å; L243-F269 HydrophobicContact CB-CB 3.88Å; L243-F269 HydrophobicContact CD1-CB 4.24Å; L243-K270 HydrophobicContact CD1-CG 4Å; L243-K270 HydrophobicContact CD2-CG 3.83Å; L243-I273 HydrophobicContact CB-CD1 3.99Å; L243-I273 HydrophobicContact CD2-CD1 3.54Å; L243-I273 HydrophobicContact CG-CD1 4.39Å
244	T	96.9	Very high	96.1	Very high	82 Å²	82	78.4 Å²	78.4	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-47.6	-176.9	-60.5	0	0	0	0	111.3	N240 W241 K248	N240-T244 WeakPolarHBondContact O-CB 3.46Å; N240-T244 PolarHBondContact O-N 2.93Å; N240-T244 PolarHBondContact O-OG1 3.32Å; W241-T244 WeakPolarHBondContact O-CB 3.45Å; W241-T244 PolarHBondContact O-N 3.28Å; W241-T244 VanDerWaalsContact O-N 3.13Å; T244-K248 VanDerWaalsContact O-CB 3.31Å; T244-K248 WeakPolarHBondContact O-CB 3.39Å; T244-K248 PolarHBondContact O-N 2.8Å
245	E	97.3	Very high	96.1	Very high	44 Å²	44	76.4 Å²	76.4	21%	0.206	37%	0.373	C	S	.	.	H	α-helix	trans	-69	-34.6	179	-79.6	-63.3	126.6	0	0	112.3	W241 L243 K248 K249	W241-E245 HydrophobicContact CD2-CG 4.21Å; W241-E245 HydrophobicContact CE3-CG 4.39Å; W241-E245 HydrophobicContact CH2-CB 4.49Å; W241-E245 HydrophobicContact CH2-CG 3.91Å; W241-E245 HydrophobicContact CZ2-CG 3.71Å; W241-E245 HydrophobicContact CZ3-CB 4.45Å; W241-E245 HydrophobicContact CZ3-CG 4.24Å; W241-E245 PolarHBondContact O-N 3.28Å; L243-E245 PolarHBondContact O-N 3.39Å; E245-K248 PolarHBondContact O-N 2.99Å; E245-K248 IonicContact OE1-NZ 2.78Å; E245-K248 PolarHBondContact OE1-NZ 3.44Å; E245-K248 IonicContact OE2-NZ 2.93Å; E245-K249 WeakPolarHBondContact O-CB 3.42Å; E245-K249 VanDerWaalsContact O-CG 3.26Å; E245-K249 WeakPolarHBondContact O-CG 3.2Å; E245-K249 PolarHBondContact O-N 3.46Å
246	T	96.9	Very high	96	Very high	10 Å²	10	77.5 Å²	77.5	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-67.5	-46.4	176.2	-61.9	0	0	0	0	111.8	D242 L243 K248 K249 A250 L262 Q265 A266 F269	D242-T246 WeakPolarHBondContact O-CB 3.49Å; D242-T246 PolarHBondContact O-N 3.44Å; D242-T246 PolarHBondContact O-OG1 3.21Å; L243-T246 PolarHBondContact O-N 3.04Å; T246-K248 VanDerWaalsContact C-N 3.3Å; T246-K248 PolarHBondContact O-N 3.28Å; T246-K249 PolarHBondContact O-N 2.86Å; T246-A250 WeakPolarHBondContact O-CB 3.47Å; T246-A250 PolarHBondContact O-N 3.45Å; T246-L262 HydrophobicContact CG2-CB 4.19Å; T246-L262 HydrophobicContact CG2-CD2 4Å; T246-L262 VanDerWaalsContact CG2-O 3.24Å; T246-L262 WeakPolarHBondContact CG2-O 3.49Å; T246-Q265 HydrophobicContact CG2-CB 3.92Å; T246-A266 HydrophobicContact CG2-CB 4.21Å; T246-F269 HydrophobicContact CG2-CE2 4.41Å; T246-F269 WeakPolarHBondContact OG1-CE2 3.43Å
247	E	96	Very high	95.9	Very high	56 Å²	56	82.9 Å²	82.9	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-64.6	-34.9	176.6	-73.3	-171.8	155.6	0	0	112.2	L243 A250 R251 A266 K270	L243-E247 HydrophobicContact CD1-CG 3.86Å; L243-E247 HydrophobicContact CG-CG 4.5Å; L243-E247 WeakPolarHBondContact O-CG 3.47Å; L243-E247 PolarHBondContact O-N 3.42Å; E247-A250 PolarHBondContact O-N 3.23Å; E247-R251 WeakPolarHBondContact O-CG 3.28Å; E247-R251 PolarHBondContact O-N 2.81Å; E247-R251 PolarHBondContact O-NE 2.93Å; E247-A266 HydrophobicContact CG-CB 3.87Å; E247-K270 WeakPolarHBondContact OE1-CE 3.41Å; E247-K270 IonicContact OE1-NZ 3.53Å; E247-K270 PolarHBondContact OE1-NZ 3Å
248	K	96.2	Very high	95.8	Very high	100 Å²	100	82.9 Å²	82.9	44%	0.435	41%	0.405	S	S	.	.	H	α-helix	trans	-65.4	-45	173.3	179.6	-180	167.6	-166.2	0	111.4	T244 E245 T246 A250 R251 N252	T244-K248 VanDerWaalsContact O-CB 3.31Å; T244-K248 WeakPolarHBondContact O-CB 3.39Å; T244-K248 PolarHBondContact O-N 2.8Å; E245-K248 PolarHBondContact O-N 2.99Å; E245-K248 IonicContact OE1-NZ 2.78Å; E245-K248 PolarHBondContact OE1-NZ 3.44Å; E245-K248 IonicContact OE2-NZ 2.93Å; T246-K248 VanDerWaalsContact C-N 3.3Å; T246-K248 PolarHBondContact O-N 3.28Å; K248-A250 VanDerWaalsContact C-N 3.32Å; K248-A250 PolarHBondContact O-N 3.41Å; K248-R251 PolarHBondContact O-N 3.26Å; K248-N252 WeakPolarHBondContact O-CB 3.45Å; K248-N252 PolarHBondContact O-N 3.03Å; K248-N252 VanDerWaalsContact O-N 3.14Å; K248-N252 PolarHBondContact O-ND2 3.06Å
249	K	96.6	Very high	95.7	Very high	113 Å²	113	83 Å²	83	49%	0.491	40%	0.399	S	S	.	.	H	α-helix	trans	-61.6	-39.8	173.9	-73	167.4	-173.5	167.4	0	111.7	E245 T246 N252 T253 L262	E245-K249 WeakPolarHBondContact O-CB 3.42Å; E245-K249 VanDerWaalsContact O-CG 3.26Å; E245-K249 WeakPolarHBondContact O-CG 3.2Å; E245-K249 PolarHBondContact O-N 3.46Å; T246-K249 PolarHBondContact O-N 2.86Å; K249-N252 PolarHBondContact O-N 2.78Å; K249-T253 PolarHBondContact O-N 3.48Å; K249-T253 VanDerWaalsContact O-N 3.15Å; K249-L262 HydrophobicContact CB-CD1 3.91Å; K249-L262 HydrophobicContact CB-CD2 4.31Å
250	A	94.2	Very high	95.6	Very high	8 Å²	8	84.1 Å²	84.1	7%	0.066	41%	0.41	C	S	.	.	H	α-helix	trans	-63.4	-42.9	178.4	0	0	0	0	0	112	T246 E247 K248 N252 T253 L262	T246-A250 WeakPolarHBondContact O-CB 3.47Å; T246-A250 PolarHBondContact O-N 3.45Å; E247-A250 PolarHBondContact O-N 3.23Å; K248-A250 VanDerWaalsContact C-N 3.32Å; K248-A250 PolarHBondContact O-N 3.41Å; A250-N252 VanDerWaalsContact C-N 3.33Å; A250-N252 PolarHBondContact O-N 3.15Å; A250-T253 WeakPolarHBondContact O-CG2 3.29Å; A250-L262 HydrophobicContact CB-CB 3.79Å; A250-L262 HydrophobicContact CB-CD1 4.35Å
251	R	93.9	Very high	95.6	Very high	179 Å²	179	84.6 Å²	84.6	68%	0.675	41%	0.414	S	S	*	.	H	α-helix	trans	-64.2	-35.7	176	-78.3	-178	-87	-166.7	-7.5	113.1	E247 K248	E247-R251 WeakPolarHBondContact O-CG 3.28Å; E247-R251 PolarHBondContact O-N 2.81Å; E247-R251 PolarHBondContact O-NE 2.93Å; K248-R251 PolarHBondContact O-N 3.26Å
252	N	94.9	Very high	95.5	Very high	128 Å²	128	77.7 Å²	77.7	68%	0.684	39%	0.389	S	S	*	.	H	α-helix	trans	-93.3	-3.6	-172.4	-66.9	-19.1	0	0	0	114.5	K248 K249 A250	K248-N252 WeakPolarHBondContact O-CB 3.45Å; K248-N252 PolarHBondContact O-N 3.03Å; K248-N252 VanDerWaalsContact O-N 3.14Å; K248-N252 PolarHBondContact O-ND2 3.06Å; K249-N252 PolarHBondContact O-N 2.78Å; A250-N252 VanDerWaalsContact C-N 3.33Å; A250-N252 PolarHBondContact O-N 3.15Å
253	T	92.8	Very high	95.4	Very high	22 Å²	22	79.8 Å²	79.8	14%	0.135	40%	0.397	C	S	.	.			trans	-90.7	133.8	176.8	-174.9	0	0	0	0	111.5	K249 A250 D255 R259 L262	K249-T253 PolarHBondContact O-N 3.48Å; K249-T253 VanDerWaalsContact O-N 3.15Å; A250-T253 WeakPolarHBondContact O-CG2 3.29Å; T253-D255 PolarHBondContact OG1-N 3.41Å; T253-R259 HydrophobicContact CG2-CB 3.85Å; T253-R259 HydrophobicContact CG2-CG 4.38Å; T253-R259 PolarHBondContact O-NH2 3.09Å; T253-L262 HydrophobicContact CG2-CD1 4.16Å
254	S	94	Very high	95.3	Very high	120 Å²	120	88 Å²	88	84%	0.839	43%	0.427	S	S	*	.			trans	-84.2	-19.8	171.3	51.7	0	0	0	0	113.1	S256	S254-S256 PolarHBondContact O-N 2.91Å
255	D	96	Very high	95.3	Very high	80 Å²	80	88.4 Å²	88.4	43%	0.428	42%	0.423	S	S	.	.			trans	-72.3	115.4	175.2	179.7	-23.3	0	0	0	110.4	T253 Y257 K258 R259	T253-D255 PolarHBondContact OG1-N 3.41Å; D255-Y257 WeakPolarHBondContact OD1-CA 3.47Å; D255-Y257 WeakPolarHBondContact OD1-CB 3.38Å; D255-Y257 PolarHBondContact OD1-N 2.86Å; D255-K258 HydrophobicContact CB-CB 3.84Å; D255-K258 PolarHBondContact O-N 3.27Å; D255-K258 PolarHBondContact OD1-N 2.84Å; D255-R259 WeakPolarHBondContact O-CB 3.13Å; D255-R259 PolarHBondContact O-N 3.47Å
256	S	93.1	Very high	95.2	Very high	84 Å²	84	86.5 Å²	86.5	59%	0.587	42%	0.415	S	S	*	.	H	α-helix	trans	-67	-36.5	-178.2	58.2	0	0	0	0	113	S254 R259 V260	S254-S256 PolarHBondContact O-N 2.91Å; S256-R259 PolarHBondContact O-N 3.34Å; S256-V260 WeakPolarHBondContact O-CG2 3.5Å; S256-V260 PolarHBondContact O-N 3Å
257	Y	93.4	Very high	95.2	Very high	181 Å²	181	90.8 Å²	90.8	71%	0.71	44%	0.435	S	S	*	.	H	α-helix	trans	-69.3	-43	178	-179.5	-96.3	0	0	0	111	D255 R259 V260 T261	D255-Y257 WeakPolarHBondContact OD1-CA 3.47Å; D255-Y257 WeakPolarHBondContact OD1-CB 3.38Å; D255-Y257 PolarHBondContact OD1-N 2.86Å; Y257-R259 VanDerWaalsContact C-N 3.31Å; Y257-R259 PolarHBondContact O-N 3.35Å; Y257-V260 PolarHBondContact O-N 3.17Å; Y257-T261 PolarHBondContact O-N 2.81Å; Y257-T261 VanDerWaalsContact O-N 3.11Å; Y257-T261 PolarHBondContact O-OG1 2.76Å; Y257-T261 VanDerWaalsContact O-OG1 3.1Å
258	K	95.4	Very high	95.3	Very high	114 Å²	114	93.6 Å²	93.6	50%	0.496	44%	0.443	S	S	.	.	H	α-helix	trans	-62.5	-40	173.9	-170.6	174	-178.6	178	0	111.5	D255 T261 L262	D255-K258 HydrophobicContact CB-CB 3.84Å; D255-K258 PolarHBondContact O-N 3.27Å; D255-K258 PolarHBondContact OD1-N 2.84Å; K258-T261 PolarHBondContact O-N 3.41Å; K258-L262 HydrophobicContact CG-CD1 4.05Å; K258-L262 WeakPolarHBondContact O-CG 3.33Å; K258-L262 PolarHBondContact O-N 3.34Å
259	R	95.5	Very high	95.4	Very high	96 Å²	96	90 Å²	90	36%	0.362	43%	0.428	S	S	.	.	H	α-helix	trans	-58.8	-52.1	176.1	-169.3	-179.6	-59.4	152	5.4	111.7	T253 D255 S256 Y257 T261 L262 E263	T253-R259 HydrophobicContact CG2-CB 3.85Å; T253-R259 HydrophobicContact CG2-CG 4.38Å; T253-R259 PolarHBondContact O-NH2 3.09Å; D255-R259 WeakPolarHBondContact O-CB 3.13Å; D255-R259 PolarHBondContact O-N 3.47Å; S256-R259 PolarHBondContact O-N 3.34Å; Y257-R259 VanDerWaalsContact C-N 3.31Å; Y257-R259 PolarHBondContact O-N 3.35Å; R259-T261 VanDerWaalsContact C-N 3.27Å; R259-T261 PolarHBondContact O-N 2.68Å; R259-L262 PolarHBondContact O-N 3.45Å; R259-L262 VanDerWaalsContact O-N 3.12Å; R259-E263 HydrophobicContact CG-CG 4.44Å; R259-E263 WeakPolarHBondContact CG-OE1 3.39Å; R259-E263 WeakPolarHBondContact O-CG 3.43Å; R259-E263 PolarHBondContact O-N 3.06Å
260	V	94.4	Very high	95.4	Very high	67 Å²	67	88.8 Å²	88.8	41%	0.406	42%	0.422	S	S	.	.	H	α-helix	trans	-59.3	-38.9	179.2	171.8	0	0	0	0	111.7	S256 Y257 E263 R264	S256-V260 WeakPolarHBondContact O-CG2 3.5Å; S256-V260 PolarHBondContact O-N 3Å; Y257-V260 PolarHBondContact O-N 3.17Å; V260-E263 PolarHBondContact O-N 3.47Å; V260-R264 WeakPolarHBondContact O-CG 3.43Å; V260-R264 PolarHBondContact O-N 3.49Å; V260-R264 VanDerWaalsContact O-N 3.09Å
261	T	96.4	Very high	95.6	Very high	55 Å²	55	92.3 Å²	92.3	34%	0.337	44%	0.44	S	S	.	.	H	α-helix	trans	-64.3	-44	176.2	-58.9	0	0	0	0	111.9	Y257 K258 R259 R264 Q265	Y257-T261 PolarHBondContact O-N 2.81Å; Y257-T261 VanDerWaalsContact O-N 3.11Å; Y257-T261 PolarHBondContact O-OG1 2.76Å; Y257-T261 VanDerWaalsContact O-OG1 3.1Å; K258-T261 PolarHBondContact O-N 3.41Å; R259-T261 VanDerWaalsContact C-N 3.27Å; R259-T261 PolarHBondContact O-N 2.68Å; T261-R264 PolarHBondContact O-N 2.76Å; T261-Q265 PolarHBondContact O-N 2.86Å; T261-Q265 VanDerWaalsContact O-N 3.08Å
262	L	97.1	Very high	95.8	Very high	16 Å²	16	85.7 Å²	85.7	8%	0.084	42%	0.417	C	S	.	.	H	α-helix	trans	-67.2	-37.4	177.3	-69.5	164.8	0	0	0	112	T246 K249 A250 T253 K258 R259 R264 Q265 A266	T246-L262 HydrophobicContact CG2-CB 4.19Å; T246-L262 HydrophobicContact CG2-CD2 4Å; T246-L262 VanDerWaalsContact CG2-O 3.24Å; T246-L262 WeakPolarHBondContact CG2-O 3.49Å; K249-L262 HydrophobicContact CB-CD1 3.91Å; K249-L262 HydrophobicContact CB-CD2 4.31Å; A250-L262 HydrophobicContact CB-CB 3.79Å; A250-L262 HydrophobicContact CB-CD1 4.35Å; T253-L262 HydrophobicContact CG2-CD1 4.16Å; K258-L262 HydrophobicContact CG-CD1 4.05Å; K258-L262 WeakPolarHBondContact O-CG 3.33Å; K258-L262 PolarHBondContact O-N 3.34Å; R259-L262 PolarHBondContact O-N 3.45Å; R259-L262 VanDerWaalsContact O-N 3.12Å; L262-R264 VanDerWaalsContact C-N 3.33Å; L262-R264 PolarHBondContact O-N 3.43Å; L262-Q265 PolarHBondContact O-N 3.16Å; L262-A266 PolarHBondContact O-N 2.99Å
263	E	94.2	Very high	95.9	Very high	101 Å²	101	80.5 Å²	80.5	47%	0.472	39%	0.389	S	S	.	.	H	α-helix	trans	-62.4	-40.1	174.8	-73.9	169.6	175.7	0	0	111.7	R259 V260 A266 E267	R259-E263 HydrophobicContact CG-CG 4.44Å; R259-E263 WeakPolarHBondContact CG-OE1 3.39Å; R259-E263 WeakPolarHBondContact O-CG 3.43Å; R259-E263 PolarHBondContact O-N 3.06Å; V260-E263 PolarHBondContact O-N 3.47Å; E263-A266 PolarHBondContact O-N 2.96Å; E263-E267 PolarHBondContact O-N 3.1Å
264	R	95.7	Very high	96.1	Very high	191 Å²	191	83.5 Å²	83.5	72%	0.721	40%	0.404	S	S	*	.	H	α-helix	trans	-65.3	-38.6	173.1	-72.8	177.9	179.6	-177.7	-0.2	112.7	V260 T261 L262 E267 Y268	V260-R264 WeakPolarHBondContact O-CG 3.43Å; V260-R264 PolarHBondContact O-N 3.49Å; V260-R264 VanDerWaalsContact O-N 3.09Å; T261-R264 PolarHBondContact O-N 2.76Å; L262-R264 VanDerWaalsContact C-N 3.33Å; L262-R264 PolarHBondContact O-N 3.43Å; R264-E267 PolarHBondContact O-N 3.31Å; R264-Y268 PolarHBondContact O-N 2.99Å
265	Q	97.1	Very high	96.2	Very high	91 Å²	91	81.4 Å²	81.4	43%	0.425	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-40.8	174	-75.7	178.6	-19	0	0	111.7	T246 T261 L262 E267 Y268 F269	T246-Q265 HydrophobicContact CG2-CB 3.92Å; T261-Q265 PolarHBondContact O-N 2.86Å; T261-Q265 VanDerWaalsContact O-N 3.08Å; L262-Q265 PolarHBondContact O-N 3.16Å; Q265-E267 VanDerWaalsContact C-N 3.29Å; Q265-E267 PolarHBondContact O-N 2.99Å; Q265-Y268 WeakPolarHBondContact O-CB 3.47Å; Q265-Y268 PolarHBondContact O-N 3.25Å; Q265-Y268 VanDerWaalsContact O-N 3.17Å; Q265-F269 HydrophobicContact CB-CE2 4.31Å; Q265-F269 WeakPolarHBondContact O-CD2 3.36Å; Q265-F269 PolarHBondContact O-N 2.76Å
266	A	96.5	Very high	96.2	Very high	5 Å²	5	79.4 Å²	79.4	4%	0.041	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-41	174	0	0	0	0	0	111.5	L243 T246 E247 L262 E263 Y268 F269 K270	L243-A266 HydrophobicContact CD1-CB 3.73Å; L243-A266 WeakPolarHBondContact CD1-O 3.14Å; T246-A266 HydrophobicContact CG2-CB 4.21Å; E247-A266 HydrophobicContact CG-CB 3.87Å; L262-A266 PolarHBondContact O-N 2.99Å; E263-A266 PolarHBondContact O-N 2.96Å; A266-Y268 VanDerWaalsContact C-N 3.35Å; A266-Y268 PolarHBondContact O-N 3.16Å; A266-F269 PolarHBondContact O-N 2.9Å; A266-K270 WeakPolarHBondContact O-CG 3.35Å; A266-K270 PolarHBondContact O-N 3.39Å
267	E	96.4	Very high	96.4	Very high	100 Å²	100	77.4 Å²	77.4	47%	0.467	35%	0.354	S	S	.	.	H	α-helix	trans	-65.1	-37.2	175.4	-167.2	59.1	-153.9	0	0	112.6	E263 R264 Q265 K270 N271	E263-E267 PolarHBondContact O-N 3.1Å; R264-E267 PolarHBondContact O-N 3.31Å; Q265-E267 VanDerWaalsContact C-N 3.29Å; Q265-E267 PolarHBondContact O-N 2.99Å; E267-K270 PolarHBondContact O-N 2.81Å; E267-N271 PolarHBondContact O-N 2.98Å; E267-N271 VanDerWaalsContact O-N 3.14Å; E267-N271 PolarHBondContact O-ND2 3.39Å
268	Y	97.4	Very high	96.6	Very high	114 Å²	114	74.6 Å²	74.6	45%	0.447	35%	0.345	S	S	.	.	H	α-helix	trans	-58.8	-50.3	171	168.1	-100	0	0	0	111.4	Y239 R264 Q265 A266 K270 N271 E272	Y239-Y268 HydrophobicContact CE1-CE1 4.44Å; R264-Y268 PolarHBondContact O-N 2.99Å; Q265-Y268 WeakPolarHBondContact O-CB 3.47Å; Q265-Y268 PolarHBondContact O-N 3.25Å; Q265-Y268 VanDerWaalsContact O-N 3.17Å; A266-Y268 VanDerWaalsContact C-N 3.35Å; A266-Y268 PolarHBondContact O-N 3.16Å; Y268-K270 VanDerWaalsContact C-N 3.34Å; Y268-K270 PolarHBondContact O-N 3.08Å; Y268-N271 WeakPolarHBondContact O-CB 3.4Å; Y268-N271 PolarHBondContact O-N 2.84Å; Y268-N271 VanDerWaalsContact O-N 3.13Å; Y268-E272 HydrophobicContact CD2-CG 4.38Å; Y268-E272 HydrophobicContact CE1-CG 4.03Å; Y268-E272 HydrophobicContact CE2-CG 3.79Å; Y268-E272 PolarHBondContact O-N 3Å
269	F	97.9	Very high	96.6	Very high	26 Å²	26	73.7 Å²	73.7	11%	0.114	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-39	178.8	-62.9	-50.7	0	0	0	112.5	Y239 D242 L243 T246 Q265 A266 N271 E272 I273	Y239-F269 AromaticContact CD1-CD1 3.65Å; Y239-F269 HydrophobicContact CD1-CD1 3.65Å; Y239-F269 HydrophobicContact CD1-CE1 4.07Å; Y239-F269 HydrophobicContact CE1-CD1 4.13Å; Y239-F269 HydrophobicContact CE1-CE1 4.31Å; D242-F269 HydrophobicContact CB-CD1 4.15Å; D242-F269 HydrophobicContact CB-CD2 4.21Å; D242-F269 HydrophobicContact CB-CE1 3.84Å; D242-F269 HydrophobicContact CB-CE2 3.93Å; D242-F269 HydrophobicContact CB-CG 4.33Å; D242-F269 HydrophobicContact CB-CZ 3.73Å; L243-F269 HydrophobicContact CB-CB 3.88Å; L243-F269 HydrophobicContact CD1-CB 4.24Å; T246-F269 HydrophobicContact CG2-CE2 4.41Å; T246-F269 WeakPolarHBondContact OG1-CE2 3.43Å; Q265-F269 HydrophobicContact CB-CE2 4.31Å; Q265-F269 WeakPolarHBondContact O-CD2 3.36Å; Q265-F269 PolarHBondContact O-N 2.76Å; A266-F269 PolarHBondContact O-N 2.9Å; F269-N271 VanDerWaalsContact C-N 3.29Å; F269-N271 PolarHBondContact O-N 2.87Å; F269-E272 PolarHBondContact O-N 2.94Å; F269-I273 WeakPolarHBondContact O-CB 3.31Å; F269-I273 WeakPolarHBondContact O-CD1 3.42Å; F269-I273 WeakPolarHBondContact O-CG1 3.42Å; F269-I273 PolarHBondContact O-N 3.5Å
270	K	97.8	Very high	96.6	Very high	86 Å²	86	70.4 Å²	70.4	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-57.4	-42.2	173.8	-76.2	171.8	-178.2	163.6	0	112.4	L243 E247 A266 E267 Y268 N274	L243-K270 HydrophobicContact CD1-CG 4Å; L243-K270 HydrophobicContact CD2-CG 3.83Å; E247-K270 WeakPolarHBondContact OE1-CE 3.41Å; E247-K270 IonicContact OE1-NZ 3.53Å; E247-K270 PolarHBondContact OE1-NZ 3Å; A266-K270 WeakPolarHBondContact O-CG 3.35Å; A266-K270 PolarHBondContact O-N 3.39Å; E267-K270 PolarHBondContact O-N 2.81Å; Y268-K270 VanDerWaalsContact C-N 3.34Å; Y268-K270 PolarHBondContact O-N 3.08Å; K270-N274 PolarHBondContact O-N 3.43Å; K270-N274 VanDerWaalsContact O-N 3.12Å
271	N	97.4	Very high	96.7	Very high	82 Å²	82	73.3 Å²	73.3	44%	0.439	34%	0.34	S	S	.	.	H	α-helix	trans	-66.8	-45.1	177.6	-74.2	-50.8	0	0	0	111.9	E267 Y268 F269 N274 I275	E267-N271 PolarHBondContact O-N 2.98Å; E267-N271 VanDerWaalsContact O-N 3.14Å; E267-N271 PolarHBondContact O-ND2 3.39Å; Y268-N271 WeakPolarHBondContact O-CB 3.4Å; Y268-N271 PolarHBondContact O-N 2.84Å; Y268-N271 VanDerWaalsContact O-N 3.13Å; F269-N271 VanDerWaalsContact C-N 3.29Å; F269-N271 PolarHBondContact O-N 2.87Å; N271-N274 PolarHBondContact O-N 2.92Å; N271-I275 WeakPolarHBondContact O-CG1 3.27Å; N271-I275 PolarHBondContact O-N 3.12Å
272	E	97.8	Very high	96.7	Very high	40 Å²	40	75.5 Å²	75.5	19%	0.187	35%	0.349	C	S	.	.	H	α-helix	trans	-62.9	-42.6	176.4	-70.1	-58.7	134.6	0	0	112.2	Y239 Y268 F269 N274 I275 Y276	Y239-E272 HydrophobicContact CD1-CB 4.3Å; Y239-E272 HydrophobicContact CD2-CB 3.86Å; Y239-E272 HydrophobicContact CE1-CB 4.16Å; Y239-E272 HydrophobicContact CE1-CG 4.25Å; Y239-E272 HydrophobicContact CE2-CB 3.7Å; Y239-E272 HydrophobicContact CE2-CG 4.22Å; Y239-E272 HydrophobicContact CG-CB 4.15Å; Y268-E272 HydrophobicContact CD2-CG 4.38Å; Y268-E272 HydrophobicContact CE1-CG 4.03Å; Y268-E272 HydrophobicContact CE2-CG 3.79Å; Y268-E272 PolarHBondContact O-N 3Å; F269-E272 PolarHBondContact O-N 2.94Å; E272-N274 VanDerWaalsContact C-N 3.3Å; E272-N274 PolarHBondContact O-N 3.3Å; E272-I275 PolarHBondContact O-N 3.43Å; E272-I275 VanDerWaalsContact O-N 3.15Å; E272-Y276 WeakPolarHBondContact O-CD2 3.45Å; E272-Y276 PolarHBondContact O-N 2.95Å
273	I	97.7	Very high	96.6	Very high	20 Å²	20	75.5 Å²	75.5	10%	0.103	35%	0.351	C	S	.	.	H	α-helix	trans	-56.2	-45.4	174.6	-71.4	162	0	0	0	110.5	Y236 L243 F269 I275 Y276 T277	Y236-I273 HydrophobicContact CD2-CG2 4.35Å; Y236-I273 HydrophobicContact CE2-CG2 3.75Å; L243-I273 HydrophobicContact CB-CD1 3.99Å; L243-I273 HydrophobicContact CD2-CD1 3.54Å; L243-I273 HydrophobicContact CG-CD1 4.39Å; F269-I273 WeakPolarHBondContact O-CB 3.31Å; F269-I273 WeakPolarHBondContact O-CD1 3.42Å; F269-I273 WeakPolarHBondContact O-CG1 3.42Å; F269-I273 PolarHBondContact O-N 3.5Å; I273-I275 PolarHBondContact O-N 2.82Å; I273-Y276 PolarHBondContact O-N 3.38Å; I273-T277 WeakPolarHBondContact O-CB 3.48Å; I273-T277 PolarHBondContact O-N 3.38Å; I273-T277 PolarHBondContact O-OG1 2.91Å
274	N	96.9	Very high	96.7	Very high	85 Å²	85	73.1 Å²	73.1	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-39.5	178.9	-168.3	12.1	0	0	0	112	K270 N271 E272 K278	K270-N274 PolarHBondContact O-N 3.43Å; K270-N274 VanDerWaalsContact O-N 3.12Å; N271-N274 PolarHBondContact O-N 2.92Å; E272-N274 VanDerWaalsContact C-N 3.3Å; E272-N274 PolarHBondContact O-N 3.3Å; N274-K278 PolarHBondContact O-N 3.29Å
275	I	96.4	Very high	96.7	Very high	75 Å²	75	71.3 Å²	71.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-49.3	175	-68.2	167.1	0	0	0	110.5	N271 E272 I273 K278 K279	N271-I275 WeakPolarHBondContact O-CG1 3.27Å; N271-I275 PolarHBondContact O-N 3.12Å; E272-I275 PolarHBondContact O-N 3.43Å; E272-I275 VanDerWaalsContact O-N 3.15Å; I273-I275 PolarHBondContact O-N 2.82Å; I275-K278 PolarHBondContact O-N 3.06Å; I275-K279 HydrophobicContact CG2-CD 4.13Å; I275-K279 WeakPolarHBondContact O-CG 3.5Å; I275-K279 PolarHBondContact O-N 2.99Å
276	Y	96.5	Very high	96.6	Very high	39 Å²	39	71.9 Å²	71.9	15%	0.153	34%	0.343	C	S	.	.	H	α-helix	trans	-69.9	-30.7	-178.9	-89.2	-88	0	0	0	113.1	I235 Y239 E272 I273 K278 K279 L280	I235-Y276 HydrophobicContact CB-CD1 4.22Å; I235-Y276 HydrophobicContact CB-CE1 3.85Å; I235-Y276 HydrophobicContact CD1-CE1 3.94Å; I235-Y276 HydrophobicContact CG2-CD1 4Å; I235-Y276 HydrophobicContact CG2-CD2 4.21Å; I235-Y276 HydrophobicContact CG2-CE1 3.56Å; I235-Y276 HydrophobicContact CG2-CE2 3.79Å; I235-Y276 HydrophobicContact CG2-CG 4.3Å; I235-Y276 VanDerWaalsContact CG2-CZ 3.43Å; Y239-Y276 HydrophobicContact CD2-CD2 4.08Å; Y239-Y276 HydrophobicContact CD2-CE2 4.39Å; Y239-Y276 AromaticContact CE2-CD2 3.77Å; Y239-Y276 HydrophobicContact CE2-CD2 3.77Å; Y239-Y276 AromaticContact CE2-CE2 3.66Å; Y239-Y276 HydrophobicContact CE2-CE2 3.66Å; E272-Y276 WeakPolarHBondContact O-CD2 3.45Å; E272-Y276 PolarHBondContact O-N 2.95Å; I273-Y276 PolarHBondContact O-N 3.38Å; Y276-K278 PolarHBondContact O-N 3.04Å; Y276-K279 PolarHBondContact O-N 2.97Å; Y276-L280 WeakPolarHBondContact O-CB 3.42Å; Y276-L280 PolarHBondContact O-N 3.5Å
277	T	96.9	Very high	96.6	Very high	41 Å²	41	72.1 Å²	72.1	25%	0.252	34%	0.343	S	S	.	.	H	α-helix	trans	-56.8	-52.2	172.1	-58.3	0	0	0	0	110.2	Y236 I273 K279 L280 E281	Y236-T277 VanDerWaalsContact CE2-OG1 3.31Å; Y236-T277 WeakPolarHBondContact CE2-OG1 3.49Å; I273-T277 WeakPolarHBondContact O-CB 3.48Å; I273-T277 PolarHBondContact O-N 3.38Å; I273-T277 PolarHBondContact O-OG1 2.91Å; T277-K279 PolarHBondContact O-N 3.45Å; T277-L280 PolarHBondContact O-N 3.19Å; T277-E281 WeakPolarHBondContact O-CG 3.42Å; T277-E281 PolarHBondContact O-N 3.05Å
278	K	96.5	Very high	96.5	Very high	122 Å²	122	70.8 Å²	70.8	53%	0.53	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-39.5	179.7	-68.1	177.9	-176.8	176	0	112.8	N274 I275 Y276 N282	N274-K278 PolarHBondContact O-N 3.29Å; I275-K278 PolarHBondContact O-N 3.06Å; Y276-K278 PolarHBondContact O-N 3.04Å; K278-N282 WeakPolarHBondContact O-CB 3.31Å; K278-N282 PolarHBondContact O-N 3.15Å; K278-N282 VanDerWaalsContact O-N 3.13Å; K278-N282 PolarHBondContact O-ND2 3.06Å
279	K	96	Very high	96.4	Very high	96 Å²	96	66.6 Å²	66.6	42%	0.417	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-48.1	176.1	-74.4	179.6	178.2	176.7	0	110.8	M232 I275 Y276 T277 N282 S283	M232-K279 HydrophobicContact SD-CB 4.03Å; I275-K279 HydrophobicContact CG2-CD 4.13Å; I275-K279 WeakPolarHBondContact O-CG 3.5Å; I275-K279 PolarHBondContact O-N 2.99Å; Y276-K279 PolarHBondContact O-N 2.97Å; T277-K279 PolarHBondContact O-N 3.45Å; K279-N282 PolarHBondContact O-N 2.86Å; K279-S283 WeakPolarHBondContact O-CB 3.42Å; K279-S283 PolarHBondContact O-N 2.93Å; K279-S283 PolarHBondContact O-OG 3.06Å
280	L	96.1	Very high	96.3	Very high	26 Å²	26	67.7 Å²	67.7	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-45.6	179.8	-174.7	65.1	0	0	0	111.4	V229 M232 R233 Y276 T277 N282 S283 Q284	V229-L280 HydrophobicContact CG1-CD1 4.16Å; V229-L280 WeakPolarHBondContact O-CD1 3.06Å; M232-L280 HydrophobicContact CB-CD1 4.04Å; R233-L280 HydrophobicContact CB-CD1 4.07Å; R233-L280 HydrophobicContact CB-CD2 4.4Å; R233-L280 HydrophobicContact CG-CD2 4.46Å; Y276-L280 WeakPolarHBondContact O-CB 3.42Å; Y276-L280 PolarHBondContact O-N 3.5Å; T277-L280 PolarHBondContact O-N 3.19Å; L280-N282 PolarHBondContact O-N 3.05Å; L280-S283 PolarHBondContact O-N 2.9Å; L280-Q284 WeakPolarHBondContact O-CB 3.44Å; L280-Q284 PolarHBondContact O-N 2.91Å
281	E	95.9	Very high	96.1	Very high	128 Å²	128	64.4 Å²	64.4	60%	0.598	32%	0.322	S	S	*	.	H	α-helix	trans	-57	-47.3	175.1	-76.5	177.5	169.1	0	0	112.1	T277 K285	T277-E281 WeakPolarHBondContact O-CG 3.42Å; T277-E281 PolarHBondContact O-N 3.05Å; E281-K285 VanDerWaalsContact O-CB 3.31Å; E281-K285 WeakPolarHBondContact O-CB 3.42Å; E281-K285 PolarHBondContact O-N 3.28Å
282	N	96.3	Very high	95.8	Very high	101 Å²	101	66.9 Å²	66.9	54%	0.54	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-45.1	178.3	-81.8	-24.4	0	0	0	112.2	K278 K279 L280 K285 N286	K278-N282 WeakPolarHBondContact O-CB 3.31Å; K278-N282 PolarHBondContact O-N 3.15Å; K278-N282 VanDerWaalsContact O-N 3.13Å; K278-N282 PolarHBondContact O-ND2 3.06Å; K279-N282 PolarHBondContact O-N 2.86Å; L280-N282 PolarHBondContact O-N 3.05Å; N282-K285 PolarHBondContact O-N 3.45Å; N282-N286 WeakPolarHBondContact O-CB 3.41Å; N282-N286 PolarHBondContact O-N 3.46Å; N282-N286 PolarHBondContact O-ND2 3.35Å
283	S	95.7	Very high	95.7	Very high	17 Å²	17	70.2 Å²	70.2	12%	0.119	35%	0.35	C	S	.	.	H	α-helix	trans	-65	-42.6	178.8	-66.1	0	0	0	0	111.6	M232 K279 L280 K285 N286 F287	M232-S283 PolarHBondContact SD-OG 3.4Å; K279-S283 WeakPolarHBondContact O-CB 3.42Å; K279-S283 PolarHBondContact O-N 2.93Å; K279-S283 PolarHBondContact O-OG 3.06Å; L280-S283 PolarHBondContact O-N 2.9Å; S283-K285 PolarHBondContact O-N 3.27Å; S283-N286 PolarHBondContact O-N 3.41Å; S283-F287 WeakPolarHBondContact O-CB 3.25Å; S283-F287 PolarHBondContact O-N 3.37Å
284	Q	96.3	Very high	95.5	Very high	50 Å²	50	71 Å²	71	23%	0.234	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-43.6	175.7	-167.3	80.9	50.8	0	0	111	L280 F287 N288	L280-Q284 WeakPolarHBondContact O-CB 3.44Å; L280-Q284 PolarHBondContact O-N 2.91Å; Q284-F287 PolarHBondContact O-N 3.09Å; Q284-N288 WeakPolarHBondContact O-CB 3.37Å; Q284-N288 VanDerWaalsContact O-CG 3.22Å; Q284-N288 PolarHBondContact O-N 2.86Å
285	K	96.1	Very high	95.3	Very high	153 Å²	153	67.2 Å²	67.2	67%	0.665	33%	0.334	S	S	*	.	H	α-helix	trans	-63.2	-44.3	176.1	-175	179.3	179.5	-179.3	0	111.9	E281 N282 S283 G289	E281-K285 VanDerWaalsContact O-CB 3.31Å; E281-K285 WeakPolarHBondContact O-CB 3.42Å; E281-K285 PolarHBondContact O-N 3.28Å; N282-K285 PolarHBondContact O-N 3.45Å; S283-K285 PolarHBondContact O-N 3.27Å; K285-G289 PolarHBondContact O-N 3.48Å
286	N	95	Very high	94.9	Very high	103 Å²	103	66.7 Å²	66.7	55%	0.551	34%	0.337	S	S	*	.	H	α-helix	trans	-64	-43	177.4	-73	-18.7	0	0	0	111.6	M225 N282 S283 F290	M225-N286 HydrophobicContact CE-CB 4.13Å; N282-N286 WeakPolarHBondContact O-CB 3.41Å; N282-N286 PolarHBondContact O-N 3.46Å; N282-N286 PolarHBondContact O-ND2 3.35Å; S283-N286 PolarHBondContact O-N 3.41Å; N286-F290 WeakPolarHBondContact O-CB 3.47Å; N286-F290 PolarHBondContact O-N 3.15Å
287	F	96.2	Very high	94.7	Very high	11 Å²	11	67.6 Å²	67.6	5%	0.048	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-52.6	175.6	170.6	-100	0	0	0	111.6	W216 L222 M225 K226 V229 S283 Q284 G289 F290 L291	W216-F287 AromaticContact CH2-CE2 3.81Å; W216-F287 HydrophobicContact CH2-CE2 3.81Å; W216-F287 AromaticContact CH2-CZ 3.58Å; W216-F287 HydrophobicContact CH2-CZ 3.58Å; W216-F287 HydrophobicContact CZ2-CE2 4.37Å; W216-F287 AromaticContact CZ2-CZ 3.77Å; W216-F287 HydrophobicContact CZ2-CZ 3.77Å; L222-F287 HydrophobicContact CD1-CD2 4.26Å; L222-F287 HydrophobicContact CD1-CE2 3.61Å; L222-F287 HydrophobicContact CD1-CZ 4.28Å; L222-F287 HydrophobicContact CG-CE2 4.2Å; M225-F287 HydrophobicContact CB-CD2 3.99Å; K226-F287 HydrophobicContact CB-CD2 4.31Å; K226-F287 HydrophobicContact CB-CE2 3.77Å; K226-F287 HydrophobicContact CB-CZ 4.31Å; K226-F287 HydrophobicContact CD-CE1 4.38Å; K226-F287 HydrophobicContact CD-CE2 4.3Å; K226-F287 HydrophobicContact CD-CZ 4.06Å; V229-F287 HydrophobicContact CG2-CB 4.08Å; S283-F287 WeakPolarHBondContact O-CB 3.25Å; S283-F287 PolarHBondContact O-N 3.37Å; Q284-F287 PolarHBondContact O-N 3.09Å; F287-G289 PolarHBondContact O-N 3.09Å; F287-F290 PolarHBondContact O-N 3.28Å; F287-L291 HydrophobicContact CE1-CD2 4.45Å; F287-L291 HydrophobicContact CZ-CD2 4.32Å; F287-L291 PolarHBondContact O-N 3.38Å
288	N	93.9	Very high	94.6	Very high	72 Å²	72	66.2 Å²	66.2	39%	0.385	35%	0.345	S	S	.	.	H	α-helix	trans	-60.3	-45.2	179.8	-70.5	-7.8	0	0	0	111.3	Q284 F290 L291 E292	Q284-N288 WeakPolarHBondContact O-CB 3.37Å; Q284-N288 VanDerWaalsContact O-CG 3.22Å; Q284-N288 PolarHBondContact O-N 2.86Å; N288-F290 VanDerWaalsContact C-N 3.33Å; N288-F290 PolarHBondContact O-N 2.83Å; N288-L291 PolarHBondContact O-N 3.47Å; N288-E292 WeakPolarHBondContact O-CB 3.32Å; N288-E292 WeakPolarHBondContact O-CG 3.38Å; N288-E292 PolarHBondContact O-N 2.85Å
289	G	95.3	Very high	94.5	Very high	26 Å²	26	65.2 Å²	65.2	27%	0.268	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-36	177.3	0	0	0	0	0	113.2	K285 F287 N293	K285-G289 PolarHBondContact O-N 3.48Å; F287-G289 PolarHBondContact O-N 3.09Å; G289-N293 WeakPolarHBondContact O-CB 3.23Å; G289-N293 PolarHBondContact O-N 3.49Å; G289-N293 PolarHBondContact O-ND2 2.86Å; G289-N293 VanDerWaalsContact O-ND2 3.08Å
290	F	95.7	Very high	94.5	Very high	48 Å²	48	66.5 Å²	66.5	21%	0.211	36%	0.358	C	S	.	.	H	α-helix	trans	-67.4	-44.9	174.7	-174.8	-107	0	0	0	111.9	K221 L222 M225 N286 F287 N288 N293 L294	K221-F290 HydrophobicContact CB-CE1 4.47Å; K221-F290 HydrophobicContact CB-CZ 4.49Å; K221-F290 HydrophobicContact CD-CE1 4.35Å; K221-F290 HydrophobicContact CD-CE2 4.22Å; K221-F290 HydrophobicContact CD-CZ 3.84Å; K221-F290 HydrophobicContact CG-CE1 4.23Å; K221-F290 HydrophobicContact CG-CZ 4.19Å; L222-F290 HydrophobicContact CB-CE1 4.34Å; L222-F290 HydrophobicContact CD1-CD1 3.98Å; L222-F290 HydrophobicContact CD1-CE1 4.4Å; M225-F290 HydrophobicContact CE-CB 4.06Å; M225-F290 HydrophobicContact CE-CG 4.49Å; M225-F290 HydrophobicContact SD-CB 4.08Å; M225-F290 HydrophobicContact SD-CD1 3.78Å; M225-F290 HydrophobicContact SD-CE1 4.38Å; M225-F290 HydrophobicContact SD-CG 3.89Å; N286-F290 WeakPolarHBondContact O-CB 3.47Å; N286-F290 PolarHBondContact O-N 3.15Å; F287-F290 PolarHBondContact O-N 3.28Å; N288-F290 VanDerWaalsContact C-N 3.33Å; N288-F290 PolarHBondContact O-N 2.83Å; F290-N293 PolarHBondContact O-N 3.28Å; F290-L294 HydrophobicContact CD1-CD1 4Å; F290-L294 HydrophobicContact CE1-CD1 3.51Å; F290-L294 HydrophobicContact CE1-CG 4.23Å; F290-L294 HydrophobicContact CZ-CD1 3.92Å; F290-L294 HydrophobicContact CZ-CD2 4.41Å; F290-L294 HydrophobicContact CZ-CG 4.28Å; F290-L294 WeakPolarHBondContact O-CG 3.48Å; F290-L294 PolarHBondContact O-N 3.02Å
291	L	93.7	Very high	94.4	Very high	17 Å²	17	65.6 Å²	65.6	9%	0.089	35%	0.353	C	S	.	.	H	α-helix	trans	-61.4	-46.5	175.9	179.4	56.9	0	0	0	111.6	E212 L222 F287 N288 N293 L294 L295	E212-L291 HydrophobicContact CG-CD1 4.5Å; L222-L291 HydrophobicContact CD1-CB 4.04Å; L222-L291 HydrophobicContact CD1-CD1 4.03Å; L222-L291 HydrophobicContact CD2-CD1 3.99Å; F287-L291 HydrophobicContact CE1-CD2 4.45Å; F287-L291 HydrophobicContact CZ-CD2 4.32Å; F287-L291 PolarHBondContact O-N 3.38Å; N288-L291 PolarHBondContact O-N 3.47Å; L291-N293 VanDerWaalsContact C-N 3.31Å; L291-N293 PolarHBondContact O-N 3.32Å; L291-L294 PolarHBondContact O-N 3.4Å; L291-L295 HydrophobicContact CD1-CD1 3.97Å; L291-L295 HydrophobicContact CD1-CG 4.13Å; L291-L295 HydrophobicContact CG-CD1 3.82Å; L291-L295 HydrophobicContact CG-CG 4.44Å; L291-L295 WeakPolarHBondContact O-CB 3.46Å; L291-L295 WeakPolarHBondContact O-CG 3.44Å; L291-L295 PolarHBondContact O-N 2.84Å
292	E	91.8	Very high	94.3	Very high	134 Å²	134	65.3 Å²	65.3	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-60.4	-39.1	176.2	-78.1	-176.4	168.5	0	0	112.5	N288 L295 S296	N288-E292 WeakPolarHBondContact O-CB 3.32Å; N288-E292 WeakPolarHBondContact O-CG 3.38Å; N288-E292 PolarHBondContact O-N 2.85Å; E292-L295 PolarHBondContact O-N 2.93Å; E292-S296 WeakPolarHBondContact O-CB 3.35Å; E292-S296 PolarHBondContact O-N 2.98Å; E292-S296 PolarHBondContact O-OG 3.14Å
293	N	94.1	Very high	94.3	Very high	111 Å²	111	62.8 Å²	62.8	59%	0.594	34%	0.343	S	S	*	.	H	α-helix	trans	-63.7	-41.4	175.2	-76.8	-29.2	0	0	0	112	G289 F290 L291 S296 A297	G289-N293 WeakPolarHBondContact O-CB 3.23Å; G289-N293 PolarHBondContact O-N 3.49Å; G289-N293 PolarHBondContact O-ND2 2.86Å; G289-N293 VanDerWaalsContact O-ND2 3.08Å; F290-N293 PolarHBondContact O-N 3.28Å; L291-N293 VanDerWaalsContact C-N 3.31Å; L291-N293 PolarHBondContact O-N 3.32Å; N293-S296 WeakPolarHBondContact CA-OG 3.5Å; N293-S296 PolarHBondContact O-OG 2.85Å; N293-S296 VanDerWaalsContact O-OG 3.08Å; N293-A297 WeakPolarHBondContact O-CB 3.29Å; N293-A297 PolarHBondContact O-N 3.44Å
294	L	94.1	Very high	94.2	Very high	36 Å²	36	63.4 Å²	63.4	19%	0.188	34%	0.344	C	S	.	.	H	α-helix	trans	-66.8	-46	176.3	-69.9	177	0	0	0	111.9	L215 N219 F290 L291 A297 S298	L215-L294 HydrophobicContact CD1-CB 3.81Å; L215-L294 HydrophobicContact CD2-CB 4.08Å; L215-L294 HydrophobicContact CD2-CD1 4.45Å; N219-L294 HydrophobicContact CB-CD1 4.48Å; F290-L294 HydrophobicContact CD1-CD1 4Å; F290-L294 HydrophobicContact CE1-CD1 3.51Å; F290-L294 HydrophobicContact CE1-CG 4.23Å; F290-L294 HydrophobicContact CZ-CD1 3.92Å; F290-L294 HydrophobicContact CZ-CD2 4.41Å; F290-L294 HydrophobicContact CZ-CG 4.28Å; F290-L294 WeakPolarHBondContact O-CG 3.48Å; F290-L294 PolarHBondContact O-N 3.02Å; L291-L294 PolarHBondContact O-N 3.4Å; L294-A297 WeakPolarHBondContact O-CB 3.46Å; L294-A297 PolarHBondContact O-N 3.03Å; L294-S298 PolarHBondContact O-N 2.95Å
295	L	91.9	Very high	94	Very high	6 Å²	6	62.9 Å²	62.9	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-48	177.8	-72.5	166.1	0	0	0	111	Y208 V211 E212 L215 L291 E292 A297 S298 L301	Y208-L295 HydrophobicContact CE1-CD1 4.48Å; Y208-L295 HydrophobicContact CE2-CD1 3.72Å; Y208-L295 HydrophobicContact CE2-CD2 4.2Å; Y208-L295 HydrophobicContact CE2-CG 4.45Å; Y208-L295 WeakPolarHBondContact OH-CD1 3.41Å; V211-L295 HydrophobicContact CG1-CD2 4.1Å; E212-L295 HydrophobicContact CB-CD2 4.11Å; E212-L295 HydrophobicContact CG-CD2 4.46Å; L215-L295 HydrophobicContact CD1-CD2 3.71Å; L215-L295 HydrophobicContact CD1-CG 3.95Å; L291-L295 HydrophobicContact CD1-CD1 3.97Å; L291-L295 HydrophobicContact CD1-CG 4.13Å; L291-L295 HydrophobicContact CG-CD1 3.82Å; L291-L295 HydrophobicContact CG-CG 4.44Å; L291-L295 WeakPolarHBondContact O-CB 3.46Å; L291-L295 WeakPolarHBondContact O-CG 3.44Å; L291-L295 PolarHBondContact O-N 2.84Å; E292-L295 PolarHBondContact O-N 2.93Å; L295-A297 PolarHBondContact O-N 3.34Å; L295-S298 VanDerWaalsContact O-CB 3.26Å; L295-S298 WeakPolarHBondContact O-CB 3.25Å; L295-S298 PolarHBondContact O-N 3.47Å; L295-L301 HydrophobicContact CB-CD2 3.93Å; L295-L301 HydrophobicContact CD2-CD2 4.18Å; L295-L301 WeakPolarHBondContact O-CD2 3.38Å
296	S	89	Confident	94	Very high	63 Å²	63	62.1 Å²	62.1	44%	0.441	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-21.1	177.9	64.2	0	0	0	0	113.1	E292 N293 S298 K302	E292-S296 WeakPolarHBondContact O-CB 3.35Å; E292-S296 PolarHBondContact O-N 2.98Å; E292-S296 PolarHBondContact O-OG 3.14Å; N293-S296 WeakPolarHBondContact CA-OG 3.5Å; N293-S296 PolarHBondContact O-OG 2.85Å; N293-S296 VanDerWaalsContact O-OG 3.08Å; S296-S298 VanDerWaalsContact C-N 3.33Å; S296-K302 WeakPolarHBondContact O-CD 3.41Å; S296-K302 WeakPolarHBondContact O-CE 3.05Å; S296-K302 PolarHBondContact O-NZ 3.41Å
297	A	92.1	Very high	93.9	Very high	58 Å²	58	62.6 Å²	62.6	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-73.9	-22.9	171.7	0	0	0	0	0	113	N293 L294 L295 P299	N293-A297 WeakPolarHBondContact O-CB 3.29Å; N293-A297 PolarHBondContact O-N 3.44Å; L294-A297 WeakPolarHBondContact O-CB 3.46Å; L294-A297 PolarHBondContact O-N 3.03Å; L295-A297 PolarHBondContact O-N 3.34Å; A297-P299 VanDerWaalsContact O-CD 3.32Å; A297-P299 WeakPolarHBondContact O-CD 3.35Å
298	S	94.9	Very high	93.7	Very high	12 Å²	12	62.7 Å²	62.7	8%	0.084	34%	0.338	C	S	.	.			trans	-61.4	119.3	-178.9	173.6	0	0	0	0	112.1	L294 L295 S296 E300 L301 K302	L294-S298 PolarHBondContact O-N 2.95Å; L295-S298 VanDerWaalsContact O-CB 3.26Å; L295-S298 WeakPolarHBondContact O-CB 3.25Å; L295-S298 PolarHBondContact O-N 3.47Å; S296-S298 VanDerWaalsContact C-N 3.33Å; S298-E300 VanDerWaalsContact C-N 3.32Å; S298-E300 PolarHBondContact O-N 3.47Å; S298-L301 PolarHBondContact O-N 3.22Å; S298-L301 PolarHBondContact OG-N 3.07Å; S298-K302 WeakPolarHBondContact O-CB 3.37Å; S298-K302 WeakPolarHBondContact O-CG 3.35Å; S298-K302 PolarHBondContact O-N 3.37Å
299	P	94.7	Very high	93.6	Very high	101 Å²	101	66.9 Å²	66.9	66%	0.656	35%	0.348	S	S	*	.	H	α-helix	trans	-62.6	-39.1	176.7	-22.4	33.5	0	0	0	112.8	A297 K302 A303	A297-P299 VanDerWaalsContact O-CD 3.32Å; A297-P299 WeakPolarHBondContact O-CD 3.35Å; P299-K302 PolarHBondContact O-N 3.04Å; P299-A303 WeakPolarHBondContact O-CB 3.13Å; P299-A303 PolarHBondContact O-N 3.16Å
300	E	94.6	Very high	93.6	Very high	124 Å²	124	69.4 Å²	69.4	58%	0.579	36%	0.355	S	S	*	.	H	α-helix	trans	-63.1	-48.1	178.7	-65.6	153.6	-178.2	0	0	110.2	V207 S298 K302 A303 E304	V207-E300 HydrophobicContact CG1-CB 4.21Å; S298-E300 VanDerWaalsContact C-N 3.32Å; S298-E300 PolarHBondContact O-N 3.47Å; E300-K302 PolarHBondContact O-N 2.97Å; E300-A303 PolarHBondContact O-N 2.81Å; E300-E304 PolarHBondContact O-N 3Å
301	L	94.1	Very high	93.5	Very high	7 Å²	7	67.8 Å²	67.8	4%	0.037	35%	0.351	C	S	.	.	H	α-helix	trans	-65.7	-40.5	178.8	-167.2	63.5	0	0	0	111.8	Y204 V207 Y208 L295 S298 A303 E304 N305	Y204-L301 HydrophobicContact CD2-CD1 3.84Å; Y204-L301 HydrophobicContact CE2-CD1 3.31Å; Y204-L301 HydrophobicContact CE2-CG 3.79Å; V207-L301 HydrophobicContact CG1-CD1 4.35Å; Y208-L301 HydrophobicContact CD2-CD1 4.01Å; Y208-L301 HydrophobicContact CD2-CD2 3.83Å; Y208-L301 HydrophobicContact CE2-CD2 4.37Å; Y208-L301 HydrophobicContact CG-CD1 4.33Å; L295-L301 HydrophobicContact CB-CD2 3.93Å; L295-L301 HydrophobicContact CD2-CD2 4.18Å; L295-L301 WeakPolarHBondContact O-CD2 3.38Å; S298-L301 PolarHBondContact O-N 3.22Å; S298-L301 PolarHBondContact OG-N 3.07Å; L301-A303 VanDerWaalsContact C-N 3.34Å; L301-A303 PolarHBondContact O-N 3.24Å; L301-E304 PolarHBondContact O-N 2.97Å; L301-N305 VanDerWaalsContact O-CB 3.25Å; L301-N305 WeakPolarHBondContact O-CB 3.1Å; L301-N305 PolarHBondContact O-N 3.29Å
302	K	94.6	Very high	93.4	Very high	122 Å²	122	68.3 Å²	68.3	53%	0.53	35%	0.354	S	S	.	.	H	α-helix	trans	-59.1	-43.6	173.7	-86.1	170.4	158.4	141.1	0	112.1	S296 S298 P299 E300 K306	S296-K302 WeakPolarHBondContact O-CD 3.41Å; S296-K302 WeakPolarHBondContact O-CE 3.05Å; S296-K302 PolarHBondContact O-NZ 3.41Å; S298-K302 WeakPolarHBondContact O-CB 3.37Å; S298-K302 WeakPolarHBondContact O-CG 3.35Å; S298-K302 PolarHBondContact O-N 3.37Å; P299-K302 PolarHBondContact O-N 3.04Å; E300-K302 PolarHBondContact O-N 2.97Å; K302-K306 WeakPolarHBondContact O-CB 3.48Å; K302-K306 PolarHBondContact O-N 3.17Å
303	A	95.8	Very high	93.6	Very high	47 Å²	47	64.9 Å²	64.9	39%	0.388	35%	0.345	S	S	.	.	H	α-helix	trans	-64.4	-46.6	180	0	0	0	0	0	111.5	P299 E300 L301 K306 K307	P299-A303 WeakPolarHBondContact O-CB 3.13Å; P299-A303 PolarHBondContact O-N 3.16Å; E300-A303 PolarHBondContact O-N 2.81Å; L301-A303 VanDerWaalsContact C-N 3.34Å; L301-A303 PolarHBondContact O-N 3.24Å; A303-K306 PolarHBondContact O-N 3.29Å; A303-K307 WeakPolarHBondContact O-CG 3.25Å; A303-K307 PolarHBondContact O-N 2.91Å; A303-K307 VanDerWaalsContact O-N 3.12Å
304	E	94.1	Very high	93.7	Very high	31 Å²	31	66 Å²	66	15%	0.145	34%	0.344	C	S	.	.	H	α-helix	trans	-70.3	-37.8	178.4	-66.1	-49.6	130.5	0	0	112.8	Y204 V207 E300 L301 K306 K307 N308	Y204-E304 HydrophobicContact CD2-CB 4.07Å; V207-E304 HydrophobicContact CB-CG 4.23Å; V207-E304 HydrophobicContact CG1-CG 4.28Å; V207-E304 HydrophobicContact CG2-CG 3.95Å; E300-E304 PolarHBondContact O-N 3Å; L301-E304 PolarHBondContact O-N 2.97Å; E304-K306 VanDerWaalsContact C-N 3.28Å; E304-K306 PolarHBondContact O-N 3.31Å; E304-K307 PolarHBondContact O-N 2.86Å; E304-K307 IonicContact OE1-NZ 2.83Å; E304-K307 PolarHBondContact OE1-NZ 2.85Å; E304-K307 WeakPolarHBondContact OE2-CD 3.47Å; E304-K307 IonicContact OE2-NZ 3.71Å; E304-N308 PolarHBondContact O-N 3.05Å
305	N	92.4	Very high	93.6	Very high	39 Å²	39	64.3 Å²	64.3	21%	0.209	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-41.4	173.9	-166.7	3.8	0	0	0	111	Y204 L301 N308 R309	Y204-N305 HydrophobicContact CD2-CB 3.93Å; Y204-N305 HydrophobicContact CE2-CB 3.5Å; L301-N305 VanDerWaalsContact O-CB 3.25Å; L301-N305 WeakPolarHBondContact O-CB 3.1Å; L301-N305 PolarHBondContact O-N 3.29Å; N305-N308 PolarHBondContact O-N 3.46Å; N305-R309 WeakPolarHBondContact O-CB 3.41Å; N305-R309 WeakPolarHBondContact O-CG 3.46Å; N305-R309 PolarHBondContact O-N 2.98Å; N305-R309 PolarHBondContact OD1-NE 3.35Å
306	K	95	Very high	93.6	Very high	136 Å²	136	66.5 Å²	66.5	59%	0.591	35%	0.345	S	S	*	.	H	α-helix	trans	-61	-47.3	176	-175.8	180	177	-176.6	0	111.1	K302 A303 E304 N308 R309 D310	K302-K306 WeakPolarHBondContact O-CB 3.48Å; K302-K306 PolarHBondContact O-N 3.17Å; A303-K306 PolarHBondContact O-N 3.29Å; E304-K306 VanDerWaalsContact C-N 3.28Å; E304-K306 PolarHBondContact O-N 3.31Å; K306-N308 VanDerWaalsContact C-N 3.31Å; K306-N308 PolarHBondContact O-N 3.28Å; K306-R309 PolarHBondContact O-N 2.99Å; K306-D310 WeakPolarHBondContact O-CB 3.48Å; K306-D310 VanDerWaalsContact O-CG 3.23Å; K306-D310 PolarHBondContact O-N 2.78Å
307	K	94.8	Very high	93.9	Very high	114 Å²	114	67.9 Å²	67.9	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-58.8	-42.5	175.9	-69.4	172	-175.9	171.2	0	111.8	A303 E304 D310 A311	A303-K307 WeakPolarHBondContact O-CG 3.25Å; A303-K307 PolarHBondContact O-N 2.91Å; A303-K307 VanDerWaalsContact O-N 3.12Å; E304-K307 PolarHBondContact O-N 2.86Å; E304-K307 IonicContact OE1-NZ 2.83Å; E304-K307 PolarHBondContact OE1-NZ 2.85Å; E304-K307 WeakPolarHBondContact OE2-CD 3.47Å; E304-K307 IonicContact OE2-NZ 3.71Å; K307-D310 PolarHBondContact O-N 3.08Å; K307-A311 PolarHBondContact O-N 2.84Å
308	N	90.5	Very high	94	Very high	12 Å²	12	66.8 Å²	66.8	6%	0.064	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-46.1	177.1	-168.1	41.1	0	0	0	112	S200 A201 E304 N305 K306 D310 A311 L312	S200-N308 PolarHBondContact OG-OD1 3.49Å; A201-N308 PolarHBondContact N-OD1 3.33Å; E304-N308 PolarHBondContact O-N 3.05Å; N305-N308 PolarHBondContact O-N 3.46Å; K306-N308 VanDerWaalsContact C-N 3.31Å; K306-N308 PolarHBondContact O-N 3.28Å; N308-D310 VanDerWaalsContact C-N 3.34Å; N308-D310 PolarHBondContact O-N 3.31Å; N308-A311 PolarHBondContact O-N 3.49Å; N308-L312 WeakPolarHBondContact O-CG 3.5Å; N308-L312 PolarHBondContact O-N 2.95Å
309	R	92.7	Very high	93.8	Very high	160 Å²	160	66.3 Å²	66.3	60%	0.604	33%	0.328	S	S	*	.	H	α-helix	trans	-62.4	-39.4	175.5	-71.9	178.2	-177.2	-172.8	-3.3	112.8	N305 K306 L312 S313	N305-R309 WeakPolarHBondContact O-CB 3.41Å; N305-R309 WeakPolarHBondContact O-CG 3.46Å; N305-R309 PolarHBondContact O-N 2.98Å; N305-R309 PolarHBondContact OD1-NE 3.35Å; K306-R309 PolarHBondContact O-N 2.99Å; R309-L312 PolarHBondContact O-N 3.48Å; R309-S313 WeakPolarHBondContact O-CB 3.45Å; R309-S313 PolarHBondContact O-N 3.17Å
310	D	95.9	Very high	93.7	Very high	79 Å²	79	64.2 Å²	64.2	42%	0.422	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-39.8	177.1	-71	-16.8	0	0	0	111.1	K306 K307 N308 S313 K314	K306-D310 WeakPolarHBondContact O-CB 3.48Å; K306-D310 VanDerWaalsContact O-CG 3.23Å; K306-D310 PolarHBondContact O-N 2.78Å; K307-D310 PolarHBondContact O-N 3.08Å; N308-D310 VanDerWaalsContact C-N 3.34Å; N308-D310 PolarHBondContact O-N 3.31Å; D310-S313 PolarHBondContact O-N 3.14Å; D310-K314 WeakPolarHBondContact O-CG 3.44Å; D310-K314 PolarHBondContact O-N 3.41Å
311	A	93.1	Very high	93.5	Very high	14 Å²	14	61.8 Å²	61.8	12%	0.116	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-48.2	174.1	0	0	0	0	0	111.6	V197 S200 K307 N308 S313 K314 Y315	V197-A311 HydrophobicContact CG2-CB 4.03Å; S200-A311 WeakPolarHBondContact OG-CB 3.31Å; K307-A311 PolarHBondContact O-N 2.84Å; N308-A311 PolarHBondContact O-N 3.49Å; A311-S313 VanDerWaalsContact C-N 3.33Å; A311-S313 PolarHBondContact O-N 3.02Å; A311-K314 PolarHBondContact O-N 3.25Å; A311-Y315 WeakPolarHBondContact O-CB 3.4Å; A311-Y315 PolarHBondContact O-N 3.44Å
312	L	92	Very high	93.4	Very high	28 Å²	28	62 Å²	62	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-44.2	175.5	-75.5	167.7	0	0	0	111.8	I53 E57 V197 N308 R309 Y315 F316	I53-L312 HydrophobicContact CD1-CD2 4.23Å; I53-L312 HydrophobicContact CG2-CD2 3.84Å; E57-L312 WeakPolarHBondContact OE1-CD1 3.39Å; V197-L312 HydrophobicContact CG1-CD2 3.52Å; V197-L312 HydrophobicContact CG1-CG 4.19Å; V197-L312 HydrophobicContact CG2-CD2 4.17Å; V197-L312 HydrophobicContact CG2-CG 4.46Å; N308-L312 WeakPolarHBondContact O-CG 3.5Å; N308-L312 PolarHBondContact O-N 2.95Å; R309-L312 PolarHBondContact O-N 3.48Å; L312-Y315 PolarHBondContact O-N 3.19Å; L312-F316 HydrophobicContact CB-CD2 4.39Å; L312-F316 HydrophobicContact CB-CE2 4.38Å; L312-F316 HydrophobicContact CD2-CE2 3.98Å; L312-F316 WeakPolarHBondContact O-CD2 3.31Å; L312-F316 PolarHBondContact O-N 3.11Å
313	S	95	Very high	93.2	Very high	62 Å²	62	56.3 Å²	56.3	43%	0.434	28%	0.279	S	S	.	.	H	α-helix	trans	-61.3	-46.8	178.9	-175.5	0	0	0	0	111.5	R309 D310 A311 Y315 F316 N317	R309-S313 WeakPolarHBondContact O-CB 3.45Å; R309-S313 PolarHBondContact O-N 3.17Å; D310-S313 PolarHBondContact O-N 3.14Å; A311-S313 VanDerWaalsContact C-N 3.33Å; A311-S313 PolarHBondContact O-N 3.02Å; S313-Y315 PolarHBondContact O-N 3.21Å; S313-F316 PolarHBondContact O-N 3.48Å; S313-N317 WeakPolarHBondContact O-CB 3.42Å; S313-N317 PolarHBondContact O-N 3.11Å; S313-N317 PolarHBondContact O-ND2 3.16Å
314	K	95.7	Very high	92.9	Very high	135 Å²	135	60 Å²	60	59%	0.587	29%	0.286	S	S	*	.	H	α-helix	trans	-60	-46.8	175.7	-72.7	173.1	-176.8	177.1	0	111.7	L193 D310 A311 N317 E318	L193-K314 HydrophobicContact CD2-CB 4.13Å; D310-K314 WeakPolarHBondContact O-CG 3.44Å; D310-K314 PolarHBondContact O-N 3.41Å; A311-K314 PolarHBondContact O-N 3.25Å; K314-N317 PolarHBondContact O-N 3.4Å; K314-E318 PolarHBondContact O-N 3.18Å
315	Y	93.2	Very high	92.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-50.6	177.9	171.8	-90.7	0	0	0	111.9	E49 I53 I190 L193 Y194 V197 A311 L312 S313 N317 E318 L319	E49-Y315 WeakPolarHBondContact CB-OH 3.3Å; E49-Y315 PolarHBondContact OE2-OH 3.11Å; I53-Y315 HydrophobicContact CD1-CD1 3.53Å; I53-Y315 HydrophobicContact CD1-CE1 3.26Å; I53-Y315 HydrophobicContact CD1-CG 4.41Å; I53-Y315 HydrophobicContact CG1-CE1 4.44Å; I190-Y315 HydrophobicContact CG2-CD2 4.35Å; I190-Y315 HydrophobicContact CG2-CE2 3.6Å; L193-Y315 HydrophobicContact CB-CD2 4.08Å; Y194-Y315 HydrophobicContact CD2-CD2 4.45Å; Y194-Y315 AromaticContact CD2-CE2 3.78Å; Y194-Y315 HydrophobicContact CD2-CE2 3.78Å; Y194-Y315 HydrophobicContact CG-CE2 4.2Å; V197-Y315 HydrophobicContact CG2-CG 4.22Å; A311-Y315 WeakPolarHBondContact O-CB 3.4Å; A311-Y315 PolarHBondContact O-N 3.44Å; L312-Y315 PolarHBondContact O-N 3.19Å; S313-Y315 PolarHBondContact O-N 3.21Å; Y315-N317 VanDerWaalsContact C-N 3.32Å; Y315-N317 PolarHBondContact O-N 2.66Å; Y315-E318 PolarHBondContact O-N 3.23Å; Y315-L319 HydrophobicContact CE1-CD2 4.14Å; Y315-L319 WeakPolarHBondContact O-CB 3.41Å; Y315-L319 PolarHBondContact O-N 3.49Å
316	F	92.2	Very high	92.5	Very high	53 Å²	53	58 Å²	58	23%	0.232	28%	0.277	C	S	.	.	H	α-helix	trans	-69.1	-29.4	-178.5	-74.6	-55.1	0	0	0	113.3	R50 I53 L312 S313 L319 N320	R50-F316 HydrophobicContact CG-CE1 3.59Å; R50-F316 HydrophobicContact CG-CZ 3.92Å; I53-F316 HydrophobicContact CD1-CE1 4.03Å; I53-F316 HydrophobicContact CD1-CE2 4.36Å; I53-F316 HydrophobicContact CD1-CZ 3.67Å; L312-F316 HydrophobicContact CB-CD2 4.39Å; L312-F316 HydrophobicContact CB-CE2 4.38Å; L312-F316 HydrophobicContact CD2-CE2 3.98Å; L312-F316 WeakPolarHBondContact O-CD2 3.31Å; L312-F316 PolarHBondContact O-N 3.11Å; S313-F316 PolarHBondContact O-N 3.48Å; F316-L319 HydrophobicContact CD1-CD2 4.07Å; F316-L319 HydrophobicContact CE1-CD2 4.42Å; F316-N320 PolarHBondContact O-N 2.84Å; F316-N320 PolarHBondContact O-ND2 3.44Å; F316-N320 VanDerWaalsContact O-ND2 3.14Å
317	N	94.2	Very high	92.2	Very high	92 Å²	92	52.8 Å²	52.8	49%	0.492	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-49.2	172.2	-72.7	-22.4	0	0	0	111.1	S313 K314 Y315 L319 N320 D321	S313-N317 WeakPolarHBondContact O-CB 3.42Å; S313-N317 PolarHBondContact O-N 3.11Å; S313-N317 PolarHBondContact O-ND2 3.16Å; K314-N317 PolarHBondContact O-N 3.4Å; Y315-N317 VanDerWaalsContact C-N 3.32Å; Y315-N317 PolarHBondContact O-N 2.66Å; N317-L319 VanDerWaalsContact C-N 3.31Å; N317-L319 PolarHBondContact O-N 2.86Å; N317-N320 WeakPolarHBondContact O-CB 3.38Å; N317-N320 PolarHBondContact O-N 3.4Å; N317-N320 VanDerWaalsContact O-N 3.15Å; N317-D321 PolarHBondContact O-N 3.11Å
318	E	94.2	Very high	91.9	Very high	34 Å²	34	51.5 Å²	51.5	16%	0.159	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-38.6	176.1	-174.7	72.3	-155	0	0	111.2	S186 R189 I190 L193 K314 Y315 N320 D321 Q322	S186-E318 PolarHBondContact OG-OE1 3.46Å; R189-E318 HydrophobicContact CB-CG 4.23Å; R189-E318 IonicContact CZ-OE1 2.67Å; R189-E318 VanDerWaalsContact CZ-OE1 3.3Å; R189-E318 IonicContact NE-OE1 3.2Å; R189-E318 PolarHBondContact NE-OE1 2.94Å; R189-E318 IonicContact NE-OE2 3.91Å; R189-E318 IonicContact NH2-OE1 2.84Å; R189-E318 PolarHBondContact NH2-OE1 2.93Å; I190-E318 HydrophobicContact CD1-CG 4.13Å; I190-E318 HydrophobicContact CG1-CB 4.09Å; I190-E318 HydrophobicContact CG1-CG 3.47Å; I190-E318 VanDerWaalsContact CG1-CG 3.47Å; L193-E318 HydrophobicContact CD1-CB 3.62Å; L193-E318 HydrophobicContact CD1-CG 4.04Å; K314-E318 PolarHBondContact O-N 3.18Å; Y315-E318 PolarHBondContact O-N 3.23Å; E318-N320 VanDerWaalsContact C-N 3.3Å; E318-N320 PolarHBondContact O-N 2.91Å; E318-D321 PolarHBondContact O-N 3.07Å; E318-Q322 WeakPolarHBondContact O-CB 3.43Å; E318-Q322 PolarHBondContact O-N 3Å
319	L	91.9	Very high	91.9	Very high	2 Å²	2	51 Å²	51	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-39.5	174.3	-178.5	62.8	0	0	0	112.2	K46 E49 I190 Y315 F316 N317 N323	K46-L319 HydrophobicContact CG-CD2 4.47Å; E49-L319 HydrophobicContact CB-CD1 4.43Å; E49-L319 HydrophobicContact CB-CD2 3.65Å; E49-L319 HydrophobicContact CG-CD1 3.88Å; E49-L319 HydrophobicContact CG-CD2 4.04Å; I190-L319 HydrophobicContact CD1-CB 4.35Å; I190-L319 HydrophobicContact CD1-CD1 4.15Å; Y315-L319 HydrophobicContact CE1-CD2 4.14Å; Y315-L319 WeakPolarHBondContact O-CB 3.41Å; Y315-L319 PolarHBondContact O-N 3.49Å; F316-L319 HydrophobicContact CD1-CD2 4.07Å; F316-L319 HydrophobicContact CE1-CD2 4.42Å; N317-L319 VanDerWaalsContact C-N 3.31Å; N317-L319 PolarHBondContact O-N 2.86Å; L319-N323 WeakPolarHBondContact O-CB 3.36Å; L319-N323 PolarHBondContact O-N 2.97Å; L319-N323 PolarHBondContact O-ND2 3.26Å
320	N	91.2	Very high	91.7	Very high	58 Å²	58	43.5 Å²	43.5	31%	0.31	23%	0.225	S	C	.	.	H	α-helix	trans	-66.9	-41.2	176	-78.4	-37.6	0	0	0	111.9	K46 F316 N317 E318 N323 K324	K46-N320 VanDerWaalsContact CE-OD1 3.28Å; K46-N320 WeakPolarHBondContact CE-OD1 3.36Å; K46-N320 PolarHBondContact NZ-OD1 2.95Å; F316-N320 PolarHBondContact O-N 2.84Å; F316-N320 PolarHBondContact O-ND2 3.44Å; F316-N320 VanDerWaalsContact O-ND2 3.14Å; N317-N320 WeakPolarHBondContact O-CB 3.38Å; N317-N320 PolarHBondContact O-N 3.4Å; N317-N320 VanDerWaalsContact O-N 3.15Å; E318-N320 VanDerWaalsContact C-N 3.3Å; E318-N320 PolarHBondContact O-N 2.91Å; N320-N323 PolarHBondContact O-N 3.49Å; N320-K324 WeakPolarHBondContact O-CG 3.45Å; N320-K324 PolarHBondContact O-N 3.44Å
321	D	91.2	Very high	91.3	Very high	73 Å²	73	41.6 Å²	41.6	39%	0.39	21%	0.214	S	C	.	.	H	α-helix	trans	-69.1	-40.5	178	-71.9	-21.4	0	0	0	111.9	N317 E318 N323 K324 I325	N317-D321 PolarHBondContact O-N 3.11Å; E318-D321 PolarHBondContact O-N 3.07Å; D321-N323 VanDerWaalsContact C-N 3.28Å; D321-N323 PolarHBondContact O-N 2.88Å; D321-K324 WeakPolarHBondContact O-CB 3.26Å; D321-K324 PolarHBondContact O-N 3.16Å; D321-K324 VanDerWaalsContact O-N 3.09Å; D321-K324 IonicContact OD1-NZ 3.6Å; D321-K324 PolarHBondContact OD1-NZ 3.5Å; D321-I325 WeakPolarHBondContact O-CG1 3.22Å; D321-I325 PolarHBondContact O-N 3.42Å
322	Q	92.7	Very high	91	Very high	10 Å²	10	44.5 Å²	44.5	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-57	-41.6	171.8	-166.1	-145.6	0.3	0	0	112	Y183 S186 K187 I190 E318 K324 I325 L326	Y183-Q322 HydrophobicContact CD2-CG 3.86Å; Y183-Q322 HydrophobicContact CE2-CG 3.61Å; Y183-Q322 PolarHBondContact OH-NE2 3.16Å; S186-Q322 VanDerWaalsContact OG-CB 3.27Å; S186-Q322 WeakPolarHBondContact OG-CB 3.45Å; S186-Q322 WeakPolarHBondContact OG-CG 3.45Å; K187-Q322 VanDerWaalsContact CE-NE2 3.33Å; I190-Q322 HydrophobicContact CD1-CB 3.51Å; I190-Q322 HydrophobicContact CD1-CG 3.73Å; E318-Q322 WeakPolarHBondContact O-CB 3.43Å; E318-Q322 PolarHBondContact O-N 3Å; Q322-K324 VanDerWaalsContact C-N 3.33Å; Q322-K324 PolarHBondContact O-N 3.16Å; Q322-I325 PolarHBondContact O-N 3.21Å; Q322-L326 WeakPolarHBondContact O-CB 3.45Å; Q322-L326 PolarHBondContact O-N 3.38Å
323	N	89.5	Confident	90.9	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-67.3	-31.1	177.3	-81	-54.8	0	0	0	113.1	K46 L319 N320 D321 S327	K46-N323 WeakPolarHBondContact CE-ND2 3.27Å; K46-N323 WeakPolarHBondContact CG-ND2 3.49Å; L319-N323 WeakPolarHBondContact O-CB 3.36Å; L319-N323 PolarHBondContact O-N 2.97Å; L319-N323 PolarHBondContact O-ND2 3.26Å; N320-N323 PolarHBondContact O-N 3.49Å; D321-N323 VanDerWaalsContact C-N 3.28Å; D321-N323 PolarHBondContact O-N 2.88Å; N323-S327 WeakPolarHBondContact O-CB 3.01Å; N323-S327 PolarHBondContact O-N 3.15Å; N323-S327 PolarHBondContact O-OG 2.83Å
324	K	89	Confident	90.6	Very high	123 Å²	123	41 Å²	41	54%	0.535	20%	0.2	S	C	.	.	H	α-helix	trans	-67.7	-44.2	171.4	-64.9	169.7	-166.2	157.4	0	110.8	N320 D321 Q322 L326 S327 N328	N320-K324 WeakPolarHBondContact O-CG 3.45Å; N320-K324 PolarHBondContact O-N 3.44Å; D321-K324 WeakPolarHBondContact O-CB 3.26Å; D321-K324 PolarHBondContact O-N 3.16Å; D321-K324 VanDerWaalsContact O-N 3.09Å; D321-K324 IonicContact OD1-NZ 3.6Å; D321-K324 PolarHBondContact OD1-NZ 3.5Å; Q322-K324 VanDerWaalsContact C-N 3.33Å; Q322-K324 PolarHBondContact O-N 3.16Å; K324-L326 VanDerWaalsContact C-N 3.34Å; K324-S327 PolarHBondContact O-N 3.26Å; K324-N328 PolarHBondContact O-N 3.35Å
325	I	89.1	Confident	90.1	Very high	29 Å²	29	36.1 Å²	36.1	15%	0.149	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-46.4	175.4	-61.3	166.6	0	0	0	109.9	E182 Y183 D321 Q322 S327 N328 M329	E182-I325 HydrophobicContact CB-CG2 4.25Å; Y183-I325 HydrophobicContact CD2-CG2 4.33Å; D321-I325 WeakPolarHBondContact O-CG1 3.22Å; D321-I325 PolarHBondContact O-N 3.42Å; Q322-I325 PolarHBondContact O-N 3.21Å; I325-S327 PolarHBondContact O-N 2.86Å; I325-N328 PolarHBondContact O-N 3.24Å; I325-M329 VanDerWaalsContact O-CB 3.31Å; I325-M329 WeakPolarHBondContact O-CB 3.33Å; I325-M329 PolarHBondContact O-N 3.15Å
326	L	90	Very high	89.9	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-57.2	-48.8	175.8	176.7	59	0	0	0	111.7	Y41 T42 I45 Y183 Q322 K324 N328 M329 E330	Y41-L326 HydrophobicContact CE1-CD2 4.09Å; T42-L326 HydrophobicContact CG2-CD2 4.11Å; T42-L326 HydrophobicContact CG2-CG 4.41Å; I45-L326 HydrophobicContact CD1-CD2 3.29Å; Y183-L326 HydrophobicContact CD2-CB 4.18Å; Y183-L326 HydrophobicContact CE1-CD1 4.43Å; Y183-L326 HydrophobicContact CE2-CB 3.67Å; Y183-L326 HydrophobicContact CE2-CD1 4.15Å; Y183-L326 HydrophobicContact CE2-CD2 4.44Å; Y183-L326 HydrophobicContact CE2-CG 4.3Å; Q322-L326 WeakPolarHBondContact O-CB 3.45Å; Q322-L326 PolarHBondContact O-N 3.38Å; K324-L326 VanDerWaalsContact C-N 3.34Å; L326-N328 VanDerWaalsContact C-N 3.31Å; L326-N328 PolarHBondContact O-N 2.78Å; L326-M329 HydrophobicContact CD1-CE 3.44Å; L326-M329 VanDerWaalsContact CD1-CE 3.44Å; L326-M329 WeakPolarHBondContact O-CB 3.31Å; L326-M329 PolarHBondContact O-N 3.24Å; L326-M329 VanDerWaalsContact O-N 3.15Å; L326-E330 HydrophobicContact CD1-CG 3.95Å; L326-E330 HydrophobicContact CG-CG 4.44Å; L326-E330 WeakPolarHBondContact O-CG 3.02Å; L326-E330 PolarHBondContact O-N 3.21Å
327	S	88	Confident	89.9	Confident	26 Å²	26	33.8 Å²	33.8	18%	0.182	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-46.1	179	-59.3	0	0	0	0	111.4	N323 K324 I325 M329 E330 I331	N323-S327 WeakPolarHBondContact O-CB 3.01Å; N323-S327 PolarHBondContact O-N 3.15Å; N323-S327 PolarHBondContact O-OG 2.83Å; K324-S327 PolarHBondContact O-N 3.26Å; I325-S327 PolarHBondContact O-N 2.86Å; S327-M329 VanDerWaalsContact C-N 3.34Å; S327-M329 PolarHBondContact O-N 3.04Å; S327-E330 PolarHBondContact O-N 3.09Å; S327-I331 WeakPolarHBondContact O-CD1 3.46Å; S327-I331 VanDerWaalsContact O-CG1 3.25Å; S327-I331 WeakPolarHBondContact O-CG1 3.33Å; S327-I331 PolarHBondContact O-N 3Å
328	N	88.1	Confident	89.5	Confident	86 Å²	86	31.5 Å²	31.5	46%	0.46	16%	0.157	S	C	.	.	H	α-helix	trans	-64	-40.6	177	-70.4	-17.4	0	0	0	111.9	L179 K324 I325 L326 I331 K332	L179-N328 HydrophobicContact CD1-CB 4.24Å; L179-N328 HydrophobicContact CD2-CB 4.48Å; K324-N328 PolarHBondContact O-N 3.35Å; I325-N328 PolarHBondContact O-N 3.24Å; L326-N328 VanDerWaalsContact C-N 3.31Å; L326-N328 PolarHBondContact O-N 2.78Å; N328-I331 PolarHBondContact O-N 3.33Å; N328-K332 WeakPolarHBondContact O-CG 3.45Å; N328-K332 PolarHBondContact O-N 2.75Å
329	M	90.5	Very high	89.1	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-46.2	177.1	-173.8	-176.4	66	0	0	111.1	L176 L179 E180 Y183 I325 L326 S327 I331 K332 R333	L176-M329 HydrophobicContact CD1-CG 3.64Å; L176-M329 WeakPolarHBondContact CD1-O 3.44Å; L179-M329 HydrophobicContact CB-CB 4.19Å; L179-M329 HydrophobicContact CB-CG 4.32Å; E180-M329 HydrophobicContact CB-SD 4.23Å; E180-M329 HydrophobicContact CG-CG 3.99Å; E180-M329 HydrophobicContact CG-SD 3.46Å; E180-M329 WeakPolarHBondContact CG-SD 3.32Å; Y183-M329 HydrophobicContact CD1-CE 3.83Å; Y183-M329 HydrophobicContact CD1-SD 4.09Å; Y183-M329 HydrophobicContact CE1-CE 4.04Å; Y183-M329 HydrophobicContact CG-CE 4.19Å; Y183-M329 HydrophobicContact CG-SD 4.22Å; I325-M329 VanDerWaalsContact O-CB 3.31Å; I325-M329 WeakPolarHBondContact O-CB 3.33Å; I325-M329 PolarHBondContact O-N 3.15Å; L326-M329 HydrophobicContact CD1-CE 3.44Å; L326-M329 VanDerWaalsContact CD1-CE 3.44Å; L326-M329 WeakPolarHBondContact O-CB 3.31Å; L326-M329 PolarHBondContact O-N 3.24Å; L326-M329 VanDerWaalsContact O-N 3.15Å; S327-M329 VanDerWaalsContact C-N 3.34Å; S327-M329 PolarHBondContact O-N 3.04Å; M329-I331 PolarHBondContact O-N 2.76Å; M329-K332 CarbonylContact O-C 3.53Å; M329-K332 PolarHBondContact O-N 2.73Å; M329-K332 VanDerWaalsContact O-N 3.14Å; M329-R333 WeakPolarHBondContact O-CG 3.48Å; M329-R333 PolarHBondContact O-N 2.92Å
330	E	90	Very high	89	Confident	3 Å²	3	33.7 Å²	33.7	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-38.7	177.5	-67.6	-58.8	152.4	0	0	112	L38 R139 F142 L326 S327 K332 R333 I334	L38-E330 HydrophobicContact CD1-CB 3.8Å; L38-E330 HydrophobicContact CD1-CG 4Å; L38-E330 HydrophobicContact CD2-CB 4.31Å; R139-E330 IonicContact CZ-OE1 3.55Å; R139-E330 IonicContact CZ-OE2 3.99Å; R139-E330 VanDerWaalsContact NH1-CD 3.33Å; R139-E330 IonicContact NH1-OE1 2.81Å; R139-E330 PolarHBondContact NH1-OE1 3.18Å; R139-E330 IonicContact NH1-OE2 3.74Å; R139-E330 IonicContact NH2-OE1 3.39Å; R139-E330 IonicContact NH2-OE2 2.89Å; R139-E330 PolarHBondContact NH2-OE2 2.96Å; F142-E330 HydrophobicContact CE1-CB 4.06Å; F142-E330 HydrophobicContact CE1-CG 4.24Å; F142-E330 HydrophobicContact CZ-CB 3.94Å; L326-E330 HydrophobicContact CD1-CG 3.95Å; L326-E330 HydrophobicContact CG-CG 4.44Å; L326-E330 WeakPolarHBondContact O-CG 3.02Å; L326-E330 PolarHBondContact O-N 3.21Å; S327-E330 PolarHBondContact O-N 3.09Å; E330-K332 VanDerWaalsContact C-N 3.3Å; E330-K332 PolarHBondContact O-N 2.96Å; E330-R333 WeakPolarHBondContact O-CB 3.33Å; E330-R333 PolarHBondContact O-N 3.35Å; E330-R333 VanDerWaalsContact O-N 3.11Å; E330-R333 IonicContact OE1-CZ 2.67Å; E330-R333 IonicContact OE1-NH1 3Å; E330-R333 PolarHBondContact OE1-NH1 2.93Å; E330-R333 WeakPolarHBondContact OE2-CD 3.49Å; E330-I334 WeakPolarHBondContact O-CG1 3.24Å; E330-I334 PolarHBondContact O-N 3.35Å; E330-I334 VanDerWaalsContact O-N 3.11Å
331	I	87.6	Confident	88.9	Confident	38 Å²	38	33.7 Å²	33.7	20%	0.195	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-42.6	171.8	-66.4	160.8	0	0	0	110.6	Y35 L38 S327 N328 M329 R333 I334 D335	Y35-I331 HydrophobicContact CD1-CD1 4.31Å; Y35-I331 HydrophobicContact CD1-CG1 4.5Å; Y35-I331 HydrophobicContact CE1-CD1 3.65Å; Y35-I331 HydrophobicContact CE1-CG1 3.82Å; L38-I331 HydrophobicContact CD2-CD1 4.3Å; L38-I331 HydrophobicContact CD2-CG1 3.91Å; S327-I331 WeakPolarHBondContact O-CD1 3.46Å; S327-I331 VanDerWaalsContact O-CG1 3.25Å; S327-I331 WeakPolarHBondContact O-CG1 3.33Å; S327-I331 PolarHBondContact O-N 3Å; N328-I331 PolarHBondContact O-N 3.33Å; M329-I331 PolarHBondContact O-N 2.76Å; I331-R333 VanDerWaalsContact C-N 3.31Å; I331-R333 PolarHBondContact O-N 3.41Å; I331-I334 WeakPolarHBondContact O-CB 3.07Å; I331-I334 PolarHBondContact O-N 2.83Å; I331-D335 PolarHBondContact O-N 2.9Å
332	K	85.9	Confident	88.6	Confident	75 Å²	75	34.3 Å²	34.3	33%	0.326	18%	0.184	S	C	.	.	H	α-helix	trans	-68.7	-26.3	175.3	-67.8	-46.8	-179.4	-171.5	0	113.8	L176 L179 N328 M329 E330 D335 V336	L176-K332 HydrophobicContact CB-CB 4.35Å; L176-K332 HydrophobicContact CD1-CB 4.07Å; L179-K332 HydrophobicContact CD1-CB 4.24Å; L179-K332 HydrophobicContact CD1-CG 3.61Å; N328-K332 WeakPolarHBondContact O-CG 3.45Å; N328-K332 PolarHBondContact O-N 2.75Å; M329-K332 CarbonylContact O-C 3.53Å; M329-K332 PolarHBondContact O-N 2.73Å; M329-K332 VanDerWaalsContact O-N 3.14Å; E330-K332 VanDerWaalsContact C-N 3.3Å; E330-K332 PolarHBondContact O-N 2.96Å; K332-D335 WeakPolarHBondContact CD-OD2 2.91Å; K332-D335 IonicContact NZ-OD2 3.51Å; K332-D335 PolarHBondContact NZ-OD2 3.15Å; K332-D335 WeakPolarHBondContact O-CB 3.32Å; K332-D335 PolarHBondContact O-N 3.06Å; K332-V336 WeakPolarHBondContact O-CG2 3.2Å; K332-V336 PolarHBondContact O-N 3.47Å; K332-V336 VanDerWaalsContact O-N 3.17Å
333	R	90.8	Very high	88.4	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-41.6	170.2	-74	171.2	173.4	174.9	-6.7	110.9	L176 E180 M329 E330 I331 D335 V336 L337 M348 E355	L176-R333 HydrophobicContact CD1-CG 3.68Å; L176-R333 HydrophobicContact CD2-CG 3.76Å; L176-R333 HydrophobicContact CG-CG 4.39Å; E180-R333 IonicContact OE1-CZ 3.71Å; E180-R333 IonicContact OE1-NE 3.61Å; E180-R333 IonicContact OE1-NH2 2.87Å; E180-R333 PolarHBondContact OE1-NH2 3.06Å; M329-R333 WeakPolarHBondContact O-CG 3.48Å; M329-R333 PolarHBondContact O-N 2.92Å; E330-R333 WeakPolarHBondContact O-CB 3.33Å; E330-R333 PolarHBondContact O-N 3.35Å; E330-R333 VanDerWaalsContact O-N 3.11Å; E330-R333 IonicContact OE1-CZ 2.67Å; E330-R333 IonicContact OE1-NH1 3Å; E330-R333 PolarHBondContact OE1-NH1 2.93Å; E330-R333 WeakPolarHBondContact OE2-CD 3.49Å; I331-R333 VanDerWaalsContact C-N 3.31Å; I331-R333 PolarHBondContact O-N 3.41Å; R333-D335 PolarHBondContact O-N 3.03Å; R333-V336 PolarHBondContact O-N 3.39Å; R333-V336 VanDerWaalsContact O-N 3.11Å; R333-L337 WeakPolarHBondContact O-CB 3.26Å; R333-L337 VanDerWaalsContact O-CG 3.25Å; R333-L337 WeakPolarHBondContact O-CG 3.25Å; R333-L337 PolarHBondContact O-N 3.27Å; R333-M348 HydrophobicContact CG-CE 4.09Å; R333-E355 IonicContact CZ-OE2 2.94Å; R333-E355 IonicContact NH2-OE2 3.72Å; R333-E355 PolarHBondContact NH2-OE2 3.46Å
334	I	88.7	Confident	88.6	Confident	12 Å²	12	44.1 Å²	44.1	6%	0.062	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-48.1	174.7	-58.4	173.2	0	0	0	110.4	I34 F142 T146 Y149 E330 I331 V336 L337 E338	I34-I334 HydrophobicContact CG2-CD1 3.52Å; F142-I334 HydrophobicContact CE2-CD1 4.28Å; F142-I334 HydrophobicContact CZ-CD1 4.15Å; T146-I334 HydrophobicContact CG2-CD1 4.28Å; T146-I334 HydrophobicContact CG2-CG1 3.82Å; T146-I334 HydrophobicContact CG2-CG2 4.45Å; Y149-I334 HydrophobicContact CD1-CG2 4.2Å; Y149-I334 HydrophobicContact CE1-CG2 4.01Å; E330-I334 WeakPolarHBondContact O-CG1 3.24Å; E330-I334 PolarHBondContact O-N 3.35Å; E330-I334 VanDerWaalsContact O-N 3.11Å; I331-I334 WeakPolarHBondContact O-CB 3.07Å; I331-I334 PolarHBondContact O-N 2.83Å; I334-V336 PolarHBondContact O-N 3.3Å; I334-V336 VanDerWaalsContact O-N 3.14Å; I334-L337 PolarHBondContact O-N 3.46Å; I334-E338 WeakPolarHBondContact O-CG 3.32Å; I334-E338 PolarHBondContact O-N 3.34Å
335	D	84.7	Confident	88.7	Confident	33 Å²	33	39.7 Å²	39.7	18%	0.176	21%	0.207	C	C	.	.	H	α-helix	trans	-53.6	-36.6	176.1	-70.8	-13.9	0	0	0	111.9	R172 I331 K332 R333	R172-D335 VanDerWaalsContact CD-O 3.27Å; R172-D335 WeakPolarHBondContact CD-O 3.41Å; R172-D335 PolarHBondContact NH1-O 3.04Å; I331-D335 PolarHBondContact O-N 2.9Å; K332-D335 WeakPolarHBondContact CD-OD2 2.91Å; K332-D335 IonicContact NZ-OD2 3.51Å; K332-D335 PolarHBondContact NZ-OD2 3.15Å; K332-D335 WeakPolarHBondContact O-CB 3.32Å; K332-D335 PolarHBondContact O-N 3.06Å; R333-D335 PolarHBondContact O-N 3.03Å
336	V	89.3	Confident	88.9	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-75.4	-47.5	176.6	173.2	0	0	0	0	111	L169 R172 K173 L176 K332 R333 I334 E338 L339 L340	L169-V336 HydrophobicContact CD1-CG1 4.1Å; R172-V336 HydrophobicContact CB-CG2 3.92Å; K173-V336 HydrophobicContact CG-CG1 4.16Å; K173-V336 HydrophobicContact CG-CG2 4.28Å; L176-V336 HydrophobicContact CB-CG2 4.46Å; L176-V336 HydrophobicContact CD2-CG2 4.03Å; K332-V336 WeakPolarHBondContact O-CG2 3.2Å; K332-V336 PolarHBondContact O-N 3.47Å; K332-V336 VanDerWaalsContact O-N 3.17Å; R333-V336 PolarHBondContact O-N 3.39Å; R333-V336 VanDerWaalsContact O-N 3.11Å; I334-V336 PolarHBondContact O-N 3.3Å; I334-V336 VanDerWaalsContact O-N 3.14Å; V336-E338 PolarHBondContact O-N 2.83Å; V336-L339 PolarHBondContact O-N 3.33Å; V336-L340 HydrophobicContact CG1-CD1 3.95Å; V336-L340 HydrophobicContact CG1-CG 4.19Å; V336-L340 WeakPolarHBondContact O-CG 3.28Å; V336-L340 PolarHBondContact O-N 3.46Å
337	L	90.4	Very high	89	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-58.3	-33.5	-177.9	-72.3	167.2	0	0	0	112.9	T146 L150 R333 I334 L339 L340 R345 M348 Y349	T146-L337 HydrophobicContact CG2-CD1 4.25Å; L150-L337 HydrophobicContact CD1-CB 3.8Å; L150-L337 HydrophobicContact CD1-CD1 4.36Å; L150-L337 HydrophobicContact CD2-CB 4.26Å; R333-L337 WeakPolarHBondContact O-CB 3.26Å; R333-L337 VanDerWaalsContact O-CG 3.25Å; R333-L337 WeakPolarHBondContact O-CG 3.25Å; R333-L337 PolarHBondContact O-N 3.27Å; I334-L337 PolarHBondContact O-N 3.46Å; L337-L339 PolarHBondContact O-N 3.45Å; L337-L340 HydrophobicContact CD2-CD1 4.42Å; L337-L340 PolarHBondContact O-N 2.81Å; L337-L340 VanDerWaalsContact O-N 3.16Å; L337-R345 HydrophobicContact CD2-CB 3.95Å; L337-R345 HydrophobicContact CD2-CG 3.73Å; L337-R345 PolarHBondContact O-NE 3.04Å; L337-R345 PolarHBondContact O-NH2 3.41Å; L337-M348 HydrophobicContact CD2-CB 3.98Å; L337-M348 HydrophobicContact CD2-CG 4.01Å; L337-Y349 HydrophobicContact CD1-CE1 4.48Å
338	E	86.5	Confident	89.3	Confident	43 Å²	43	46.7 Å²	46.7	20%	0.201	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-36.3	173.2	-77	177.2	-179.4	0	0	113.1	Y149 L150 L153 R172 I334 V336	Y149-E338 HydrophobicContact CE1-CG 4.36Å; Y149-E338 PolarHBondContact OH-OE1 3.41Å; L150-E338 HydrophobicContact CD2-CB 4.46Å; L150-E338 HydrophobicContact CD2-CG 3.97Å; L153-E338 HydrophobicContact CD1-CG 4.01Å; R172-E338 IonicContact NH1-OE2 2.81Å; R172-E338 PolarHBondContact NH1-OE2 3.21Å; I334-E338 WeakPolarHBondContact O-CG 3.32Å; I334-E338 PolarHBondContact O-N 3.34Å; V336-E338 PolarHBondContact O-N 2.83Å
339	L	87	Confident	89.6	Confident	71 Å²	71	42.7 Å²	42.7	37%	0.372	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-3.7	-174.8	-60.7	-175.9	0	0	0	113.6	L169 V336 L337	L169-L339 HydrophobicContact CB-CD1 4.06Å; L169-L339 HydrophobicContact CD1-CB 4.03Å; L169-L339 HydrophobicContact CD1-CD1 4.26Å; V336-L339 PolarHBondContact O-N 3.33Å; L337-L339 PolarHBondContact O-N 3.45Å
340	L	89	Confident	89.8	Confident	11 Å²	11	46 Å²	46	6%	0.058	23%	0.225	C	C	.	.	S	Bend	trans	-92.3	144	-179.3	-67.4	-174	0	0	0	111.4	L169 V336 L337 E344 R345 M348	L169-L340 HydrophobicContact CD1-CD2 4.2Å; L169-L340 HydrophobicContact CD2-CD2 4.17Å; V336-L340 HydrophobicContact CG1-CD1 3.95Å; V336-L340 HydrophobicContact CG1-CG 4.19Å; V336-L340 WeakPolarHBondContact O-CG 3.28Å; V336-L340 PolarHBondContact O-N 3.46Å; L337-L340 HydrophobicContact CD2-CD1 4.42Å; L337-L340 PolarHBondContact O-N 2.81Å; L337-L340 VanDerWaalsContact O-N 3.16Å; L340-E344 HydrophobicContact CB-CB 3.84Å; L340-E344 HydrophobicContact CD1-CB 4.17Å; L340-E344 HydrophobicContact CD2-CB 4.03Å; L340-E344 HydrophobicContact CG-CB 4.21Å; L340-R345 HydrophobicContact CB-CG 3.88Å; L340-R345 PolarHBondContact O-NE 3.47Å; L340-R345 VanDerWaalsContact O-NE 3.11Å; L340-R345 PolarHBondContact O-NH2 2.83Å; L340-M348 HydrophobicContact CD1-CB 4.35Å
341	S	88.3	Confident	89.9	Confident	59 Å²	59	48.5 Å²	48.5	41%	0.413	24%	0.243	S	C	.	.			trans	-65.1	160.6	166.7	65.7	0	0	0	0	111.3	K343 E344 R345	S341-K343 PolarHBondContact O-N 2.74Å; S341-K343 VanDerWaalsContact O-N 3.17Å; S341-E344 VanDerWaalsContact CB-OE2 3.31Å; S341-E344 WeakPolarHBondContact CB-OE2 3.41Å; S341-E344 PolarHBondContact N-OE2 2.91Å; S341-E344 PolarHBondContact O-N 3.25Å; S341-E344 VanDerWaalsContact OG-CG 3.32Å; S341-E344 WeakPolarHBondContact OG-CG 3.29Å; S341-E344 PolarHBondContact OG-N 3.29Å; S341-E344 PolarHBondContact OG-OE2 3.45Å; S341-R345 WeakPolarHBondContact O-CG 3.22Å; S341-R345 PolarHBondContact O-N 3.03Å
342	S	86	Confident	90.1	Very high	86 Å²	86	46.8 Å²	46.8	60%	0.601	23%	0.234	S	C	*	.	H	α-helix	trans	-54	-39.2	178.7	-49.9	0	0	0	0	112.8	R345 I346	S342-R345 PolarHBondContact O-N 2.99Å; S342-I346 WeakPolarHBondContact O-CG1 3.41Å; S342-I346 PolarHBondContact O-N 3.24Å; S342-I346 VanDerWaalsContact O-N 3.16Å
343	K	88.2	Confident	90.5	Very high	143 Å²	143	44.1 Å²	44.1	62%	0.622	22%	0.223	S	C	*	.	H	α-helix	trans	-66.6	-37	177.2	-173.4	174.1	-177.7	173.6	0	112.7	S341 R347	S341-K343 PolarHBondContact O-N 2.74Å; S341-K343 VanDerWaalsContact O-N 3.17Å; K343-R347 PolarHBondContact O-N 3Å
344	E	92.9	Very high	90.5	Very high	77 Å²	77	48.7 Å²	48.7	36%	0.36	25%	0.245	S	C	.	.	H	α-helix	trans	-73.3	-32.8	176.5	-70.3	167.2	122.6	0	0	112	L340 S341 R347 M348	L340-E344 HydrophobicContact CB-CB 3.84Å; L340-E344 HydrophobicContact CD1-CB 4.17Å; L340-E344 HydrophobicContact CD2-CB 4.03Å; L340-E344 HydrophobicContact CG-CB 4.21Å; S341-E344 VanDerWaalsContact CB-OE2 3.31Å; S341-E344 WeakPolarHBondContact CB-OE2 3.41Å; S341-E344 PolarHBondContact N-OE2 2.91Å; S341-E344 PolarHBondContact O-N 3.25Å; S341-E344 VanDerWaalsContact OG-CG 3.32Å; S341-E344 WeakPolarHBondContact OG-CG 3.29Å; S341-E344 PolarHBondContact OG-N 3.29Å; S341-E344 PolarHBondContact OG-OE2 3.45Å; E344-R347 PolarHBondContact O-N 2.97Å; E344-M348 PolarHBondContact O-N 2.61Å
345	R	92.5	Very high	90.4	Very high	29 Å²	29	50 Å²	50	11%	0.109	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-42.2	173.3	-65.5	177.9	-175.2	167.3	1.9	111.9	L337 L340 S341 S342 R347 M348 Y349	L337-R345 HydrophobicContact CD2-CB 3.95Å; L337-R345 HydrophobicContact CD2-CG 3.73Å; L337-R345 PolarHBondContact O-NE 3.04Å; L337-R345 PolarHBondContact O-NH2 3.41Å; L340-R345 HydrophobicContact CB-CG 3.88Å; L340-R345 PolarHBondContact O-NE 3.47Å; L340-R345 VanDerWaalsContact O-NE 3.11Å; L340-R345 PolarHBondContact O-NH2 2.83Å; S341-R345 WeakPolarHBondContact O-CG 3.22Å; S341-R345 PolarHBondContact O-N 3.03Å; S342-R345 PolarHBondContact O-N 2.99Å; R345-R347 VanDerWaalsContact C-N 3.34Å; R345-R347 PolarHBondContact O-N 3.39Å; R345-M348 WeakPolarHBondContact O-CB 3.3Å; R345-M348 PolarHBondContact O-N 3.27Å; R345-M348 VanDerWaalsContact O-N 3.1Å; R345-Y349 VanDerWaalsContact O-CD2 3.23Å; R345-Y349 WeakPolarHBondContact O-CD2 3.25Å; R345-Y349 PolarHBondContact O-N 3.26Å
346	I	91.8	Very high	90.5	Very high	24 Å²	24	48.9 Å²	48.9	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-54.4	-51.1	174.2	-68.2	168.6	0	0	0	110.5	F90 L100 S342 M348 Y349 E350	F90-I346 HydrophobicContact CD1-CG1 4.27Å; F90-I346 HydrophobicContact CE1-CB 4.07Å; F90-I346 HydrophobicContact CE1-CG1 3.6Å; F90-I346 HydrophobicContact CE1-CG2 4.04Å; F90-I346 HydrophobicContact CE2-CG2 4.25Å; F90-I346 HydrophobicContact CZ-CB 4.06Å; F90-I346 HydrophobicContact CZ-CG1 4.11Å; F90-I346 HydrophobicContact CZ-CG2 3.66Å; L100-I346 HydrophobicContact CD1-CG2 4.44Å; L100-I346 HydrophobicContact CD2-CD1 4.14Å; S342-I346 WeakPolarHBondContact O-CG1 3.41Å; S342-I346 PolarHBondContact O-N 3.24Å; S342-I346 VanDerWaalsContact O-N 3.16Å; I346-M348 VanDerWaalsContact C-N 3.26Å; I346-M348 PolarHBondContact O-N 2.84Å; I346-Y349 PolarHBondContact O-N 2.97Å; I346-Y349 VanDerWaalsContact O-N 3.16Å; I346-E350 WeakPolarHBondContact O-CG 3.25Å; I346-E350 PolarHBondContact O-N 3.36Å
347	R	93.3	Very high	90.4	Very high	151 Å²	151	50.2 Å²	50.2	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-61.7	-33.9	177.9	-67.7	177.4	179.1	174.7	-4.1	113	K343 E344 R345 S351	K343-R347 PolarHBondContact O-N 3Å; E344-R347 PolarHBondContact O-N 2.97Å; R345-R347 VanDerWaalsContact C-N 3.34Å; R345-R347 PolarHBondContact O-N 3.39Å; R347-S351 PolarHBondContact O-N 3.28Å
348	M	94.2	Very high	89.9	Confident	29 Å²	29	55.7 Å²	55.7	14%	0.143	28%	0.281	C	S	.	.	H	α-helix	trans	-66.8	-44.7	175.8	-165.9	73.8	-175.7	0	0	110.9	L176 R333 L337 L340 E344 R345 I346 E350 S351 I352	L176-M348 HydrophobicContact CD2-CE 3.47Å; L176-M348 VanDerWaalsContact CD2-CE 3.47Å; R333-M348 HydrophobicContact CG-CE 4.09Å; L337-M348 HydrophobicContact CD2-CB 3.98Å; L337-M348 HydrophobicContact CD2-CG 4.01Å; L340-M348 HydrophobicContact CD1-CB 4.35Å; E344-M348 PolarHBondContact O-N 2.61Å; R345-M348 WeakPolarHBondContact O-CB 3.3Å; R345-M348 PolarHBondContact O-N 3.27Å; R345-M348 VanDerWaalsContact O-N 3.1Å; I346-M348 VanDerWaalsContact C-N 3.26Å; I346-M348 PolarHBondContact O-N 2.84Å; M348-E350 VanDerWaalsContact C-N 3.35Å; M348-E350 PolarHBondContact O-N 3.08Å; M348-S351 WeakPolarHBondContact O-CB 3.31Å; M348-S351 PolarHBondContact O-N 3.38Å; M348-S351 VanDerWaalsContact O-N 3.16Å; M348-I352 HydrophobicContact CG-CD1 4.41Å; M348-I352 VanDerWaalsContact O-CG1 3.29Å; M348-I352 WeakPolarHBondContact O-CG1 3.11Å; M348-I352 PolarHBondContact O-N 3.4Å
349	Y	94.7	Very high	88.9	Confident	1 Å²	1	55 Å²	55	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-63.4	-39.1	175.6	-70.9	-58.2	0	0	0	112.5	W85 L89 F90 I93 D143 L337 R345 I346 S351 I352 L353	W85-Y349 HydrophobicContact CZ2-CD1 4.27Å; L89-Y349 HydrophobicContact CD2-CD1 3.91Å; L89-Y349 HydrophobicContact CD2-CD2 4Å; L89-Y349 HydrophobicContact CD2-CE1 4.15Å; L89-Y349 HydrophobicContact CD2-CE2 4.21Å; L89-Y349 HydrophobicContact CD2-CG 3.85Å; F90-Y349 HydrophobicContact CE1-CD2 4.33Å; I93-Y349 HydrophobicContact CD1-CD2 4.43Å; I93-Y349 HydrophobicContact CD1-CE2 4.23Å; D143-Y349 HydrophobicContact CB-CE1 4.07Å; L337-Y349 HydrophobicContact CD1-CE1 4.48Å; R345-Y349 VanDerWaalsContact O-CD2 3.23Å; R345-Y349 WeakPolarHBondContact O-CD2 3.25Å; R345-Y349 PolarHBondContact O-N 3.26Å; I346-Y349 PolarHBondContact O-N 2.97Å; I346-Y349 VanDerWaalsContact O-N 3.16Å; Y349-S351 VanDerWaalsContact C-N 3.33Å; Y349-S351 PolarHBondContact O-N 3.03Å; Y349-I352 HydrophobicContact CD1-CD1 4.09Å; Y349-I352 PolarHBondContact O-N 2.87Å; Y349-L353 PolarHBondContact O-N 2.83Å
350	E	93.7	Very high	88	Confident	72 Å²	72	54.8 Å²	54.8	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-58.8	-44.1	170.9	-72.6	167.7	178.1	0	0	111.9	I86 Y104 I346 M348 I352 L353 Q354	I86-E350 HydrophobicContact CD1-CG 4.06Å; Y104-E350 VanDerWaalsContact OH-CD 3.23Å; Y104-E350 WeakPolarHBondContact OH-CG 3.21Å; Y104-E350 PolarHBondContact OH-OE1 3.14Å; I346-E350 WeakPolarHBondContact O-CG 3.25Å; I346-E350 PolarHBondContact O-N 3.36Å; M348-E350 VanDerWaalsContact C-N 3.35Å; M348-E350 PolarHBondContact O-N 3.08Å; E350-I352 VanDerWaalsContact C-N 3.35Å; E350-I352 PolarHBondContact O-N 3.47Å; E350-L353 WeakPolarHBondContact O-CB 3.22Å; E350-L353 PolarHBondContact O-N 2.79Å; E350-Q354 PolarHBondContact O-N 3.47Å; E350-Q354 VanDerWaalsContact O-N 3.11Å
351	S	93.3	Very high	87.9	Confident	56 Å²	56	57 Å²	57	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-40.3	176.3	-171.3	0	0	0	0	112	R347 M348 Y349 Q354 E355	R347-S351 PolarHBondContact O-N 3.28Å; M348-S351 WeakPolarHBondContact O-CB 3.31Å; M348-S351 PolarHBondContact O-N 3.38Å; M348-S351 VanDerWaalsContact O-N 3.16Å; Y349-S351 VanDerWaalsContact C-N 3.33Å; Y349-S351 PolarHBondContact O-N 3.03Å; S351-Q354 PolarHBondContact O-N 3.36Å; S351-E355 WeakPolarHBondContact O-CG 3.39Å; S351-E355 PolarHBondContact O-N 2.75Å
352	I	92.1	Very high	87.9	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-46.8	176.4	-69.5	166.6	0	0	0	110.3	W85 M348 Y349 E350 Q354 E355 E356	W85-I352 HydrophobicContact CH2-CG2 4.37Å; M348-I352 HydrophobicContact CG-CD1 4.41Å; M348-I352 VanDerWaalsContact O-CG1 3.29Å; M348-I352 WeakPolarHBondContact O-CG1 3.11Å; M348-I352 PolarHBondContact O-N 3.4Å; Y349-I352 HydrophobicContact CD1-CD1 4.09Å; Y349-I352 PolarHBondContact O-N 2.87Å; E350-I352 VanDerWaalsContact C-N 3.35Å; E350-I352 PolarHBondContact O-N 3.47Å; I352-Q354 PolarHBondContact O-N 3.33Å; I352-E355 PolarHBondContact O-N 3.42Å; I352-E356 PolarHBondContact O-N 3.34Å
353	L	93	Very high	88	Confident	19 Å²	19	55.3 Å²	55.3	10%	0.099	27%	0.266	C	S	.	.	H	α-helix	trans	-51.9	-50	175.2	-170.2	43.5	0	0	0	110.5	W85 I86 W136 Y349 E350 E355 E356 L357	W85-L353 HydrophobicContact CE3-CD1 3.91Å; W85-L353 HydrophobicContact CH2-CB 4.47Å; W85-L353 HydrophobicContact CZ3-CB 3.71Å; W85-L353 HydrophobicContact CZ3-CD1 3.81Å; W85-L353 HydrophobicContact CZ3-CD2 4.24Å; W85-L353 HydrophobicContact CZ3-CG 4.09Å; I86-L353 HydrophobicContact CB-CD2 4.13Å; I86-L353 HydrophobicContact CD1-CB 4.49Å; I86-L353 HydrophobicContact CD1-CD2 3.76Å; I86-L353 HydrophobicContact CG2-CD2 3.94Å; W136-L353 HydrophobicContact CH2-CD1 3.58Å; W136-L353 HydrophobicContact CZ2-CD1 4.28Å; W136-L353 HydrophobicContact CZ3-CD1 4.16Å; Y349-L353 PolarHBondContact O-N 2.83Å; E350-L353 WeakPolarHBondContact O-CB 3.22Å; E350-L353 PolarHBondContact O-N 2.79Å; L353-E355 PolarHBondContact O-N 2.87Å; L353-E356 PolarHBondContact O-N 2.85Å; L353-L357 HydrophobicContact CD1-CD1 3.78Å; L353-L357 HydrophobicContact CD1-CG 3.97Å; L353-L357 HydrophobicContact CG-CD1 3.87Å; L353-L357 HydrophobicContact CG-CG 4.38Å; L353-L357 WeakPolarHBondContact O-CB 3.22Å; L353-L357 WeakPolarHBondContact O-CG 3.18Å; L353-L357 PolarHBondContact O-N 3.37Å
354	Q	91.4	Very high	88	Confident	99 Å²	99	50.1 Å²	50.1	46%	0.463	25%	0.245	S	C	.	.	H	α-helix	trans	-73.6	-31.7	-170.4	-149.5	60.7	-14.9	0	0	112.5	E350 S351 I352 N358	E350-Q354 PolarHBondContact O-N 3.47Å; E350-Q354 VanDerWaalsContact O-N 3.11Å; S351-Q354 PolarHBondContact O-N 3.36Å; I352-Q354 PolarHBondContact O-N 3.33Å; Q354-N358 WeakPolarHBondContact O-CB 3.28Å; Q354-N358 PolarHBondContact O-N 2.97Å; Q354-N358 PolarHBondContact O-ND2 3.23Å
355	E	87.3	Confident	87.7	Confident	39 Å²	39	48.4 Å²	48.4	18%	0.182	24%	0.238	C	C	.	.	H	α-helix	trans	-67.8	-39.8	169.1	-72.1	-162.9	146.4	0	0	113	K184 R333 S351 I352 L353 S359	K184-E355 WeakPolarHBondContact CE-OE1 3.36Å; K184-E355 IonicContact NZ-OE1 2.9Å; K184-E355 PolarHBondContact NZ-OE1 3.15Å; R333-E355 IonicContact CZ-OE2 2.94Å; R333-E355 IonicContact NH2-OE2 3.72Å; R333-E355 PolarHBondContact NH2-OE2 3.46Å; S351-E355 WeakPolarHBondContact O-CG 3.39Å; S351-E355 PolarHBondContact O-N 2.75Å; I352-E355 PolarHBondContact O-N 3.42Å; L353-E355 PolarHBondContact O-N 2.87Å; E355-S359 WeakPolarHBondContact O-CB 3.42Å; E355-S359 PolarHBondContact O-OG 2.89Å
356	E	86.5	Confident	87.4	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-44	174.2	-74.1	-157.2	-142.8	0	0	111.1	Y41 K135 W136 R139 I352 L353 S359	Y41-E356 PolarHBondContact OH-OE1 3.48Å; Y41-E356 PolarHBondContact OH-OE2 2.63Å; K135-E356 IonicContact NZ-OE2 3.98Å; W136-E356 HydrophobicContact CH2-CB 4.27Å; R139-E356 IonicContact CZ-OE1 2.78Å; R139-E356 IonicContact NE-OE1 2.76Å; R139-E356 IonicContact NH1-OE1 3.85Å; R139-E356 PolarHBondContact NH1-OE1 2.78Å; I352-E356 PolarHBondContact O-N 3.34Å; L353-E356 PolarHBondContact O-N 2.85Å; E356-S359 PolarHBondContact O-N 2.89Å; E356-S359 PolarHBondContact O-OG 3.38Å
357	L	86.5	Confident	87.1	Confident	29 Å²	29	51.6 Å²	51.6	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-73.4	-40.1	-178	-67.7	-180	0	0	0	114.4	E78 R79 W136 L353 S359 I360	E78-L357 HydrophobicContact CB-CD2 4.3Å; R79-L357 HydrophobicContact CG-CD1 4.4Å; R79-L357 HydrophobicContact CG-CD2 4.07Å; W136-L357 HydrophobicContact CZ2-CD2 4.47Å; L353-L357 HydrophobicContact CD1-CD1 3.78Å; L353-L357 HydrophobicContact CD1-CG 3.97Å; L353-L357 HydrophobicContact CG-CD1 3.87Å; L353-L357 HydrophobicContact CG-CG 4.38Å; L353-L357 WeakPolarHBondContact O-CB 3.22Å; L353-L357 WeakPolarHBondContact O-CG 3.18Å; L353-L357 PolarHBondContact O-N 3.37Å; L357-S359 PolarHBondContact O-N 2.93Å; L357-S359 VanDerWaalsContact O-N 3.13Å; L357-I360 HydrophobicContact CD2-CD1 4.07Å; L357-I360 PolarHBondContact O-N 2.86Å
358	N	79.3	Confident	86.6	Confident	120 Å²	120	43.9 Å²	43.9	64%	0.642	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.5	178.2	-73.2	-19.2	0	0	0	113.2	Q354	Q354-N358 WeakPolarHBondContact O-CB 3.28Å; Q354-N358 PolarHBondContact O-N 2.97Å; Q354-N358 PolarHBondContact O-ND2 3.23Å
359	S	66	Low	86	Confident	27 Å²	27	45.2 Å²	45.2	19%	0.189	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	1.5	-172.8	76.5	0	0	0	0	114.2	K187 R191 E355 E356 L357	K187-S359 PolarHBondContact NZ-OG 2.76Å; R191-S359 PolarHBondContact NH2-O 3.46Å; E355-S359 WeakPolarHBondContact O-CB 3.42Å; E355-S359 PolarHBondContact O-OG 2.89Å; E356-S359 PolarHBondContact O-N 2.89Å; E356-S359 PolarHBondContact O-OG 3.38Å; L357-S359 PolarHBondContact O-N 2.93Å; L357-S359 VanDerWaalsContact O-N 3.13Å
360	I	68.2	Low	85.2	Confident	68 Å²	68	49.2 Å²	49.2	35%	0.349	26%	0.26	S	S	.	.			trans	-87.1	0	166.5	-56.3	159.5	0	0	0	106.1	I75 E78 R191 L357	I75-I360 HydrophobicContact CG1-CB 4.4Å; I75-I360 HydrophobicContact CG1-CG2 3.52Å; E78-I360 HydrophobicContact CB-CD1 3.29Å; E78-I360 HydrophobicContact CG-CD1 3.48Å; E78-I360 VanDerWaalsContact CG-CD1 3.48Å; E78-I360 HydrophobicContact CG-CG1 4.44Å; R191-I360 PolarHBondContact NH2-O 3.49Å; R191-I360 PolarHBondContact NH2-OXT 2.86Å; L357-I360 HydrophobicContact CD2-CD1 4.07Å; L357-I360 PolarHBondContact O-N 2.86Å

Retrieved 360 of 360 residues in 196.3 ms (Link to these results)

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