A0A087X9F8_POEFO Loading...

ADP/ATP translocase

Catalyzes the exchange of ADP and ATP across the membrane.

AlphaFold DB , UniProt , Accession A0A087X9F8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 299 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	59.2	Low	83.1	Confident	179 Å²	179	97.1 Å²	97.1	88%	0.882	53%	0.531	S	S	*	.				0	126.4	0	-133.8	-176	-60.8	0	0	106.2	V5 I6	M1-V5 HydrophobicContact CG-CB 4.1Å; M1-V5 HydrophobicContact CG-CG1 3.71Å; M1-V5 HydrophobicContact SD-CG1 3.73Å; M1-I6 HydrophobicContact CB-CD1 4.28Å; M1-I6 HydrophobicContact CB-CG1 4.07Å; M1-I6 HydrophobicContact SD-CG1 4.25Å
2	S	84	Confident	83.3	Confident	72 Å²	72	92.2 Å²	92.2	50%	0.503	50%	0.501	S	S	.	.			trans	-65.1	152.7	-179.7	65.5	0	0	0	0	111	A4 V5 I6	S2-A4 PolarHBondContact O-N 3.38Å; S2-A4 VanDerWaalsContact O-N 3.14Å; S2-V5 PolarHBondContact O-N 3.13Å; S2-V5 WeakPolarHBondContact OG-CG2 3.46Å; S2-I6 PolarHBondContact O-N 2.9Å; S2-I6 VanDerWaalsContact O-N 3.17Å
3	D	84.7	Confident	83.9	Confident	138 Å²	138	92.5 Å²	92.5	74%	0.738	50%	0.501	S	S	*	.	H	α-helix	trans	-55.8	-33.5	179.6	-65.9	-32.9	0	0	0	112.7	V5 I6 S7	D3-V5 PolarHBondContact O-N 3.28Å; D3-I6 PolarHBondContact O-N 3Å; D3-S7 WeakPolarHBondContact O-CB 3.44Å; D3-S7 PolarHBondContact O-N 3.29Å
4	A	83.9	Confident	84.1	Confident	73 Å²	73	87.7 Å²	87.7	60%	0.603	48%	0.481	S	S	*	.	H	α-helix	trans	-61.9	-40.3	174.3	0	0	0	0	0	113.1	S2 F8	S2-A4 PolarHBondContact O-N 3.38Å; S2-A4 VanDerWaalsContact O-N 3.14Å; A4-F8 WeakPolarHBondContact O-CB 3.35Å; A4-F8 PolarHBondContact O-N 3.4Å
5	V	87.1	Confident	84.3	Confident	60 Å²	60	83.3 Å²	83.3	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-70.4	-40.5	178.1	175.3	0	0	0	0	110.3	M1 S2 D3 F8 M9	M1-V5 HydrophobicContact CG-CB 4.1Å; M1-V5 HydrophobicContact CG-CG1 3.71Å; M1-V5 HydrophobicContact SD-CG1 3.73Å; S2-V5 PolarHBondContact O-N 3.13Å; S2-V5 WeakPolarHBondContact OG-CG2 3.46Å; D3-V5 PolarHBondContact O-N 3.28Å; V5-F8 PolarHBondContact O-N 3.11Å; V5-M9 HydrophobicContact CG1-CG 4.43Å; V5-M9 WeakPolarHBondContact O-CB 3.37Å; V5-M9 VanDerWaalsContact O-CG 3.28Å; V5-M9 WeakPolarHBondContact O-CG 3.46Å; V5-M9 PolarHBondContact O-N 2.94Å
6	I	85.8	Confident	84.7	Confident	63 Å²	63	78.2 Å²	78.2	32%	0.323	44%	0.435	S	S	.	.	H	α-helix	trans	-63.6	-45.3	177	-63.2	173.8	0	0	0	110.4	M1 S2 D3 M9 K10	M1-I6 HydrophobicContact CB-CD1 4.28Å; M1-I6 HydrophobicContact CB-CG1 4.07Å; M1-I6 HydrophobicContact SD-CG1 4.25Å; S2-I6 PolarHBondContact O-N 2.9Å; S2-I6 VanDerWaalsContact O-N 3.17Å; D3-I6 PolarHBondContact O-N 3Å; I6-M9 PolarHBondContact O-N 3.49Å; I6-K10 HydrophobicContact CG2-CD 4.26Å; I6-K10 WeakPolarHBondContact O-CG 3.39Å; I6-K10 PolarHBondContact O-N 3.23Å
7	S	84.6	Confident	85	Confident	64 Å²	64	78.9 Å²	78.9	45%	0.448	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-49.5	176.7	-170.1	0	0	0	0	111.5	D3 M9 K10 D11	D3-S7 WeakPolarHBondContact O-CB 3.44Å; D3-S7 PolarHBondContact O-N 3.29Å; S7-M9 VanDerWaalsContact C-N 3.33Å; S7-M9 PolarHBondContact O-N 2.8Å; S7-K10 WeakPolarHBondContact O-CB 3.42Å; S7-K10 PolarHBondContact O-N 2.78Å; S7-D11 PolarHBondContact O-N 3.39Å
8	F	86.4	Confident	85.2	Confident	81 Å²	81	75.2 Å²	75.2	36%	0.355	42%	0.418	S	S	.	.	H	α-helix	trans	-57.4	-44.2	176.3	173.5	-90.7	0	0	0	112.3	A4 V5 D11 F12 F89	A4-F8 WeakPolarHBondContact O-CB 3.35Å; A4-F8 PolarHBondContact O-N 3.4Å; V5-F8 PolarHBondContact O-N 3.11Å; F8-D11 PolarHBondContact O-N 3.35Å; F8-F12 HydrophobicContact CE1-CB 4.44Å; F8-F12 VanDerWaalsContact O-CB 3.27Å; F8-F12 WeakPolarHBondContact O-CB 3.48Å; F8-F12 PolarHBondContact O-N 2.93Å; F8-F89 HydrophobicContact CE2-CD1 4.07Å; F8-F89 HydrophobicContact CE2-CD2 4.17Å; F8-F89 AromaticContact CE2-CE1 3.87Å; F8-F89 HydrophobicContact CE2-CE1 3.87Å; F8-F89 AromaticContact CE2-CE2 3.99Å; F8-F89 HydrophobicContact CE2-CE2 3.99Å; F8-F89 HydrophobicContact CE2-CG 4.23Å; F8-F89 AromaticContact CE2-CZ 3.83Å; F8-F89 HydrophobicContact CE2-CZ 3.83Å; F8-F89 HydrophobicContact CZ-CD2 4.04Å; F8-F89 HydrophobicContact CZ-CE2 4.09Å; F8-F89 HydrophobicContact CZ-CG 4.35Å; F8-F89 HydrophobicContact CZ-CZ 4.4Å
9	M	88.6	Confident	85.4	Confident	84 Å²	84	72.2 Å²	72.2	41%	0.414	40%	0.404	S	S	.	.	H	α-helix	trans	-66.2	-37.8	179.2	-72.4	-60	154.2	0	0	112.3	V5 I6 S7 F12 L13	V5-M9 HydrophobicContact CG1-CG 4.43Å; V5-M9 WeakPolarHBondContact O-CB 3.37Å; V5-M9 VanDerWaalsContact O-CG 3.28Å; V5-M9 WeakPolarHBondContact O-CG 3.46Å; V5-M9 PolarHBondContact O-N 2.94Å; I6-M9 PolarHBondContact O-N 3.49Å; S7-M9 VanDerWaalsContact C-N 3.33Å; S7-M9 PolarHBondContact O-N 2.8Å; M9-F12 PolarHBondContact O-N 2.83Å; M9-L13 WeakPolarHBondContact O-CB 3.24Å; M9-L13 VanDerWaalsContact O-CG 3.24Å; M9-L13 WeakPolarHBondContact O-CG 3.34Å; M9-L13 PolarHBondContact O-N 3.43Å
10	K	86.6	Confident	85.8	Confident	143 Å²	143	69.5 Å²	69.5	62%	0.622	39%	0.392	S	S	*	.	H	α-helix	trans	-61.2	-47	173.8	-75	175.8	178.5	179.6	0	111.2	I6 S7 L13 A14	I6-K10 HydrophobicContact CG2-CD 4.26Å; I6-K10 WeakPolarHBondContact O-CG 3.39Å; I6-K10 PolarHBondContact O-N 3.23Å; S7-K10 WeakPolarHBondContact O-CB 3.42Å; S7-K10 PolarHBondContact O-N 2.78Å; K10-L13 PolarHBondContact O-N 2.94Å; K10-A14 WeakPolarHBondContact O-CB 3.27Å; K10-A14 PolarHBondContact O-N 3.19Å
11	D	83.5	Confident	86.1	Confident	111 Å²	111	69.7 Å²	69.7	59%	0.594	39%	0.391	S	S	*	.	H	α-helix	trans	-66.6	-41.2	179.2	-71.7	-19.1	0	0	0	112.2	S7 F8 A14 G15	S7-D11 PolarHBondContact O-N 3.39Å; F8-D11 PolarHBondContact O-N 3.35Å; D11-A14 PolarHBondContact O-N 2.98Å; D11-G15 PolarHBondContact O-N 2.9Å
12	F	85.9	Confident	87.7	Confident	38 Å²	38	61.4 Å²	61.4	17%	0.167	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-46.4	176.9	-177.9	-103.4	0	0	0	111.9	F8 M9 G16 F82 Q85 F89	F8-F12 HydrophobicContact CE1-CB 4.44Å; F8-F12 VanDerWaalsContact O-CB 3.27Å; F8-F12 WeakPolarHBondContact O-CB 3.48Å; F8-F12 PolarHBondContact O-N 2.93Å; M9-F12 PolarHBondContact O-N 2.83Å; F12-G16 PolarHBondContact O-N 2.8Å; F12-F82 HydrophobicContact CD1-CD1 4.33Å; F12-F82 AromaticContact CE1-CD1 3.57Å; F12-F82 HydrophobicContact CE1-CD1 3.57Å; F12-F82 HydrophobicContact CE1-CE1 4.32Å; F12-F82 HydrophobicContact CZ-CB 4.12Å; F12-F82 AromaticContact CZ-CD1 3.84Å; F12-F82 HydrophobicContact CZ-CD1 3.84Å; F12-F82 HydrophobicContact CZ-CG 4.5Å; F12-Q85 HydrophobicContact CD2-CB 4.32Å; F12-Q85 HydrophobicContact CE2-CB 3.68Å; F12-F89 HydrophobicContact CD2-CE2 4.08Å
13	L	90.1	Very high	88.1	Confident	96 Å²	96	60.8 Å²	60.8	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-69	-44.3	177.4	-70.8	173	0	0	0	112	M9 K10 G15 G16 I17 F82	M9-L13 WeakPolarHBondContact O-CB 3.24Å; M9-L13 VanDerWaalsContact O-CG 3.24Å; M9-L13 WeakPolarHBondContact O-CG 3.34Å; M9-L13 PolarHBondContact O-N 3.43Å; K10-L13 PolarHBondContact O-N 2.94Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 2.74Å; L13-G16 WeakPolarHBondContact O-CA 3.39Å; L13-G16 PolarHBondContact O-N 3.03Å; L13-G16 VanDerWaalsContact O-N 3.09Å; L13-I17 WeakPolarHBondContact O-CG1 3.23Å; L13-I17 PolarHBondContact O-N 3Å; L13-F82 HydrophobicContact CD2-CE1 4.44Å
14	A	87.2	Confident	88.6	Confident	26 Å²	26	56.6 Å²	56.6	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-45.6	177.9	0	0	0	0	0	111.3	K10 D11 G16 I17 A18	K10-A14 WeakPolarHBondContact O-CB 3.27Å; K10-A14 PolarHBondContact O-N 3.19Å; D11-A14 PolarHBondContact O-N 2.98Å; A14-G16 VanDerWaalsContact C-N 3.29Å; A14-G16 PolarHBondContact O-N 3.01Å; A14-I17 PolarHBondContact O-N 2.95Å; A14-A18 WeakPolarHBondContact O-CB 3.2Å; A14-A18 PolarHBondContact O-N 3.13Å
15	G	87.1	Confident	89.2	Confident	22 Å²	22	55.7 Å²	55.7	23%	0.227	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-36.7	174	0	0	0	0	0	112.6	D11 L13 A19 Y81	D11-G15 PolarHBondContact O-N 2.9Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 2.74Å; G15-A19 VanDerWaalsContact O-CB 3.24Å; G15-A19 WeakPolarHBondContact O-CB 3.42Å; G15-A19 PolarHBondContact O-N 2.77Å; G15-Y81 VanDerWaalsContact C-OH 3.24Å; G15-Y81 WeakPolarHBondContact CA-OH 3.31Å
16	G	89.9	Confident	89.6	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-43.5	175.3	0	0	0	0	0	113.5	F12 L13 A14 A19 A20	F12-G16 PolarHBondContact O-N 2.8Å; L13-G16 WeakPolarHBondContact O-CA 3.39Å; L13-G16 PolarHBondContact O-N 3.03Å; L13-G16 VanDerWaalsContact O-N 3.09Å; A14-G16 VanDerWaalsContact C-N 3.29Å; A14-G16 PolarHBondContact O-N 3.01Å; G16-A19 PolarHBondContact O-N 3.4Å; G16-A20 WeakPolarHBondContact O-CB 3.41Å; G16-A20 PolarHBondContact O-N 3.32Å
17	I	91	Very high	90.1	Very high	90 Å²	90	50.5 Å²	50.5	46%	0.462	28%	0.283	S	S	.	.	H	α-helix	trans	-65.5	-48.2	176.3	-67.4	165.7	0	0	0	110.3	L13 A14 A19 A20 I21	L13-I17 WeakPolarHBondContact O-CG1 3.23Å; L13-I17 PolarHBondContact O-N 3Å; A14-I17 PolarHBondContact O-N 2.95Å; I17-A19 VanDerWaalsContact C-N 3.3Å; I17-A19 PolarHBondContact O-N 3.34Å; I17-A20 WeakPolarHBondContact O-CB 3.17Å; I17-A20 PolarHBondContact O-N 3.46Å; I17-A20 VanDerWaalsContact O-N 3.11Å; I17-I21 HydrophobicContact CG2-CD1 3.79Å; I17-I21 HydrophobicContact CG2-CG1 4.42Å; I17-I21 WeakPolarHBondContact O-CG1 3.43Å; I17-I21 PolarHBondContact O-N 2.92Å
18	A	88.9	Confident	90.7	Very high	12 Å²	12	48.8 Å²	48.8	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-43.4	177.1	0	0	0	0	0	111.6	A14 I21 S22 L288 Y291	A14-A18 WeakPolarHBondContact O-CB 3.2Å; A14-A18 PolarHBondContact O-N 3.13Å; A18-I21 PolarHBondContact O-N 3.34Å; A18-S22 WeakPolarHBondContact O-CB 3.44Å; A18-S22 PolarHBondContact O-N 2.9Å; A18-L288 HydrophobicContact CB-CD2 4.14Å; A18-Y291 HydrophobicContact CB-CD1 3.86Å; A18-Y291 HydrophobicContact CB-CE1 3.7Å
19	A	89.2	Confident	91.2	Very high	18 Å²	18	46.5 Å²	46.5	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-42.2	175	0	0	0	0	0	112.2	G15 G16 I17 K23 Y81	G15-A19 VanDerWaalsContact O-CB 3.24Å; G15-A19 WeakPolarHBondContact O-CB 3.42Å; G15-A19 PolarHBondContact O-N 2.77Å; G16-A19 PolarHBondContact O-N 3.4Å; I17-A19 VanDerWaalsContact C-N 3.3Å; I17-A19 PolarHBondContact O-N 3.34Å; A19-K23 VanDerWaalsContact O-CB 3.31Å; A19-K23 WeakPolarHBondContact O-CB 2.9Å; A19-K23 WeakPolarHBondContact O-CG 3.23Å; A19-K23 PolarHBondContact O-N 3.36Å; A19-Y81 HydrophobicContact CB-CD2 3.28Å; A19-Y81 HydrophobicContact CB-CE2 3.61Å; A19-Y81 HydrophobicContact CB-CG 3.85Å
20	A	92.7	Very high	91.5	Very high	19 Å²	19	42.8 Å²	42.8	16%	0.157	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-44.7	177.6	0	0	0	0	0	111.8	G16 I17 T24 V78	G16-A20 WeakPolarHBondContact O-CB 3.41Å; G16-A20 PolarHBondContact O-N 3.32Å; I17-A20 WeakPolarHBondContact O-CB 3.17Å; I17-A20 PolarHBondContact O-N 3.46Å; I17-A20 VanDerWaalsContact O-N 3.11Å; A20-T24 WeakPolarHBondContact O-CB 3.15Å; A20-T24 PolarHBondContact O-N 2.99Å; A20-T24 PolarHBondContact O-OG1 3.32Å; A20-V78 HydrophobicContact CB-CB 4.4Å; A20-V78 HydrophobicContact CB-CG1 3.76Å; A20-V78 HydrophobicContact CB-CG2 4.08Å
21	I	92.9	Very high	92.1	Very high	74 Å²	74	36.2 Å²	36.2	38%	0.379	21%	0.214	S	C	.	.	H	α-helix	trans	-62.1	-54.3	177	-67.4	167.8	0	0	0	110	I17 A18 K23 T24 A25 V287 Y291	I17-I21 HydrophobicContact CG2-CD1 3.79Å; I17-I21 HydrophobicContact CG2-CG1 4.42Å; I17-I21 WeakPolarHBondContact O-CG1 3.43Å; I17-I21 PolarHBondContact O-N 2.92Å; A18-I21 PolarHBondContact O-N 3.34Å; I21-K23 PolarHBondContact O-N 3.43Å; I21-T24 PolarHBondContact O-N 3.41Å; I21-T24 VanDerWaalsContact O-N 3.15Å; I21-A25 WeakPolarHBondContact O-CB 3.43Å; I21-A25 PolarHBondContact O-N 3.24Å; I21-V287 HydrophobicContact CG2-CG1 4.17Å; I21-Y291 HydrophobicContact CD1-CD2 3.96Å; I21-Y291 HydrophobicContact CD1-CE2 3.7Å
22	S	91.8	Very high	92.7	Very high	5 Å²	5	30.9 Å²	30.9	4%	0.035	19%	0.186	C	C	.	.	H	α-helix	trans	-57.2	-46.6	-179.6	173.2	0	0	0	0	112	A18 T24 A25 V26 G284	A18-S22 WeakPolarHBondContact O-CB 3.44Å; A18-S22 PolarHBondContact O-N 2.9Å; S22-T24 PolarHBondContact O-N 2.86Å; S22-A25 PolarHBondContact O-N 2.87Å; S22-V26 WeakPolarHBondContact O-CG2 3.37Å; S22-V26 PolarHBondContact O-N 2.89Å; S22-G284 PolarHBondContact OG-O 3.01Å
23	K	92.1	Very high	93.3	Very high	58 Å²	58	29.6 Å²	29.6	25%	0.252	18%	0.18	S	C	.	.	H	α-helix	trans	-65.1	-37.5	178	-67.7	-64.2	174.3	-153.2	0	112.9	A19 I21 A27 N77	A19-K23 VanDerWaalsContact O-CB 3.31Å; A19-K23 WeakPolarHBondContact O-CB 2.9Å; A19-K23 WeakPolarHBondContact O-CG 3.23Å; A19-K23 PolarHBondContact O-N 3.36Å; I21-K23 PolarHBondContact O-N 3.43Å; K23-A27 WeakPolarHBondContact O-CB 3.41Å; K23-A27 PolarHBondContact O-N 2.95Å; K23-N77 HydrophobicContact CB-CB 4.03Å; K23-N77 HydrophobicContact CG-CB 4.34Å
24	T	96.1	Very high	93.6	Very high	50 Å²	50	25.2 Å²	25.2	31%	0.307	16%	0.157	S	C	.	.	H	α-helix	trans	-71.1	-39.1	178.9	-58.8	0	0	0	0	111.1	A20 I21 S22 V26 A27 W71 N74	A20-T24 WeakPolarHBondContact O-CB 3.15Å; A20-T24 PolarHBondContact O-N 2.99Å; A20-T24 PolarHBondContact O-OG1 3.32Å; I21-T24 PolarHBondContact O-N 3.41Å; I21-T24 VanDerWaalsContact O-N 3.15Å; S22-T24 PolarHBondContact O-N 2.86Å; T24-V26 VanDerWaalsContact C-N 3.33Å; T24-V26 PolarHBondContact O-N 3.45Å; T24-A27 WeakPolarHBondContact O-CB 3.21Å; T24-A27 PolarHBondContact O-N 3.23Å; T24-W71 PolarHBondContact O-NE1 3.46Å; T24-N74 PolarHBondContact OG1-ND2 3.44Å
25	A	95.5	Very high	94.1	Very high	54 Å²	54	24 Å²	24	45%	0.446	15%	0.147	S	C	.	.	H	α-helix	trans	-61.1	-40.2	176.4	0	0	0	0	0	112.3	I21 S22 V287	I21-A25 WeakPolarHBondContact O-CB 3.43Å; I21-A25 PolarHBondContact O-N 3.24Å; S22-A25 PolarHBondContact O-N 2.87Å; A25-V287 HydrophobicContact CB-CG1 4.14Å; A25-V287 HydrophobicContact CB-CG2 3.85Å
26	V	95.5	Very high	94.5	Very high	9 Å²	9	23.7 Å²	23.7	6%	0.055	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	2.4	179.8	-54.4	0	0	0	0	114.7	S22 T24 P28 I29 E30 R280	S22-V26 WeakPolarHBondContact O-CG2 3.37Å; S22-V26 PolarHBondContact O-N 2.89Å; T24-V26 VanDerWaalsContact C-N 3.33Å; T24-V26 PolarHBondContact O-N 3.45Å; V26-P28 VanDerWaalsContact C-CD 3.42Å; V26-P28 VanDerWaalsContact C-N 3.33Å; V26-I29 HydrophobicContact CB-CG2 4.06Å; V26-I29 WeakPolarHBondContact O-CG2 3.41Å; V26-I29 PolarHBondContact O-N 3.34Å; V26-E30 WeakPolarHBondContact O-CB 3.22Å; V26-E30 PolarHBondContact O-N 3.44Å; V26-R280 HydrophobicContact CB-CG 4.02Å; V26-R280 HydrophobicContact CG2-CG 3.84Å
27	A	96.3	Very high	94.9	Very high	5 Å²	5	23.7 Å²	23.7	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-56.6	-38.7	179	0	0	0	0	0	113.5	K23 T24 E30 R31 W71 N74	K23-A27 WeakPolarHBondContact O-CB 3.41Å; K23-A27 PolarHBondContact O-N 2.95Å; T24-A27 WeakPolarHBondContact O-CB 3.21Å; T24-A27 PolarHBondContact O-N 3.23Å; A27-E30 PolarHBondContact O-N 3.14Å; A27-R31 PolarHBondContact O-N 3.4Å; A27-W71 HydrophobicContact CB-CG 4.28Å; A27-N74 HydrophobicContact CB-CB 4.2Å
28	P	97.6	Very high	95.1	Very high	29 Å²	29	19.4 Å²	19.4	19%	0.188	12%	0.118	C	C	.	.	H	α-helix	trans	-58.4	-52.6	176.9	-25.7	35	0	0	0	113.3	V26 E30 R31 V32 F70 W71	V26-P28 VanDerWaalsContact C-CD 3.42Å; V26-P28 VanDerWaalsContact C-N 3.33Å; P28-E30 VanDerWaalsContact C-N 3.27Å; P28-E30 PolarHBondContact O-N 3.14Å; P28-R31 PolarHBondContact O-N 2.87Å; P28-V32 WeakPolarHBondContact O-CG2 3.4Å; P28-V32 PolarHBondContact O-N 2.73Å; P28-V32 VanDerWaalsContact O-N 3.11Å; P28-F70 HydrophobicContact CB-CB 3.83Å; P28-F70 HydrophobicContact CB-CD1 3.82Å; P28-F70 HydrophobicContact CB-CG 3.84Å; P28-F70 HydrophobicContact CG-CB 3.97Å; P28-F70 HydrophobicContact CG-CG 4.39Å; P28-W71 HydrophobicContact CG-CH2 3.88Å; P28-W71 HydrophobicContact CG-CZ2 3.58Å; P28-W71 HydrophobicContact CG-CZ3 4.45Å
29	I	96.6	Very high	95.4	Very high	32 Å²	32	19.3 Å²	19.3	16%	0.164	12%	0.116	C	C	.	.	H	α-helix	trans	-68.5	-29.9	179.6	-173.1	60.6	0	0	0	111.8	V26 V32 K33 I54 I279 R280	V26-I29 HydrophobicContact CB-CG2 4.06Å; V26-I29 WeakPolarHBondContact O-CG2 3.41Å; V26-I29 PolarHBondContact O-N 3.34Å; I29-V32 HydrophobicContact CD1-CB 4.37Å; I29-V32 PolarHBondContact O-N 3.12Å; I29-K33 PolarHBondContact O-N 2.96Å; I29-I54 HydrophobicContact CD1-CG2 4.01Å; I29-I279 HydrophobicContact CG1-CB 4.32Å; I29-I279 HydrophobicContact CG1-CG2 4.07Å; I29-R280 HydrophobicContact CG2-CB 3.84Å; I29-R280 HydrophobicContact CG2-CG 4.1Å
30	E	96.3	Very high	95.6	Very high	7 Å²	7	21.8 Å²	21.8	3%	0.033	12%	0.124	C	C	.	.	H	α-helix	trans	-69	-35.8	173.9	-169.9	154.1	-152.6	0	0	113	V26 A27 P28 K33 L34 R138 R280	V26-E30 WeakPolarHBondContact O-CB 3.22Å; V26-E30 PolarHBondContact O-N 3.44Å; A27-E30 PolarHBondContact O-N 3.14Å; P28-E30 VanDerWaalsContact C-N 3.27Å; P28-E30 PolarHBondContact O-N 3.14Å; E30-K33 WeakPolarHBondContact O-CB 3.45Å; E30-K33 PolarHBondContact O-N 3.31Å; E30-L34 HydrophobicContact CG-CD1 4.49Å; E30-L34 WeakPolarHBondContact O-CG 3.46Å; E30-L34 PolarHBondContact O-N 3.4Å; E30-R138 VanDerWaalsContact CD-CZ 3.44Å; E30-R138 IonicContact OE1-CZ 3.8Å; E30-R138 IonicContact OE1-NH1 3.94Å; E30-R138 PolarHBondContact OE1-NH1 3.37Å; E30-R138 IonicContact OE1-NH2 2.66Å; E30-R138 PolarHBondContact OE1-NH2 2.91Å; E30-R138 IonicContact OE2-CZ 3.72Å; E30-R138 IonicContact OE2-NH2 2.93Å; E30-R138 PolarHBondContact OE2-NH2 3.35Å; E30-R280 HydrophobicContact CB-CG 3.97Å; E30-R280 HydrophobicContact CG-CG 4.41Å; E30-R280 WeakPolarHBondContact OE1-CD 3.29Å; E30-R280 IonicContact OE1-CZ 2.75Å; E30-R280 IonicContact OE1-NE 3.87Å; E30-R280 IonicContact OE1-NH1 3.92Å; E30-R280 PolarHBondContact OE1-NH1 3.31Å
31	R	97.4	Very high	95.6	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-65.1	-43.6	172.3	-172.3	176.6	-177.6	-126.3	-7.6	111	A27 P28 K33 L34 L35 S69 F70 A142 D144	A27-R31 PolarHBondContact O-N 3.4Å; P28-R31 PolarHBondContact O-N 2.87Å; R31-K33 VanDerWaalsContact C-N 3.33Å; R31-K33 PolarHBondContact O-N 3.42Å; R31-L34 PolarHBondContact O-N 2.95Å; R31-L35 HydrophobicContact CG-CD1 4.17Å; R31-L35 HydrophobicContact CG-CG 4.47Å; R31-L35 WeakPolarHBondContact O-CG 3.44Å; R31-L35 PolarHBondContact O-N 3.3Å; R31-S69 WeakPolarHBondContact CD-O 3.44Å; R31-S69 VanDerWaalsContact CZ-O 3.22Å; R31-S69 PolarHBondContact NE-O 3.36Å; R31-S69 VanDerWaalsContact NE-O 3.17Å; R31-S69 VanDerWaalsContact NH1-C 3.34Å; R31-S69 PolarHBondContact NH1-O 3.37Å; R31-S69 PolarHBondContact NH1-OG 3.11Å; R31-F70 WeakPolarHBondContact CD-O 3.34Å; R31-A142 HydrophobicContact CG-CB 4.33Å; R31-A142 PolarHBondContact NE-O 3.3Å; R31-D144 PolarHBondContact NH2-O 3.07Å
32	V	97.4	Very high	95.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57.6	-46.2	174	174	0	0	0	0	111	P28 I29 L34 L35 L36 I54 C57 V58 I61 F70	P28-V32 WeakPolarHBondContact O-CG2 3.4Å; P28-V32 PolarHBondContact O-N 2.73Å; P28-V32 VanDerWaalsContact O-N 3.11Å; I29-V32 HydrophobicContact CD1-CB 4.37Å; I29-V32 PolarHBondContact O-N 3.12Å; V32-L34 PolarHBondContact O-N 2.89Å; V32-L35 PolarHBondContact O-N 2.86Å; V32-L36 HydrophobicContact CG1-CD1 3.97Å; V32-L36 HydrophobicContact CG1-CG 4.42Å; V32-L36 WeakPolarHBondContact O-CG 3.45Å; V32-L36 PolarHBondContact O-N 3.22Å; V32-I54 HydrophobicContact CG1-CB 4.31Å; V32-I54 HydrophobicContact CG1-CG1 4.33Å; V32-I54 HydrophobicContact CG1-CG2 4.08Å; V32-C57 HydrophobicContact CB-CB 4.29Å; V32-C57 HydrophobicContact CG1-CB 3.68Å; V32-C57 HydrophobicContact CG2-CB 3.9Å; V32-V58 HydrophobicContact CG2-CG2 3.84Å; V32-I61 HydrophobicContact CG2-CD1 4.13Å; V32-F70 HydrophobicContact CG2-CE1 4.43Å
33	K	97.2	Very high	95.4	Very high	10 Å²	10	23.2 Å²	23.2	4%	0.043	13%	0.125	C	C	.	.	H	α-helix	trans	-52.5	-55	173.4	178.4	-145.6	161.8	171.5	0	110.9	I29 E30 R31 L35 L36 Q37 Y229 D232 N277	I29-K33 PolarHBondContact O-N 2.96Å; E30-K33 WeakPolarHBondContact O-CB 3.45Å; E30-K33 PolarHBondContact O-N 3.31Å; R31-K33 VanDerWaalsContact C-N 3.33Å; R31-K33 PolarHBondContact O-N 3.42Å; K33-L35 PolarHBondContact O-N 2.87Å; K33-L36 PolarHBondContact O-N 2.89Å; K33-Q37 VanDerWaalsContact O-CB 3.24Å; K33-Q37 WeakPolarHBondContact O-CB 3.45Å; K33-Q37 PolarHBondContact O-N 2.92Å; K33-Y229 WeakPolarHBondContact CE-OH 3.31Å; K33-D232 IonicContact NZ-OD2 3.15Å; K33-D232 PolarHBondContact NZ-OD2 3.44Å; K33-N277 HydrophobicContact CD-CB 3.77Å; K33-N277 WeakPolarHBondContact CE-OD1 3.43Å; K33-N277 HydrophobicContact CG-CB 4.02Å; K33-N277 PolarHBondContact NZ-OD1 2.9Å
34	L	97.2	Very high	95.3	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-45	-175.7	-71.5	170.5	0	0	0	111.2	E30 R31 V32 Q37 V38 T139 A142 R236	E30-L34 HydrophobicContact CG-CD1 4.49Å; E30-L34 WeakPolarHBondContact O-CG 3.46Å; E30-L34 PolarHBondContact O-N 3.4Å; R31-L34 PolarHBondContact O-N 2.95Å; V32-L34 PolarHBondContact O-N 2.89Å; L34-Q37 PolarHBondContact O-N 3.11Å; L34-V38 WeakPolarHBondContact O-CG2 3.16Å; L34-V38 PolarHBondContact O-N 3.32Å; L34-T139 HydrophobicContact CD2-CG2 4.49Å; L34-A142 HydrophobicContact CB-CB 4.08Å; L34-A142 HydrophobicContact CD1-CB 3.51Å; L34-A142 HydrophobicContact CG-CB 4.44Å; L34-R236 HydrophobicContact CD2-CG 4.36Å
35	L	97.2	Very high	95.1	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-57.6	-52.5	176.6	-75.7	169.9	0	0	0	111.4	R31 V32 K33 Q37 V38 Q39 Y51 I61 I145	R31-L35 HydrophobicContact CG-CD1 4.17Å; R31-L35 HydrophobicContact CG-CG 4.47Å; R31-L35 WeakPolarHBondContact O-CG 3.44Å; R31-L35 PolarHBondContact O-N 3.3Å; V32-L35 PolarHBondContact O-N 2.86Å; K33-L35 PolarHBondContact O-N 2.87Å; L35-Q37 PolarHBondContact O-N 3.1Å; L35-V38 PolarHBondContact O-N 2.88Å; L35-Q39 WeakPolarHBondContact O-CA 3.49Å; L35-Q39 WeakPolarHBondContact O-CB 3.28Å; L35-Q39 VanDerWaalsContact O-CG 3.22Å; L35-Q39 WeakPolarHBondContact O-CG 3.47Å; L35-Q39 PolarHBondContact O-N 3.25Å; L35-Y51 HydrophobicContact CB-CD2 4.43Å; L35-Y51 HydrophobicContact CB-CE2 4.44Å; L35-Y51 HydrophobicContact CD1-CE2 4.11Å; L35-Y51 HydrophobicContact CD2-CE2 4.31Å; L35-I61 HydrophobicContact CD1-CD1 3.58Å; L35-I61 HydrophobicContact CD1-CG1 4.1Å; L35-I145 HydrophobicContact CD2-CG2 3.75Å
36	L	96.9	Very high	94.9	Very high	16 Å²	16	21.6 Å²	21.6	8%	0.084	11%	0.111	C	C	.	.	H	α-helix	trans	-58.7	-37.8	178.2	-68.1	174.4	0	0	0	112.2	V32 K33 I54 K272	V32-L36 HydrophobicContact CG1-CD1 3.97Å; V32-L36 HydrophobicContact CG1-CG 4.42Å; V32-L36 WeakPolarHBondContact O-CG 3.45Å; V32-L36 PolarHBondContact O-N 3.22Å; K33-L36 PolarHBondContact O-N 2.89Å; L36-I54 HydrophobicContact CD1-CG1 4.01Å; L36-K272 WeakPolarHBondContact O-CB 3.15Å
37	Q	97.1	Very high	94.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71	-38.3	-177.9	-168.1	175.3	29	0	0	112.8	K33 L34 L35 Y229 D232 T233 R237 K272	K33-Q37 VanDerWaalsContact O-CB 3.24Å; K33-Q37 WeakPolarHBondContact O-CB 3.45Å; K33-Q37 PolarHBondContact O-N 2.92Å; L34-Q37 PolarHBondContact O-N 3.11Å; L35-Q37 PolarHBondContact O-N 3.1Å; Q37-Y229 PolarHBondContact NE2-OH 2.96Å; Q37-D232 PolarHBondContact NE2-OD2 3.11Å; Q37-D232 PolarHBondContact OE1-OD2 3.15Å; Q37-T233 HydrophobicContact CG-CG2 4.18Å; Q37-T233 VanDerWaalsContact NE2-CA 3.29Å; Q37-T233 PolarHBondContact NE2-OG1 3.05Å; Q37-R237 PolarHBondContact O-NE 3.01Å; Q37-R237 PolarHBondContact O-NH2 2.84Å; Q37-K272 WeakPolarHBondContact CB-O 3.44Å
38	V	96	Very high	94.2	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-113.8	-6.3	-172.7	-52.6	0	0	0	0	116.2	L34 L35 H40 A41 S42 A143 R236 M240	L34-V38 WeakPolarHBondContact O-CG2 3.16Å; L34-V38 PolarHBondContact O-N 3.32Å; L35-V38 PolarHBondContact O-N 2.88Å; V38-H40 PolarHBondContact O-N 2.97Å; V38-H40 VanDerWaalsContact O-N 3.15Å; V38-A41 CarbonylContact O-C 3.59Å; V38-A41 WeakPolarHBondContact O-CA 3.25Å; V38-A41 WeakPolarHBondContact O-CB 3.28Å; V38-A41 PolarHBondContact O-N 3.22Å; V38-S42 PolarHBondContact O-N 2.9Å; V38-A143 HydrophobicContact CG2-CB 3.62Å; V38-R236 HydrophobicContact CG1-CB 3.42Å; V38-R236 VanDerWaalsContact CG1-CB 3.42Å; V38-R236 HydrophobicContact CG1-CG 4.46Å; V38-M240 HydrophobicContact CB-CG 3.88Å; V38-M240 HydrophobicContact CB-SD 4.32Å; V38-M240 HydrophobicContact CG1-CG 4.21Å; V38-M240 HydrophobicContact CG2-CE 4.45Å; V38-M240 HydrophobicContact CG2-CG 4.2Å; V38-M240 HydrophobicContact CG2-SD 3.98Å
39	Q	95.3	Very high	93.9	Very high	10 Å²	10	33.8 Å²	33.8	5%	0.047	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-55.9	-34.7	-175.3	56.4	179.9	-25	0	0	114.3	L35 A41 S42 I45 Y51	L35-Q39 WeakPolarHBondContact O-CA 3.49Å; L35-Q39 WeakPolarHBondContact O-CB 3.28Å; L35-Q39 VanDerWaalsContact O-CG 3.22Å; L35-Q39 WeakPolarHBondContact O-CG 3.47Å; L35-Q39 PolarHBondContact O-N 3.25Å; Q39-A41 PolarHBondContact O-N 3.33Å; Q39-S42 VanDerWaalsContact O-CB 3.3Å; Q39-S42 WeakPolarHBondContact O-CB 3.49Å; Q39-S42 PolarHBondContact O-N 3.37Å; Q39-I45 HydrophobicContact CB-CD1 3.62Å; Q39-I45 HydrophobicContact CB-CG2 4.43Å; Q39-Y51 PolarHBondContact NE2-O 3.32Å; Q39-Y51 VanDerWaalsContact NE2-O 3.11Å
40	H	92.9	Very high	93.8	Very high	70 Å²	70	34.6 Å²	34.6	32%	0.324	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-62.7	-24.2	176.1	-171	82.9	0	0	0	112.4	V38 E265	V38-H40 PolarHBondContact O-N 2.97Å; V38-H40 VanDerWaalsContact O-N 3.15Å; H40-E265 IonicContact CD2-OE1 2.81Å; H40-E265 PolarHBondContact CD2-OE1 3.31Å; H40-E265 VanDerWaalsContact CD2-OE1 3.3Å; H40-E265 IonicContact CD2-OE2 3.19Å; H40-E265 IonicContact CG-OE1 3.82Å; H40-E265 IonicContact CG-OE2 3.1Å; H40-E265 IonicContact ND1-OE2 2.73Å; H40-E265 IonicContact NE2-OE1 3.93Å
41	A	91.8	Very high	93.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-101.7	17.3	175.3	0	0	0	0	0	112.7	V38 Q39 M240 R244 M250 Y251	V38-A41 CarbonylContact O-C 3.59Å; V38-A41 WeakPolarHBondContact O-CA 3.25Å; V38-A41 WeakPolarHBondContact O-CB 3.28Å; V38-A41 PolarHBondContact O-N 3.22Å; Q39-A41 PolarHBondContact O-N 3.33Å; A41-M240 HydrophobicContact CB-CB 4.25Å; A41-M240 HydrophobicContact CB-CG 4.43Å; A41-R244 PolarHBondContact O-NH2 3.4Å; A41-M250 HydrophobicContact CB-CE 3.32Å; A41-M250 HydrophobicContact CB-SD 4.47Å; A41-Y251 HydrophobicContact CB-CE2 4.23Å
42	S	92.1	Very high	93.6	Very high	17 Å²	17	43.6 Å²	43.6	12%	0.119	23%	0.226	C	C	.	.			trans	-86.3	151.8	176.8	-174.6	0	0	0	0	111.5	V38 Q39 Q44 I45	V38-S42 PolarHBondContact O-N 2.9Å; Q39-S42 VanDerWaalsContact O-CB 3.3Å; Q39-S42 WeakPolarHBondContact O-CB 3.49Å; Q39-S42 PolarHBondContact O-N 3.37Å; S42-Q44 PolarHBondContact OG-N 2.81Å; S42-I45 PolarHBondContact OG-N 2.9Å
43	K	90.1	Very high	93.5	Very high	111 Å²	111	44.7 Å²	44.7	48%	0.483	24%	0.237	S	C	.	.	S	Bend	trans	-86.4	-26.3	168	-70.9	-162.8	177	-170.6	0	112.8	D248	K43-D248 VanDerWaalsContact NZ-CG 3.35Å; K43-D248 IonicContact NZ-OD2 2.67Å; K43-D248 PolarHBondContact NZ-OD2 3Å
44	Q	89.8	Confident	93.4	Very high	48 Å²	48	46.1 Å²	46.1	22%	0.224	25%	0.245	C	C	.	.	S	Bend	trans	-87.8	-21.8	-175.7	-66.5	168.3	-43.7	0	0	112.1	S42 M49 D144 I145 E151	S42-Q44 PolarHBondContact OG-N 2.81Å; Q44-M49 VanDerWaalsContact O-CE 3.29Å; Q44-M49 WeakPolarHBondContact O-CE 3.49Å; Q44-D144 PolarHBondContact NE2-OD1 3.4Å; Q44-D144 PolarHBondContact OE1-OD1 3.35Å; Q44-I145 HydrophobicContact CB-CD1 3.86Å; Q44-I145 HydrophobicContact CB-CG1 3.47Å; Q44-I145 VanDerWaalsContact CB-CG1 3.47Å; Q44-I145 HydrophobicContact CG-CG1 4.37Å; Q44-E151 PolarHBondContact NE2-O 3Å
45	I	91.7	Very high	93.3	Very high	11 Å²	11	53.1 Å²	53.1	6%	0.056	28%	0.279	C	S	.	.			trans	-102.1	105.4	-177.4	-55.2	169.3	0	0	0	108.6	Q39 S42 M49 Q50 Y51 I145	Q39-I45 HydrophobicContact CB-CD1 3.62Å; Q39-I45 HydrophobicContact CB-CG2 4.43Å; S42-I45 PolarHBondContact OG-N 2.9Å; I45-M49 HydrophobicContact CG2-CB 4.26Å; I45-Q50 HydrophobicContact CG2-CB 4.42Å; I45-Q50 HydrophobicContact CG2-CG 3.76Å; I45-Y51 HydrophobicContact CD1-CE2 4.31Å; I45-I145 HydrophobicContact CD1-CD1 4.38Å; I45-I145 HydrophobicContact CD1-CG1 4.46Å; I45-I145 HydrophobicContact CD1-CG2 3.95Å; I45-I145 HydrophobicContact CG1-CD1 3.44Å; I45-I145 VanDerWaalsContact CG1-CD1 3.44Å; I45-I145 HydrophobicContact CG1-CG1 3.85Å; I45-I145 HydrophobicContact CG1-CG2 4.23Å
46	T	89.9	Confident	93.3	Very high	68 Å²	68	55.1 Å²	55.1	42%	0.417	29%	0.29	S	S	.	.			trans	-72.5	165.3	168.5	55.1	0	0	0	0	110.7	D48 M49 Q50	T46-D48 VanDerWaalsContact C-N 3.28Å; T46-D48 WeakPolarHBondContact CB-OD1 3.42Å; T46-D48 PolarHBondContact O-N 2.76Å; T46-D48 PolarHBondContact OG1-OD1 3.26Å; T46-M49 HydrophobicContact CG2-CE 4.35Å; T46-M49 PolarHBondContact O-N 3.32Å; T46-M49 VanDerWaalsContact O-N 3.1Å; T46-M49 WeakPolarHBondContact OG1-CE 3.44Å; T46-M49 WeakPolarHBondContact OG1-CG 3.23Å; T46-Q50 PolarHBondContact O-N 3.04Å
47	A	88.6	Confident	93.2	Very high	84 Å²	84	54.4 Å²	54.4	69%	0.694	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-58.9	-37.6	-174.9	0	0	0	0	0	113.3
48	D	89.6	Confident	93.1	Very high	138 Å²	138	57.2 Å²	57.2	74%	0.738	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-71.4	-26.6	177.5	60.7	-60.9	0	0	0	113.4	T46	T46-D48 VanDerWaalsContact C-N 3.28Å; T46-D48 WeakPolarHBondContact CB-OD1 3.42Å; T46-D48 PolarHBondContact O-N 2.76Å; T46-D48 PolarHBondContact OG1-OD1 3.26Å
49	M	91.4	Very high	93.2	Very high	77 Å²	77	60.9 Å²	60.9	38%	0.379	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-89	-3.5	179.1	-69	-158.2	-66.6	0	0	113.9	Q44 I45 T46 Y51 R60	Q44-M49 VanDerWaalsContact O-CE 3.29Å; Q44-M49 WeakPolarHBondContact O-CE 3.49Å; I45-M49 HydrophobicContact CG2-CB 4.26Å; T46-M49 HydrophobicContact CG2-CE 4.35Å; T46-M49 PolarHBondContact O-N 3.32Å; T46-M49 VanDerWaalsContact O-N 3.1Å; T46-M49 WeakPolarHBondContact OG1-CE 3.44Å; T46-M49 WeakPolarHBondContact OG1-CG 3.23Å; M49-Y51 PolarHBondContact O-N 2.93Å; M49-R60 PolarHBondContact O-NH1 3.15Å; M49-R60 PolarHBondContact O-NH2 2.85Å
50	Q	94.5	Very high	93.3	Very high	50 Å²	50	62.7 Å²	62.7	23%	0.234	33%	0.332	C	S	.	.			trans	-59.1	139	-179.7	-71.4	-176.7	15.9	0	0	111.6	I45 T46 R60	I45-Q50 HydrophobicContact CG2-CB 4.42Å; I45-Q50 HydrophobicContact CG2-CG 3.76Å; T46-Q50 PolarHBondContact O-N 3.04Å; Q50-R60 PolarHBondContact O-NH1 3.37Å
51	Y	95.6	Very high	93.4	Very high	8 Å²	8	59.4 Å²	59.4	3%	0.031	32%	0.316	C	S	.	.			trans	-70.8	130.1	175.5	-61	-79.3	0	0	0	110.7	L35 Q39 I45 M49 G53 D56 C57 R60 I61 E64 I145	L35-Y51 HydrophobicContact CB-CD2 4.43Å; L35-Y51 HydrophobicContact CB-CE2 4.44Å; L35-Y51 HydrophobicContact CD1-CE2 4.11Å; L35-Y51 HydrophobicContact CD2-CE2 4.31Å; Q39-Y51 PolarHBondContact NE2-O 3.32Å; Q39-Y51 VanDerWaalsContact NE2-O 3.11Å; I45-Y51 HydrophobicContact CD1-CE2 4.31Å; M49-Y51 PolarHBondContact O-N 2.93Å; Y51-G53 VanDerWaalsContact C-N 3.31Å; Y51-G53 PolarHBondContact O-N 3.31Å; Y51-D56 WeakPolarHBondContact CA-OD2 3.24Å; Y51-C57 WeakPolarHBondContact CB-SG 3.5Å; Y51-C57 HydrophobicContact CD1-CB 4.17Å; Y51-C57 VanDerWaalsContact CD1-SG 3.59Å; Y51-C57 HydrophobicContact CG-CB 4.41Å; Y51-R60 HydrophobicContact CD1-CB 4.39Å; Y51-R60 HydrophobicContact CE1-CB 3.86Å; Y51-I61 HydrophobicContact CE1-CG1 4.42Å; Y51-E64 PolarHBondContact OH-OE2 2.88Å; Y51-I145 HydrophobicContact CE2-CG2 4.48Å
52	K	94.1	Very high	93.6	Very high	192 Å²	192	61.3 Å²	61.3	84%	0.835	33%	0.329	S	S	*	.			trans	-76.8	-18.8	-175.3	-60.6	179.9	-177.3	177.5	0	113.2	D56	K52-D56 HydrophobicContact CB-CB 4.14Å; K52-D56 PolarHBondContact N-OD2 2.89Å
53	G	94.3	Very high	93.8	Very high	23 Å²	23	68.8 Å²	68.8	24%	0.237	36%	0.359	C	S	.	.	S	Bend	trans	168.5	-168.6	-179	0	0	0	0	0	112.6	Y51 D56 C57	Y51-G53 VanDerWaalsContact C-N 3.31Å; Y51-G53 PolarHBondContact O-N 3.31Å; G53-D56 PolarHBondContact O-N 3.03Å; G53-C57 PolarHBondContact O-N 2.89Å
54	I	94.9	Very high	93.9	Very high	40 Å²	40	65.8 Å²	65.8	21%	0.205	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-50.8	-174.9	-58.9	-179.6	0	0	0	111.3	I29 V32 L36 D56 C57 V58 S276 I279	I29-I54 HydrophobicContact CD1-CG2 4.01Å; V32-I54 HydrophobicContact CG1-CB 4.31Å; V32-I54 HydrophobicContact CG1-CG1 4.33Å; V32-I54 HydrophobicContact CG1-CG2 4.08Å; L36-I54 HydrophobicContact CD1-CG1 4.01Å; I54-D56 VanDerWaalsContact C-N 3.35Å; I54-D56 PolarHBondContact O-N 3.12Å; I54-C57 WeakPolarHBondContact O-CB 3.34Å; I54-C57 PolarHBondContact O-N 3.36Å; I54-V58 HydrophobicContact CG2-CG2 4.37Å; I54-V58 WeakPolarHBondContact O-CG2 3.28Å; I54-V58 PolarHBondContact O-N 3.35Å; I54-S276 WeakPolarHBondContact CD1-OG 3.14Å; I54-S276 VanDerWaalsContact CG1-OG 3.28Å; I54-S276 WeakPolarHBondContact CG1-OG 3.32Å; I54-I279 HydrophobicContact CD1-CD1 4.24Å
55	M	96.3	Very high	94.1	Very high	150 Å²	150	64.2 Å²	64.2	74%	0.739	34%	0.34	S	S	*	.	H	α-helix	trans	-64.4	-41.8	-177.3	-60.8	-57.7	-85.2	0	0	111.4	C57 V58 V59	M55-C57 PolarHBondContact O-N 3.1Å; M55-V58 PolarHBondContact O-N 2.68Å; M55-V59 WeakPolarHBondContact O-CB 3.29Å; M55-V59 VanDerWaalsContact O-CG2 3.31Å; M55-V59 WeakPolarHBondContact O-CG2 3.31Å; M55-V59 PolarHBondContact O-N 3.39Å
56	D	96.6	Very high	94.3	Very high	44 Å²	44	65.3 Å²	65.3	24%	0.235	35%	0.354	C	S	.	.	H	α-helix	trans	-59.6	-46.8	175.1	-172.5	58.6	0	0	0	111.4	Y51 K52 G53 I54 V59 R60	Y51-D56 WeakPolarHBondContact CA-OD2 3.24Å; K52-D56 HydrophobicContact CB-CB 4.14Å; K52-D56 PolarHBondContact N-OD2 2.89Å; G53-D56 PolarHBondContact O-N 3.03Å; I54-D56 VanDerWaalsContact C-N 3.35Å; I54-D56 PolarHBondContact O-N 3.12Å; D56-V59 PolarHBondContact O-N 3.11Å; D56-R60 VanDerWaalsContact CG-CD 3.48Å; D56-R60 VanDerWaalsContact O-CB 3.23Å; D56-R60 WeakPolarHBondContact O-CB 3.36Å; D56-R60 VanDerWaalsContact O-CG 3.28Å; D56-R60 WeakPolarHBondContact O-CG 3.47Å; D56-R60 PolarHBondContact O-N 3.38Å; D56-R60 WeakPolarHBondContact OD1-CD 3.49Å; D56-R60 WeakPolarHBondContact OD2-CD 3.35Å; D56-R60 IonicContact OD2-CZ 3.99Å; D56-R60 IonicContact OD2-NH1 2.78Å; D56-R60 PolarHBondContact OD2-NH1 2.91Å
57	C	94.8	Very high	94.6	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-57.1	-51.6	173	-78.1	0	0	0	0	112.4	V32 Y51 G53 I54 M55 V59 R60 I61	V32-C57 HydrophobicContact CB-CB 4.29Å; V32-C57 HydrophobicContact CG1-CB 3.68Å; V32-C57 HydrophobicContact CG2-CB 3.9Å; Y51-C57 WeakPolarHBondContact CB-SG 3.5Å; Y51-C57 HydrophobicContact CD1-CB 4.17Å; Y51-C57 VanDerWaalsContact CD1-SG 3.59Å; Y51-C57 HydrophobicContact CG-CB 4.41Å; G53-C57 PolarHBondContact O-N 2.89Å; I54-C57 WeakPolarHBondContact O-CB 3.34Å; I54-C57 PolarHBondContact O-N 3.36Å; M55-C57 PolarHBondContact O-N 3.1Å; C57-V59 VanDerWaalsContact C-N 3.27Å; C57-V59 PolarHBondContact O-N 3.2Å; C57-R60 PolarHBondContact O-N 3.33Å; C57-I61 HydrophobicContact CB-CD1 4.08Å; C57-I61 VanDerWaalsContact O-CB 3.28Å; C57-I61 WeakPolarHBondContact O-CB 3.34Å; C57-I61 WeakPolarHBondContact O-CD1 3.43Å; C57-I61 WeakPolarHBondContact O-CG1 3.31Å; C57-I61 PolarHBondContact O-N 2.87Å
58	V	95.4	Very high	94.9	Very high	60 Å²	60	70.9 Å²	70.9	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-35.5	-174.4	171.8	0	0	0	0	111.5	V32 I54 M55 P62 F70	V32-V58 HydrophobicContact CG2-CG2 3.84Å; I54-V58 HydrophobicContact CG2-CG2 4.37Å; I54-V58 WeakPolarHBondContact O-CG2 3.28Å; I54-V58 PolarHBondContact O-N 3.35Å; M55-V58 PolarHBondContact O-N 2.68Å; V58-P62 WeakPolarHBondContact O-CD 3.46Å; V58-F70 HydrophobicContact CG1-CZ 4.21Å
59	V	97.1	Very high	95.2	Very high	78 Å²	78	64.7 Å²	64.7	47%	0.473	33%	0.33	S	S	.	.	H	α-helix	trans	-76.9	-39.4	178.4	172.8	0	0	0	0	112	M55 D56 C57	M55-V59 WeakPolarHBondContact O-CB 3.29Å; M55-V59 VanDerWaalsContact O-CG2 3.31Å; M55-V59 WeakPolarHBondContact O-CG2 3.31Å; M55-V59 PolarHBondContact O-N 3.39Å; D56-V59 PolarHBondContact O-N 3.11Å; C57-V59 VanDerWaalsContact C-N 3.27Å; C57-V59 PolarHBondContact O-N 3.2Å
60	R	96.9	Very high	95.5	Very high	48 Å²	48	61.6 Å²	61.6	18%	0.181	32%	0.315	C	S	.	.	H	α-helix	trans	-79.7	-40.2	-174.7	-74.3	173.1	58.2	-166.5	-3.2	113.3	M49 Q50 Y51 D56 C57 K63 E64	M49-R60 PolarHBondContact O-NH1 3.15Å; M49-R60 PolarHBondContact O-NH2 2.85Å; Q50-R60 PolarHBondContact O-NH1 3.37Å; Y51-R60 HydrophobicContact CD1-CB 4.39Å; Y51-R60 HydrophobicContact CE1-CB 3.86Å; D56-R60 VanDerWaalsContact CG-CD 3.48Å; D56-R60 VanDerWaalsContact O-CB 3.23Å; D56-R60 WeakPolarHBondContact O-CB 3.36Å; D56-R60 VanDerWaalsContact O-CG 3.28Å; D56-R60 WeakPolarHBondContact O-CG 3.47Å; D56-R60 PolarHBondContact O-N 3.38Å; D56-R60 WeakPolarHBondContact OD1-CD 3.49Å; D56-R60 WeakPolarHBondContact OD2-CD 3.35Å; D56-R60 IonicContact OD2-CZ 3.99Å; D56-R60 IonicContact OD2-NH1 2.78Å; D56-R60 PolarHBondContact OD2-NH1 2.91Å; C57-R60 PolarHBondContact O-N 3.33Å; R60-K63 PolarHBondContact O-N 3.32Å; R60-E64 IonicContact CZ-OE1 3.44Å; R60-E64 VanDerWaalsContact CZ-OE1 3.29Å; R60-E64 IonicContact NE-OE1 3.64Å; R60-E64 PolarHBondContact NE-OE1 3.43Å; R60-E64 IonicContact NH2-OE1 2.64Å; R60-E64 PolarHBondContact NH2-OE1 2.83Å; R60-E64 IonicContact NH2-OE2 3.34Å; R60-E64 WeakPolarHBondContact O-CB 3.22Å; R60-E64 WeakPolarHBondContact O-CG 3.18Å; R60-E64 PolarHBondContact O-N 3.46Å
61	I	95.8	Very high	95.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-51.7	-49.8	-176.3	-77.1	164.9	0	0	0	112.9	V32 L35 Y51 C57 K63 E64 Q65 S69 F70	V32-I61 HydrophobicContact CG2-CD1 4.13Å; L35-I61 HydrophobicContact CD1-CD1 3.58Å; L35-I61 HydrophobicContact CD1-CG1 4.1Å; Y51-I61 HydrophobicContact CE1-CG1 4.42Å; C57-I61 HydrophobicContact CB-CD1 4.08Å; C57-I61 VanDerWaalsContact O-CB 3.28Å; C57-I61 WeakPolarHBondContact O-CB 3.34Å; C57-I61 WeakPolarHBondContact O-CD1 3.43Å; C57-I61 WeakPolarHBondContact O-CG1 3.31Å; C57-I61 PolarHBondContact O-N 2.87Å; I61-K63 VanDerWaalsContact C-N 3.32Å; I61-K63 PolarHBondContact O-N 2.99Å; I61-E64 PolarHBondContact O-N 3.22Å; I61-Q65 PolarHBondContact O-N 3.24Å; I61-S69 WeakPolarHBondContact CG2-OG 3.39Å; I61-F70 HydrophobicContact CB-CE1 3.98Å; I61-F70 HydrophobicContact CB-CZ 4.21Å; I61-F70 HydrophobicContact CD1-CD1 4.3Å; I61-F70 HydrophobicContact CD1-CE1 3.85Å; I61-F70 HydrophobicContact CG2-CD1 3.87Å; I61-F70 HydrophobicContact CG2-CE1 3.73Å; I61-F70 HydrophobicContact CG2-CE2 4.46Å; I61-F70 HydrophobicContact CG2-CG 4.27Å; I61-F70 HydrophobicContact CG2-CZ 4.04Å
62	P	96.6	Very high	95.7	Very high	41 Å²	41	64 Å²	64	27%	0.266	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-35.9	178.6	-24.8	36.6	0	0	0	113.3	V58 G66 F67 F70	V58-P62 WeakPolarHBondContact O-CD 3.46Å; P62-G66 CarbonylContact O-C 3.59Å; P62-G66 WeakPolarHBondContact O-CA 3.5Å; P62-G66 PolarHBondContact O-N 3.47Å; P62-F67 HydrophobicContact CG-CD2 4.47Å; P62-F70 HydrophobicContact CG-CD2 4.49Å; P62-F70 HydrophobicContact CG-CE2 3.51Å; P62-F70 HydrophobicContact CG-CZ 3.78Å
63	K	94.8	Very high	95.7	Very high	173 Å²	173	55.3 Å²	55.3	75%	0.752	29%	0.287	S	S	*	.	H	α-helix	trans	-73.2	-36.7	180	-63.3	-179.3	-178.6	-176.4	0	112	R60 I61	R60-K63 PolarHBondContact O-N 3.32Å; I61-K63 VanDerWaalsContact C-N 3.32Å; I61-K63 PolarHBondContact O-N 2.99Å
64	E	93.9	Very high	95.8	Very high	48 Å²	48	55 Å²	55	22%	0.224	28%	0.28	C	S	.	.	H	α-helix	trans	-82.7	-38.9	-177.1	-69.3	178.1	-168.7	0	0	112.2	Y51 R60 I61 K147	Y51-E64 PolarHBondContact OH-OE2 2.88Å; R60-E64 IonicContact CZ-OE1 3.44Å; R60-E64 VanDerWaalsContact CZ-OE1 3.29Å; R60-E64 IonicContact NE-OE1 3.64Å; R60-E64 PolarHBondContact NE-OE1 3.43Å; R60-E64 IonicContact NH2-OE1 2.64Å; R60-E64 PolarHBondContact NH2-OE1 2.83Å; R60-E64 IonicContact NH2-OE2 3.34Å; R60-E64 WeakPolarHBondContact O-CB 3.22Å; R60-E64 WeakPolarHBondContact O-CG 3.18Å; R60-E64 PolarHBondContact O-N 3.46Å; I61-E64 PolarHBondContact O-N 3.22Å; E64-K147 WeakPolarHBondContact O-CD 3.44Å; E64-K147 WeakPolarHBondContact O-CG 3.33Å
65	Q	93.6	Very high	95.9	Very high	16 Å²	16	58.1 Å²	58.1	8%	0.075	30%	0.296	C	S	.	.	H	α-helix	trans	-131.1	-0.8	-167.2	-55.3	-177.6	-88.9	0	0	114.7	I61 D144 I145 G146	I61-Q65 PolarHBondContact O-N 3.24Å; Q65-D144 PolarHBondContact NE2-O 3.09Å; Q65-I145 PolarHBondContact NE2-O 3.32Å; Q65-I145 VanDerWaalsContact NE2-O 3.14Å; Q65-G146 PolarHBondContact NE2-O 3.46Å
66	G	95.3	Very high	95.8	Very high	34 Å²	34	51 Å²	51	35%	0.351	26%	0.261	S	S	.	.			trans	86.2	152.3	-173	0	0	0	0	0	113.4	P62 L68 S69	P62-G66 CarbonylContact O-C 3.59Å; P62-G66 WeakPolarHBondContact O-CA 3.5Å; P62-G66 PolarHBondContact O-N 3.47Å; G66-L68 PolarHBondContact O-N 3.21Å; G66-S69 WeakPolarHBondContact O-CB 3.21Å; G66-S69 PolarHBondContact O-N 3.12Å; G66-S69 VanDerWaalsContact O-N 3.08Å; G66-S69 PolarHBondContact O-OG 2.77Å
67	F	95.9	Very high	95.5	Very high	126 Å²	126	49.3 Å²	49.3	55%	0.553	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-58.1	-41.4	-174.3	-178.8	-103.1	0	0	0	113.9	P62 S69 F70 W71	P62-F67 HydrophobicContact CG-CD2 4.47Å; F67-S69 PolarHBondContact O-N 3.07Å; F67-F70 HydrophobicContact CD2-CD2 4.19Å; F67-F70 HydrophobicContact CD2-CE2 4.16Å; F67-F70 HydrophobicContact CE2-CD2 4.23Å; F67-F70 HydrophobicContact CE2-CE2 4.2Å; F67-F70 VanDerWaalsContact O-CD2 3.3Å; F67-F70 WeakPolarHBondContact O-CD2 3.36Å; F67-F70 PolarHBondContact O-N 3.42Å; F67-W71 HydrophobicContact CD1-CZ3 4.31Å; F67-W71 HydrophobicContact CE1-CH2 4.1Å; F67-W71 AromaticContact CE1-CZ3 3.86Å; F67-W71 HydrophobicContact CE1-CZ3 3.86Å; F67-W71 HydrophobicContact CZ-CH2 4.23Å; F67-W71 HydrophobicContact CZ-CZ3 4.24Å
68	L	96.2	Very high	95.4	Very high	143 Å²	143	51.1 Å²	51.1	75%	0.749	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-64.6	-14.7	-179.8	-64.1	178.6	0	0	0	113.5	G66 F70 W71	G66-L68 PolarHBondContact O-N 3.21Å; L68-F70 PolarHBondContact O-N 2.94Å; L68-W71 PolarHBondContact O-N 3.5Å; L68-W71 VanDerWaalsContact O-N 3.16Å
69	S	95.9	Very high	95.4	Very high	7 Å²	7	51.5 Å²	51.5	5%	0.049	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-64.2	-18.5	177.4	72.4	0	0	0	0	113.1	R31 I61 G66 F67 W71 R72	R31-S69 WeakPolarHBondContact CD-O 3.44Å; R31-S69 VanDerWaalsContact CZ-O 3.22Å; R31-S69 PolarHBondContact NE-O 3.36Å; R31-S69 VanDerWaalsContact NE-O 3.17Å; R31-S69 VanDerWaalsContact NH1-C 3.34Å; R31-S69 PolarHBondContact NH1-O 3.37Å; R31-S69 PolarHBondContact NH1-OG 3.11Å; I61-S69 WeakPolarHBondContact CG2-OG 3.39Å; G66-S69 WeakPolarHBondContact O-CB 3.21Å; G66-S69 PolarHBondContact O-N 3.12Å; G66-S69 VanDerWaalsContact O-N 3.08Å; G66-S69 PolarHBondContact O-OG 2.77Å; F67-S69 PolarHBondContact O-N 3.07Å; S69-W71 PolarHBondContact O-N 3.39Å; S69-R72 WeakPolarHBondContact O-CB 3.49Å; S69-R72 PolarHBondContact O-N 3.41Å
70	F	97.3	Very high	95.2	Very high	12 Å²	12	50.8 Å²	50.8	5%	0.053	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-55.4	-31.1	171.6	-81	-56.3	0	0	0	113.5	P28 R31 V32 V58 I61 P62 F67 L68 R72	P28-F70 HydrophobicContact CB-CB 3.83Å; P28-F70 HydrophobicContact CB-CD1 3.82Å; P28-F70 HydrophobicContact CB-CG 3.84Å; P28-F70 HydrophobicContact CG-CB 3.97Å; P28-F70 HydrophobicContact CG-CG 4.39Å; R31-F70 WeakPolarHBondContact CD-O 3.34Å; V32-F70 HydrophobicContact CG2-CE1 4.43Å; V58-F70 HydrophobicContact CG1-CZ 4.21Å; I61-F70 HydrophobicContact CB-CE1 3.98Å; I61-F70 HydrophobicContact CB-CZ 4.21Å; I61-F70 HydrophobicContact CD1-CD1 4.3Å; I61-F70 HydrophobicContact CD1-CE1 3.85Å; I61-F70 HydrophobicContact CG2-CD1 3.87Å; I61-F70 HydrophobicContact CG2-CE1 3.73Å; I61-F70 HydrophobicContact CG2-CE2 4.46Å; I61-F70 HydrophobicContact CG2-CG 4.27Å; I61-F70 HydrophobicContact CG2-CZ 4.04Å; P62-F70 HydrophobicContact CG-CD2 4.49Å; P62-F70 HydrophobicContact CG-CE2 3.51Å; P62-F70 HydrophobicContact CG-CZ 3.78Å; F67-F70 HydrophobicContact CD2-CD2 4.19Å; F67-F70 HydrophobicContact CD2-CE2 4.16Å; F67-F70 HydrophobicContact CE2-CD2 4.23Å; F67-F70 HydrophobicContact CE2-CE2 4.2Å; F67-F70 VanDerWaalsContact O-CD2 3.3Å; F67-F70 WeakPolarHBondContact O-CD2 3.36Å; F67-F70 PolarHBondContact O-N 3.42Å; L68-F70 PolarHBondContact O-N 2.94Å; F70-R72 VanDerWaalsContact C-N 3.32Å
71	W	97.9	Very high	94.9	Very high	84 Å²	84	50.8 Å²	50.8	32%	0.318	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-92.6	12.5	179.3	-70.9	-91.6	0	0	0	113.6	T24 A27 P28 F67 L68 S69 G73 N74	T24-W71 PolarHBondContact O-NE1 3.46Å; A27-W71 HydrophobicContact CB-CG 4.28Å; P28-W71 HydrophobicContact CG-CH2 3.88Å; P28-W71 HydrophobicContact CG-CZ2 3.58Å; P28-W71 HydrophobicContact CG-CZ3 4.45Å; F67-W71 HydrophobicContact CD1-CZ3 4.31Å; F67-W71 HydrophobicContact CE1-CH2 4.1Å; F67-W71 AromaticContact CE1-CZ3 3.86Å; F67-W71 HydrophobicContact CE1-CZ3 3.86Å; F67-W71 HydrophobicContact CZ-CH2 4.23Å; F67-W71 HydrophobicContact CZ-CZ3 4.24Å; L68-W71 PolarHBondContact O-N 3.5Å; L68-W71 VanDerWaalsContact O-N 3.16Å; S69-W71 PolarHBondContact O-N 3.39Å; W71-G73 PolarHBondContact O-N 3Å; W71-G73 VanDerWaalsContact O-N 3.15Å; W71-N74 HydrophobicContact CB-CB 4.12Å; W71-N74 WeakPolarHBondContact O-CB 3.35Å; W71-N74 PolarHBondContact O-N 3.33Å
72	R	96.3	Very high	94.7	Very high	24 Å²	24	54 Å²	54	9%	0.091	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	120.2	-180	-164.1	173.7	-174.6	158	2.6	110.9	S69 F70 L141 D144 G146 F154	S69-R72 WeakPolarHBondContact O-CB 3.49Å; S69-R72 PolarHBondContact O-N 3.41Å; F70-R72 VanDerWaalsContact C-N 3.32Å; R72-L141 WeakPolarHBondContact CD-O 3.41Å; R72-L141 HydrophobicContact CG-CB 4.37Å; R72-L141 VanDerWaalsContact CG-O 3.24Å; R72-L141 WeakPolarHBondContact CG-O 3.37Å; R72-L141 PolarHBondContact NE-O 2.91Å; R72-D144 VanDerWaalsContact CZ-CG 3.48Å; R72-D144 IonicContact CZ-OD1 3.93Å; R72-D144 IonicContact CZ-OD2 3.34Å; R72-D144 PolarHBondContact NH1-O 3.15Å; R72-D144 IonicContact NH1-OD1 3.77Å; R72-D144 IonicContact NH1-OD2 3.9Å; R72-D144 IonicContact NH2-OD1 3.77Å; R72-D144 IonicContact NH2-OD2 2.64Å; R72-D144 PolarHBondContact NH2-OD2 3.32Å; R72-G146 PolarHBondContact NH1-O 2.98Å; R72-F154 PolarHBondContact NH2-O 2.89Å
73	G	94.6	Very high	94.6	Very high	11 Å²	11	54.2 Å²	54.2	11%	0.113	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	-1.2	-173.8	0	0	0	0	0	115	W71 L75 A76	W71-G73 PolarHBondContact O-N 3Å; W71-G73 VanDerWaalsContact O-N 3.15Å; G73-L75 VanDerWaalsContact C-N 3.28Å; G73-L75 PolarHBondContact O-N 3.17Å; G73-A76 PolarHBondContact O-N 2.85Å
74	N	96.5	Very high	94.4	Very high	15 Å²	15	47 Å²	47	8%	0.08	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-27.4	-176.9	-172	51.8	0	0	0	114	T24 A27 W71 A76 N77 V78	T24-N74 PolarHBondContact OG1-ND2 3.44Å; A27-N74 HydrophobicContact CB-CB 4.2Å; W71-N74 HydrophobicContact CB-CB 4.12Å; W71-N74 WeakPolarHBondContact O-CB 3.35Å; W71-N74 PolarHBondContact O-N 3.33Å; N74-A76 PolarHBondContact O-N 3.05Å; N74-N77 WeakPolarHBondContact O-CA 3.49Å; N74-N77 VanDerWaalsContact O-CB 3.24Å; N74-N77 WeakPolarHBondContact O-CB 3.39Å; N74-N77 PolarHBondContact O-N 3.07Å; N74-N77 PolarHBondContact OD1-ND2 3.06Å; N74-V78 PolarHBondContact O-N 3.42Å
75	L	95.4	Very high	94.1	Very high	106 Å²	106	47.1 Å²	47.1	56%	0.555	24%	0.238	S	C	*	.	H	α-helix	trans	-53.5	-40.6	176.6	-179.8	61.8	0	0	0	112.2	G73 N77 V78 I79 L157	G73-L75 VanDerWaalsContact C-N 3.28Å; G73-L75 PolarHBondContact O-N 3.17Å; L75-N77 PolarHBondContact O-N 2.58Å; L75-V78 PolarHBondContact O-N 3.49Å; L75-I79 HydrophobicContact CD1-CD1 3.88Å; L75-I79 HydrophobicContact CD1-CG1 4.21Å; L75-I79 HydrophobicContact CD2-CD1 4.38Å; L75-I79 HydrophobicContact CG-CD1 3.77Å; L75-I79 HydrophobicContact CG-CG1 4.46Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.4Å; L75-L157 HydrophobicContact CD2-CB 4.3Å; L75-L157 HydrophobicContact CD2-CD2 4.22Å; L75-L157 HydrophobicContact CG-CD2 4.22Å
76	A	94.5	Very high	94	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-31	176.5	0	0	0	0	0	112.3	G73 N74 R80 L134 R138 L157	G73-A76 PolarHBondContact O-N 2.85Å; N74-A76 PolarHBondContact O-N 3.05Å; A76-R80 WeakPolarHBondContact O-CB 3.25Å; A76-R80 PolarHBondContact O-N 3.23Å; A76-L134 HydrophobicContact CB-CB 4.47Å; A76-R138 HydrophobicContact CB-CB 3.8Å; A76-R138 HydrophobicContact CB-CG 4.41Å; A76-L157 HydrophobicContact CB-CD1 4.09Å; A76-L157 HydrophobicContact CB-CD2 4.3Å
77	N	90.6	Very high	93.8	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-69	-43	179.6	-58.1	-26.5	0	0	0	112.3	K23 N74 L75 R138	K23-N77 HydrophobicContact CB-CB 4.03Å; K23-N77 HydrophobicContact CG-CB 4.34Å; N74-N77 WeakPolarHBondContact O-CA 3.49Å; N74-N77 VanDerWaalsContact O-CB 3.24Å; N74-N77 WeakPolarHBondContact O-CB 3.39Å; N74-N77 PolarHBondContact O-N 3.07Å; N74-N77 PolarHBondContact OD1-ND2 3.06Å; L75-N77 PolarHBondContact O-N 2.58Å; N77-R138 PolarHBondContact ND2-NE 2.93Å; N77-R138 PolarHBondContact ND2-NH2 2.64Å; N77-R138 WeakPolarHBondContact OD1-CD 3.44Å; N77-R138 WeakPolarHBondContact OD1-CG 3.21Å; N77-R138 PolarHBondContact OD1-NE 3.14Å; N77-R138 PolarHBondContact OD1-NH1 3.3Å; N77-R138 PolarHBondContact OD1-NH2 3.05Å
78	V	94.1	Very high	93.3	Very high	37 Å²	37	44.3 Å²	44.3	22%	0.224	23%	0.228	C	C	.	.	H	α-helix	trans	-66.1	-50.8	179.1	176.3	0	0	0	0	109.3	A20 N74 L75 R80 Y81	A20-V78 HydrophobicContact CB-CB 4.4Å; A20-V78 HydrophobicContact CB-CG1 3.76Å; A20-V78 HydrophobicContact CB-CG2 4.08Å; N74-V78 PolarHBondContact O-N 3.42Å; L75-V78 PolarHBondContact O-N 3.49Å; V78-R80 PolarHBondContact O-N 3.36Å; V78-Y81 PolarHBondContact O-N 2.93Å
79	I	95.1	Very high	92.8	Very high	68 Å²	68	43.2 Å²	43.2	35%	0.349	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-43.7	-179.1	-66.9	173.1	0	0	0	111.3	L75 Y81 F82 P83 L134 L157	L75-I79 HydrophobicContact CD1-CD1 3.88Å; L75-I79 HydrophobicContact CD1-CG1 4.21Å; L75-I79 HydrophobicContact CD2-CD1 4.38Å; L75-I79 HydrophobicContact CG-CD1 3.77Å; L75-I79 HydrophobicContact CG-CG1 4.46Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 3.4Å; I79-Y81 PolarHBondContact O-N 3.47Å; I79-F82 PolarHBondContact O-N 2.87Å; I79-P83 WeakPolarHBondContact O-CD 3.45Å; I79-L134 HydrophobicContact CG2-CD1 4.01Å; I79-L157 HydrophobicContact CD1-CD2 3.88Å
80	R	92.9	Very high	92.5	Very high	63 Å²	63	45.5 Å²	45.5	24%	0.238	24%	0.237	C	C	.	.	H	α-helix	trans	-57.9	-27	-172.5	-172.7	-174.3	75.6	92.3	11.3	113.8	A76 V78 P83 T84 V131 L134 D135	A76-R80 WeakPolarHBondContact O-CB 3.25Å; A76-R80 PolarHBondContact O-N 3.23Å; V78-R80 PolarHBondContact O-N 3.36Å; R80-P83 WeakPolarHBondContact O-CD 3.48Å; R80-T84 VanDerWaalsContact O-CB 3.25Å; R80-T84 WeakPolarHBondContact O-CB 3.39Å; R80-T84 PolarHBondContact O-N 3.12Å; R80-T84 PolarHBondContact O-OG1 3.03Å; R80-V131 HydrophobicContact CG-CB 4.21Å; R80-V131 HydrophobicContact CG-CG2 4.23Å; R80-L134 HydrophobicContact CB-CD1 4.06Å; R80-L134 HydrophobicContact CG-CD1 4.42Å; R80-D135 WeakPolarHBondContact CD-OD1 3Å; R80-D135 IonicContact NE-OD1 3.34Å
81	Y	90.6	Very high	92.2	Very high	49 Å²	49	48.6 Å²	48.6	19%	0.192	25%	0.25	C	S	.	.	H	α-helix	trans	-57	-53.3	179.4	178.1	-89.4	0	0	0	111.8	G15 A19 V78 I79 T84 Q85	G15-Y81 VanDerWaalsContact C-OH 3.24Å; G15-Y81 WeakPolarHBondContact CA-OH 3.31Å; A19-Y81 HydrophobicContact CB-CD2 3.28Å; A19-Y81 HydrophobicContact CB-CE2 3.61Å; A19-Y81 HydrophobicContact CB-CG 3.85Å; V78-Y81 PolarHBondContact O-N 2.93Å; I79-Y81 PolarHBondContact O-N 3.47Å; Y81-T84 PolarHBondContact O-N 3.33Å; Y81-Q85 HydrophobicContact CD1-CG 3.95Å; Y81-Q85 HydrophobicContact CD2-CG 4.08Å; Y81-Q85 HydrophobicContact CE1-CB 4.36Å; Y81-Q85 HydrophobicContact CE1-CG 3.53Å; Y81-Q85 HydrophobicContact CE2-CG 3.69Å; Y81-Q85 HydrophobicContact CG-CG 4.22Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.41Å; Y81-Q85 WeakPolarHBondContact O-CG 2.98Å; Y81-Q85 PolarHBondContact O-N 3.26Å
82	F	91.4	Very high	91.5	Very high	67 Å²	67	48.9 Å²	48.9	29%	0.294	25%	0.254	S	S	.	.	H	α-helix	trans	-59	-54.7	-172.7	-59.7	-77.3	0	0	0	114.1	F12 L13 I79 T84 Q85 A86	F12-F82 HydrophobicContact CD1-CD1 4.33Å; F12-F82 AromaticContact CE1-CD1 3.57Å; F12-F82 HydrophobicContact CE1-CD1 3.57Å; F12-F82 HydrophobicContact CE1-CE1 4.32Å; F12-F82 HydrophobicContact CZ-CB 4.12Å; F12-F82 AromaticContact CZ-CD1 3.84Å; F12-F82 HydrophobicContact CZ-CD1 3.84Å; F12-F82 HydrophobicContact CZ-CG 4.5Å; L13-F82 HydrophobicContact CD2-CE1 4.44Å; I79-F82 PolarHBondContact O-N 2.87Å; F82-T84 VanDerWaalsContact C-N 3.31Å; F82-T84 PolarHBondContact O-N 2.86Å; F82-Q85 PolarHBondContact O-N 3.36Å; F82-A86 PolarHBondContact O-N 3.45Å
83	P	93.5	Very high	91.2	Very high	45 Å²	45	52.8 Å²	52.8	29%	0.292	28%	0.277	S	S	.	.	H	α-helix	trans	-66.8	-33.9	178.5	27.6	-33.3	0	0	0	111.8	I79 R80 Q85 A86 L87 V131 L134	I79-P83 WeakPolarHBondContact O-CD 3.45Å; R80-P83 WeakPolarHBondContact O-CD 3.48Å; P83-Q85 PolarHBondContact O-N 3.39Å; P83-A86 PolarHBondContact O-N 3.24Å; P83-L87 WeakPolarHBondContact O-CB 3.49Å; P83-L87 WeakPolarHBondContact O-CD1 3.48Å; P83-L87 WeakPolarHBondContact O-CG 3.31Å; P83-L87 PolarHBondContact O-N 2.92Å; P83-V131 HydrophobicContact CB-CG1 3.9Å; P83-V131 HydrophobicContact CG-CG1 3.82Å; P83-L134 HydrophobicContact CG-CD1 4.44Å
84	T	90.6	Very high	91.1	Very high	21 Å²	21	59 Å²	59	13%	0.129	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-43.4	176.2	-56.5	0	0	0	0	110.9	R80 Y81 F82 L87 N88	R80-T84 VanDerWaalsContact O-CB 3.25Å; R80-T84 WeakPolarHBondContact O-CB 3.39Å; R80-T84 PolarHBondContact O-N 3.12Å; R80-T84 PolarHBondContact O-OG1 3.03Å; Y81-T84 PolarHBondContact O-N 3.33Å; F82-T84 VanDerWaalsContact C-N 3.31Å; F82-T84 PolarHBondContact O-N 2.86Å; T84-L87 PolarHBondContact O-N 2.86Å; T84-N88 WeakPolarHBondContact O-CB 3.18Å; T84-N88 VanDerWaalsContact O-CG 3.29Å; T84-N88 PolarHBondContact O-N 3.13Å; T84-N88 PolarHBondContact O-ND2 3.04Å
85	Q	88.4	Confident	90.9	Very high	52 Å²	52	60.6 Å²	60.6	24%	0.243	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-42.6	178.4	-69.5	-53.2	-10.3	0	0	111.9	F12 Y81 F82 P83 L87 N88 F89	F12-Q85 HydrophobicContact CD2-CB 4.32Å; F12-Q85 HydrophobicContact CE2-CB 3.68Å; Y81-Q85 HydrophobicContact CD1-CG 3.95Å; Y81-Q85 HydrophobicContact CD2-CG 4.08Å; Y81-Q85 HydrophobicContact CE1-CB 4.36Å; Y81-Q85 HydrophobicContact CE1-CG 3.53Å; Y81-Q85 HydrophobicContact CE2-CG 3.69Å; Y81-Q85 HydrophobicContact CG-CG 4.22Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.41Å; Y81-Q85 WeakPolarHBondContact O-CG 2.98Å; Y81-Q85 PolarHBondContact O-N 3.26Å; F82-Q85 PolarHBondContact O-N 3.36Å; P83-Q85 PolarHBondContact O-N 3.39Å; Q85-L87 VanDerWaalsContact C-N 3.29Å; Q85-L87 PolarHBondContact O-N 3.38Å; Q85-N88 WeakPolarHBondContact O-CB 3.39Å; Q85-N88 PolarHBondContact O-N 2.91Å; Q85-N88 VanDerWaalsContact O-N 3.13Å; Q85-F89 HydrophobicContact CB-CD2 4.41Å; Q85-F89 HydrophobicContact CB-CE2 4.27Å; Q85-F89 WeakPolarHBondContact O-CD2 3.24Å; Q85-F89 PolarHBondContact O-N 3.03Å
86	A	90.3	Very high	90.7	Very high	51 Å²	51	59.7 Å²	59.7	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-55.4	-45	174.6	0	0	0	0	0	111.8	F82 P83 F89 A90	F82-A86 PolarHBondContact O-N 3.45Å; P83-A86 PolarHBondContact O-N 3.24Å; A86-F89 PolarHBondContact O-N 2.78Å; A86-A90 PolarHBondContact O-N 3Å
87	L	91.3	Very high	90.6	Very high	25 Å²	25	67.6 Å²	67.6	13%	0.131	33%	0.332	C	S	.	.	H	α-helix	trans	-67.3	-38.8	176.7	-67.9	165.8	0	0	0	112.4	P83 T84 Q85 A90 F91 F130 V131	P83-L87 WeakPolarHBondContact O-CB 3.49Å; P83-L87 WeakPolarHBondContact O-CD1 3.48Å; P83-L87 WeakPolarHBondContact O-CG 3.31Å; P83-L87 PolarHBondContact O-N 2.92Å; T84-L87 PolarHBondContact O-N 2.86Å; Q85-L87 VanDerWaalsContact C-N 3.29Å; Q85-L87 PolarHBondContact O-N 3.38Å; L87-A90 PolarHBondContact O-N 3.41Å; L87-F91 HydrophobicContact CB-CD2 4.47Å; L87-F91 HydrophobicContact CD2-CD2 4.14Å; L87-F91 HydrophobicContact CD2-CE2 3.77Å; L87-F91 WeakPolarHBondContact O-CB 3.46Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.45Å; L87-F91 PolarHBondContact O-N 3.15Å; L87-F130 HydrophobicContact CD1-CB 3.77Å; L87-F130 HydrophobicContact CD1-CD2 3.67Å; L87-F130 HydrophobicContact CD1-CG 3.96Å; L87-F130 HydrophobicContact CD2-CD2 3.82Å; L87-F130 HydrophobicContact CD2-CE2 3.97Å; L87-F130 HydrophobicContact CD2-CG 4.44Å; L87-F130 HydrophobicContact CG-CD2 4.43Å; L87-V131 HydrophobicContact CD1-CG1 4.28Å
88	N	86.5	Confident	90.9	Very high	41 Å²	41	72.7 Å²	72.7	22%	0.219	36%	0.358	C	S	.	.	H	α-helix	trans	-61.5	-45.4	173.9	-78.4	-32.8	0	0	0	111.5	T84 Q85 A90 F91 K92	T84-N88 WeakPolarHBondContact O-CB 3.18Å; T84-N88 VanDerWaalsContact O-CG 3.29Å; T84-N88 PolarHBondContact O-N 3.13Å; T84-N88 PolarHBondContact O-ND2 3.04Å; Q85-N88 WeakPolarHBondContact O-CB 3.39Å; Q85-N88 PolarHBondContact O-N 2.91Å; Q85-N88 VanDerWaalsContact O-N 3.13Å; N88-A90 VanDerWaalsContact C-N 3.28Å; N88-A90 PolarHBondContact O-N 3.28Å; N88-F91 PolarHBondContact O-N 3.09Å; N88-K92 WeakPolarHBondContact O-CB 3.21Å; N88-K92 PolarHBondContact O-N 3.34Å
89	F	86	Confident	90.8	Very high	119 Å²	119	74 Å²	74	52%	0.522	36%	0.36	S	S	.	.	H	α-helix	trans	-60.5	-38.7	176.1	-77.4	-65.4	0	0	0	111.8	F8 F12 Q85 A86	F8-F89 HydrophobicContact CE2-CD1 4.07Å; F8-F89 HydrophobicContact CE2-CD2 4.17Å; F8-F89 AromaticContact CE2-CE1 3.87Å; F8-F89 HydrophobicContact CE2-CE1 3.87Å; F8-F89 AromaticContact CE2-CE2 3.99Å; F8-F89 HydrophobicContact CE2-CE2 3.99Å; F8-F89 HydrophobicContact CE2-CG 4.23Å; F8-F89 AromaticContact CE2-CZ 3.83Å; F8-F89 HydrophobicContact CE2-CZ 3.83Å; F8-F89 HydrophobicContact CZ-CD2 4.04Å; F8-F89 HydrophobicContact CZ-CE2 4.09Å; F8-F89 HydrophobicContact CZ-CG 4.35Å; F8-F89 HydrophobicContact CZ-CZ 4.4Å; F12-F89 HydrophobicContact CD2-CE2 4.08Å; Q85-F89 HydrophobicContact CB-CD2 4.41Å; Q85-F89 HydrophobicContact CB-CE2 4.27Å; Q85-F89 WeakPolarHBondContact O-CD2 3.24Å; Q85-F89 PolarHBondContact O-N 3.03Å; A86-F89 PolarHBondContact O-N 2.78Å
90	A	89.8	Confident	90.7	Very high	55 Å²	55	71.9 Å²	71.9	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-71.3	-41.8	179.2	0	0	0	0	0	113.7	A86 L87 N88	A86-A90 PolarHBondContact O-N 3Å; L87-A90 PolarHBondContact O-N 3.41Å; N88-A90 VanDerWaalsContact C-N 3.28Å; N88-A90 PolarHBondContact O-N 3.28Å
91	F	89.8	Confident	90.7	Very high	77 Å²	77	71.2 Å²	71.2	34%	0.338	36%	0.362	S	S	.	.	H	α-helix	trans	-115	-24.2	-164	-65.3	-71.9	0	0	0	115.6	L87 N88 D93 K94 Y95 T126	L87-F91 HydrophobicContact CB-CD2 4.47Å; L87-F91 HydrophobicContact CD2-CD2 4.14Å; L87-F91 HydrophobicContact CD2-CE2 3.77Å; L87-F91 WeakPolarHBondContact O-CB 3.46Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.45Å; L87-F91 PolarHBondContact O-N 3.15Å; N88-F91 PolarHBondContact O-N 3.09Å; F91-D93 PolarHBondContact O-N 3.01Å; F91-K94 PolarHBondContact O-N 3.28Å; F91-Y95 HydrophobicContact CB-CD2 3.98Å; F91-Y95 HydrophobicContact CB-CE2 3.72Å; F91-Y95 HydrophobicContact CG-CE2 4.4Å; F91-Y95 VanDerWaalsContact O-CD2 3.23Å; F91-Y95 WeakPolarHBondContact O-CD2 3.2Å; F91-Y95 PolarHBondContact O-N 3.39Å; F91-T126 HydrophobicContact CD2-CG2 3.85Å; F91-T126 HydrophobicContact CE2-CG2 4.05Å; F91-T126 HydrophobicContact CG-CG2 4.12Å; F91-T126 HydrophobicContact CZ-CG2 4.47Å
92	K	84.6	Confident	90.6	Very high	90 Å²	90	72.9 Å²	72.9	39%	0.391	39%	0.394	S	S	.	.	H	α-helix	trans	-60.1	-47	-171.2	-175.6	-179.4	178.7	-174.7	0	112.1	N88 Y95 K96	N88-K92 WeakPolarHBondContact O-CB 3.21Å; N88-K92 PolarHBondContact O-N 3.34Å; K92-Y95 PolarHBondContact O-N 3.04Å; K92-K96 WeakPolarHBondContact O-CG 3.46Å; K92-K96 PolarHBondContact O-N 2.85Å
93	D	88.1	Confident	90.6	Very high	106 Å²	106	70.8 Å²	70.8	57%	0.567	39%	0.387	S	S	*	.	H	α-helix	trans	-74.7	-31.2	-178.2	-65	-29.2	0	0	0	112.2	F91 K96 K97	F91-D93 PolarHBondContact O-N 3.01Å; D93-K96 PolarHBondContact O-N 3.24Å; D93-K97 WeakPolarHBondContact O-CB 3.37Å; D93-K97 PolarHBondContact O-N 3.46Å
94	K	92.6	Very high	90.3	Very high	143 Å²	143	72.3 Å²	72.3	62%	0.622	39%	0.393	S	S	*	.	H	α-helix	trans	-60.8	-49.1	171.1	-64.6	-66.7	-174	177.5	0	110.9	F91 K97 I98	F91-K94 PolarHBondContact O-N 3.28Å; K94-K97 PolarHBondContact O-N 3.2Å; K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.37Å; K94-I98 PolarHBondContact O-N 3.4Å
95	Y	93.5	Very high	90.1	Very high	47 Å²	47	76.1 Å²	76.1	18%	0.184	41%	0.409	C	S	.	.	H	α-helix	trans	-65.2	-40	177.1	-72.1	-51.4	0	0	0	112.6	F91 K92 K97 I98 F99 A122 A123 T126	F91-Y95 HydrophobicContact CB-CD2 3.98Å; F91-Y95 HydrophobicContact CB-CE2 3.72Å; F91-Y95 HydrophobicContact CG-CE2 4.4Å; F91-Y95 VanDerWaalsContact O-CD2 3.23Å; F91-Y95 WeakPolarHBondContact O-CD2 3.2Å; F91-Y95 PolarHBondContact O-N 3.39Å; K92-Y95 PolarHBondContact O-N 3.04Å; Y95-K97 VanDerWaalsContact C-N 3.33Å; Y95-K97 PolarHBondContact O-N 3.13Å; Y95-I98 HydrophobicContact CD1-CD1 4.42Å; Y95-I98 PolarHBondContact O-N 2.67Å; Y95-F99 HydrophobicContact CD1-CD2 4.4Å; Y95-F99 AromaticContact CD1-CE2 3.74Å; Y95-F99 HydrophobicContact CD1-CE2 3.74Å; Y95-F99 HydrophobicContact CG-CE2 4.38Å; Y95-F99 WeakPolarHBondContact O-CD2 3.47Å; Y95-F99 PolarHBondContact O-N 2.78Å; Y95-A122 HydrophobicContact CD1-CB 3.77Å; Y95-A122 HydrophobicContact CD2-CB 4.22Å; Y95-A122 HydrophobicContact CE1-CB 3.78Å; Y95-A122 HydrophobicContact CE2-CB 4.2Å; Y95-A122 HydrophobicContact CG-CB 4.01Å; Y95-A123 HydrophobicContact CD2-CB 3.82Å; Y95-A123 HydrophobicContact CE2-CB 4.39Å; Y95-T126 PolarHBondContact OH-OG1 3.47Å
96	K	90.7	Very high	89.9	Confident	87 Å²	87	83.1 Å²	83.1	38%	0.378	44%	0.439	S	S	.	.	H	α-helix	trans	-57.6	-46.8	172.3	-77	179.7	172.9	-175.7	0	111.4	K92 D93 I98 F99 L100 S119	K92-K96 WeakPolarHBondContact O-CG 3.46Å; K92-K96 PolarHBondContact O-N 2.85Å; D93-K96 PolarHBondContact O-N 3.24Å; K96-I98 VanDerWaalsContact C-N 3.34Å; K96-I98 PolarHBondContact O-N 2.9Å; K96-F99 PolarHBondContact O-N 3.17Å; K96-L100 HydrophobicContact CG-CD1 4.47Å; K96-L100 WeakPolarHBondContact O-CA 3.15Å; K96-L100 VanDerWaalsContact O-CB 3.23Å; K96-L100 WeakPolarHBondContact O-CB 3.28Å; K96-L100 PolarHBondContact O-N 2.86Å; K96-S119 PolarHBondContact N-OG 2.95Å
97	K	93.4	Very high	89.8	Confident	167 Å²	167	85.9 Å²	85.9	73%	0.726	45%	0.451	S	S	*	.	H	α-helix	trans	-61.6	-41.5	178.2	-169.6	175.4	-178	177.7	0	112.1	D93 K94 Y95 G101	D93-K97 WeakPolarHBondContact O-CB 3.37Å; D93-K97 PolarHBondContact O-N 3.46Å; K94-K97 PolarHBondContact O-N 3.2Å; Y95-K97 VanDerWaalsContact C-N 3.33Å; Y95-K97 PolarHBondContact O-N 3.13Å; K97-G101 VanDerWaalsContact O-CA 3.24Å; K97-G101 WeakPolarHBondContact O-CA 3.29Å; K97-G101 PolarHBondContact O-N 2.82Å
98	I	95.1	Very high	89.8	Confident	116 Å²	116	88.8 Å²	88.8	60%	0.595	46%	0.464	S	S	*	.	H	α-helix	trans	-64.9	-47.7	178.7	-69.1	164.3	0	0	0	111.6	K94 Y95 K96	K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.37Å; K94-I98 PolarHBondContact O-N 3.4Å; Y95-I98 HydrophobicContact CD1-CD1 4.42Å; Y95-I98 PolarHBondContact O-N 2.67Å; K96-I98 VanDerWaalsContact C-N 3.34Å; K96-I98 PolarHBondContact O-N 2.9Å
99	F	92.9	Very high	89.9	Confident	64 Å²	64	91.2 Å²	91.2	28%	0.281	47%	0.472	S	S	.	.	H	α-helix	trans	-93.6	-23.1	-170.7	-65.2	-66.7	0	0	0	114.5	Y95 K96 R111 G115 A118 S119 A122	Y95-F99 HydrophobicContact CD1-CD2 4.4Å; Y95-F99 AromaticContact CD1-CE2 3.74Å; Y95-F99 HydrophobicContact CD1-CE2 3.74Å; Y95-F99 HydrophobicContact CG-CE2 4.38Å; Y95-F99 WeakPolarHBondContact O-CD2 3.47Å; Y95-F99 PolarHBondContact O-N 2.78Å; K96-F99 PolarHBondContact O-N 3.17Å; F99-R111 PolarHBondContact O-NH1 3.11Å; F99-R111 PolarHBondContact O-NH2 2.7Å; F99-G115 WeakPolarHBondContact CB-O 3.22Å; F99-A118 HydrophobicContact CB-CB 4.44Å; F99-A118 HydrophobicContact CD1-CB 3.68Å; F99-A118 HydrophobicContact CD2-CB 4.3Å; F99-A118 HydrophobicContact CE1-CB 3.91Å; F99-A118 HydrophobicContact CE2-CB 4.49Å; F99-A118 HydrophobicContact CG-CB 3.89Å; F99-A118 HydrophobicContact CZ-CB 4.31Å; F99-S119 VanDerWaalsContact CD2-CA 3.49Å; F99-A122 HydrophobicContact CE2-CB 3.83Å; F99-A122 HydrophobicContact CZ-CB 4.36Å
100	L	92.8	Very high	90.1	Very high	25 Å²	25	94.7 Å²	94.7	13%	0.131	48%	0.482	C	S	.	.	H	α-helix	trans	-120.8	-0.7	-176.4	-60.8	168.3	0	0	0	113.5	K96 G102 V103 Y112 N116	K96-L100 HydrophobicContact CG-CD1 4.47Å; K96-L100 WeakPolarHBondContact O-CA 3.15Å; K96-L100 VanDerWaalsContact O-CB 3.23Å; K96-L100 WeakPolarHBondContact O-CB 3.28Å; K96-L100 PolarHBondContact O-N 2.86Å; L100-G102 PolarHBondContact O-N 3.29Å; L100-V103 PolarHBondContact O-N 3.37Å; L100-V103 VanDerWaalsContact O-N 3.11Å; L100-Y112 HydrophobicContact CD2-CD2 3.84Å; L100-Y112 HydrophobicContact CD2-CE2 4.16Å; L100-Y112 HydrophobicContact CD2-CG 4.38Å; L100-Y112 WeakPolarHBondContact CD2-O 3.46Å; L100-N116 WeakPolarHBondContact CD1-OD1 3.5Å
101	G	92.4	Very high	90.2	Very high	48 Å²	48	97.7 Å²	97.7	50%	0.495	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	122	175.9	0	0	0	0	0	111	K97 V103	K97-G101 VanDerWaalsContact O-CA 3.24Å; K97-G101 WeakPolarHBondContact O-CA 3.29Å; K97-G101 PolarHBondContact O-N 2.82Å; G101-V103 VanDerWaalsContact C-N 3.29Å; G101-V103 PolarHBondContact O-N 3.37Å
102	G	89.7	Confident	90.3	Very high	84 Å²	84	96.8 Å²	96.8	87%	0.866	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	10.2	179.7	0	0	0	0	0	115.6	L100	L100-G102 PolarHBondContact O-N 3.29Å
103	V	90.7	Very high	90.5	Very high	23 Å²	23	94.3 Å²	94.3	14%	0.139	47%	0.466	C	S	.	.			trans	-95	121.1	177.1	-177.3	0	0	0	0	110.1	L100 G101 Q108 R111 Y112	L100-V103 PolarHBondContact O-N 3.37Å; L100-V103 VanDerWaalsContact O-N 3.11Å; G101-V103 VanDerWaalsContact C-N 3.29Å; G101-V103 PolarHBondContact O-N 3.37Å; V103-Q108 HydrophobicContact CG1-CB 4.29Å; V103-R111 HydrophobicContact CG1-CB 4.28Å; V103-R111 HydrophobicContact CG1-CG 3.86Å; V103-R111 HydrophobicContact CG2-CG 4.03Å; V103-Y112 HydrophobicContact CG1-CD2 4.3Å
104	D	88.1	Confident	90.7	Very high	77 Å²	77	91.9 Å²	91.9	41%	0.412	46%	0.46	S	S	.	.			trans	-86.6	122.3	173.9	-173.2	-28.6	0	0	0	110.4	K106 T107 Q108	D104-K106 VanDerWaalsContact C-N 3.29Å; D104-K106 PolarHBondContact O-N 2.94Å; D104-K106 WeakPolarHBondContact OD1-CB 3.35Å; D104-K106 PolarHBondContact OD1-N 3.39Å; D104-T107 WeakPolarHBondContact CB-OG1 3.38Å; D104-Q108 WeakPolarHBondContact O-CB 3.48Å; D104-Q108 PolarHBondContact O-N 3.21Å
105	Q	84.9	Confident	90.7	Very high	101 Å²	101	85.1 Å²	85.1	47%	0.472	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-32.4	-179.8	-177.9	176.4	-1.8	0	0	113.2	Y112	Q105-Y112 HydrophobicContact CB-CD1 4.27Å; Q105-Y112 HydrophobicContact CB-CD2 3.84Å; Q105-Y112 HydrophobicContact CB-CE1 4.32Å; Q105-Y112 HydrophobicContact CB-CE2 3.91Å; Q105-Y112 HydrophobicContact CB-CG 4.03Å; Q105-Y112 HydrophobicContact CG-CD1 3.75Å; Q105-Y112 HydrophobicContact CG-CD2 4.24Å; Q105-Y112 HydrophobicContact CG-CE1 3.72Å; Q105-Y112 HydrophobicContact CG-CE2 4.22Å; Q105-Y112 HydrophobicContact CG-CG 4.01Å
106	K	84	Confident	90.6	Very high	199 Å²	199	83.5 Å²	83.5	87%	0.865	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-35.6	-174.4	-67.1	-178.8	173.4	178.8	0	112.4	D104	D104-K106 VanDerWaalsContact C-N 3.29Å; D104-K106 PolarHBondContact O-N 2.94Å; D104-K106 WeakPolarHBondContact OD1-CB 3.35Å; D104-K106 PolarHBondContact OD1-N 3.39Å
107	T	89.8	Confident	90.6	Very high	110 Å²	110	80.6 Å²	80.6	68%	0.675	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-23.3	-176.4	59.5	0	0	0	0	112.8	D104	D104-T107 WeakPolarHBondContact CB-OG1 3.38Å
108	Q	90.4	Very high	90.6	Very high	86 Å²	86	74.5 Å²	74.5	40%	0.402	40%	0.395	S	S	.	.			trans	-126.8	54.3	-172.8	-51.9	179.8	-70.7	0	0	113.1	V103 D104 W110 R111 Y112	V103-Q108 HydrophobicContact CG1-CB 4.29Å; D104-Q108 WeakPolarHBondContact O-CB 3.48Å; D104-Q108 PolarHBondContact O-N 3.21Å; Q108-W110 PolarHBondContact O-N 2.87Å; Q108-R111 HydrophobicContact CB-CB 4.02Å; Q108-R111 PolarHBondContact O-N 3.49Å; Q108-R111 VanDerWaalsContact O-N 3.13Å; Q108-Y112 WeakPolarHBondContact O-CB 3.49Å; Q108-Y112 PolarHBondContact O-N 3.35Å
109	F	89.1	Confident	90.5	Very high	91 Å²	91	69.1 Å²	69.1	40%	0.399	37%	0.368	S	S	.	.	H	α-helix	trans	-47.6	-55	-175.5	177.6	-97	0	0	0	113.9	R111 Y112 F113	F109-R111 VanDerWaalsContact C-N 3.34Å; F109-R111 PolarHBondContact O-N 2.92Å; F109-Y112 PolarHBondContact O-N 3.04Å; F109-F113 WeakPolarHBondContact O-CB 3.48Å; F109-F113 PolarHBondContact O-N 3.39Å
110	W	90.8	Very high	90.3	Very high	193 Å²	193	66.1 Å²	66.1	73%	0.731	36%	0.355	S	S	*	.	H	α-helix	trans	-65.7	-35.1	-177	-70.1	117.3	0	0	0	113.3	Q108 F113 A114	Q108-W110 PolarHBondContact O-N 2.87Å; W110-F113 HydrophobicContact CE3-CD1 4.29Å; W110-F113 HydrophobicContact CZ3-CD1 4.32Å; W110-F113 PolarHBondContact O-N 3.04Å; W110-A114 WeakPolarHBondContact O-CB 3.5Å; W110-A114 PolarHBondContact O-N 3.33Å
111	R	92.1	Very high	90.2	Very high	118 Å²	118	65.2 Å²	65.2	45%	0.445	35%	0.351	S	S	.	.	H	α-helix	trans	-69.5	-38.4	176	178.5	59.4	-175.4	80.3	2.7	111.5	F99 V103 Q108 F109 G115	F99-R111 PolarHBondContact O-NH1 3.11Å; F99-R111 PolarHBondContact O-NH2 2.7Å; V103-R111 HydrophobicContact CG1-CB 4.28Å; V103-R111 HydrophobicContact CG1-CG 3.86Å; V103-R111 HydrophobicContact CG2-CG 4.03Å; Q108-R111 HydrophobicContact CB-CB 4.02Å; Q108-R111 PolarHBondContact O-N 3.49Å; Q108-R111 VanDerWaalsContact O-N 3.13Å; F109-R111 VanDerWaalsContact C-N 3.34Å; F109-R111 PolarHBondContact O-N 2.92Å; R111-G115 PolarHBondContact O-N 2.92Å
112	Y	90.3	Very high	90.3	Very high	57 Å²	57	64.1 Å²	64.1	22%	0.224	34%	0.337	C	S	.	.	H	α-helix	trans	-67.6	-43.8	174.4	-177.3	-95.5	0	0	0	111.3	L100 V103 Q105 Q108 F109 G115 N116	L100-Y112 HydrophobicContact CD2-CD2 3.84Å; L100-Y112 HydrophobicContact CD2-CE2 4.16Å; L100-Y112 HydrophobicContact CD2-CG 4.38Å; L100-Y112 WeakPolarHBondContact CD2-O 3.46Å; V103-Y112 HydrophobicContact CG1-CD2 4.3Å; Q105-Y112 HydrophobicContact CB-CD1 4.27Å; Q105-Y112 HydrophobicContact CB-CD2 3.84Å; Q105-Y112 HydrophobicContact CB-CE1 4.32Å; Q105-Y112 HydrophobicContact CB-CE2 3.91Å; Q105-Y112 HydrophobicContact CB-CG 4.03Å; Q105-Y112 HydrophobicContact CG-CD1 3.75Å; Q105-Y112 HydrophobicContact CG-CD2 4.24Å; Q105-Y112 HydrophobicContact CG-CE1 3.72Å; Q105-Y112 HydrophobicContact CG-CE2 4.22Å; Q105-Y112 HydrophobicContact CG-CG 4.01Å; Q108-Y112 WeakPolarHBondContact O-CB 3.49Å; Q108-Y112 PolarHBondContact O-N 3.35Å; F109-Y112 PolarHBondContact O-N 3.04Å; Y112-G115 PolarHBondContact O-N 3Å; Y112-N116 WeakPolarHBondContact CD1-ND2 3.44Å; Y112-N116 WeakPolarHBondContact CE1-ND2 3.27Å; Y112-N116 WeakPolarHBondContact O-CB 3.17Å; Y112-N116 PolarHBondContact O-N 2.96Å; Y112-N116 PolarHBondContact O-ND2 3.21Å
113	F	89.8	Confident	90.4	Very high	39 Å²	39	60.4 Å²	60.4	17%	0.171	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-53.6	176.4	-176.8	-103	0	0	0	110.9	F109 W110 G115 N116 L117 A189 F192	F109-F113 WeakPolarHBondContact O-CB 3.48Å; F109-F113 PolarHBondContact O-N 3.39Å; W110-F113 HydrophobicContact CE3-CD1 4.29Å; W110-F113 HydrophobicContact CZ3-CD1 4.32Å; W110-F113 PolarHBondContact O-N 3.04Å; F113-G115 VanDerWaalsContact C-N 3.31Å; F113-G115 PolarHBondContact O-N 3.49Å; F113-N116 PolarHBondContact O-N 3Å; F113-N116 VanDerWaalsContact O-N 3.13Å; F113-L117 HydrophobicContact CD1-CD1 4Å; F113-L117 HydrophobicContact CD1-CG 4.43Å; F113-L117 HydrophobicContact CE1-CD1 3.49Å; F113-L117 VanDerWaalsContact CE1-CD1 3.49Å; F113-L117 HydrophobicContact CE1-CG 4.2Å; F113-L117 HydrophobicContact CZ-CD1 3.89Å; F113-L117 HydrophobicContact CZ-CD2 4.4Å; F113-L117 HydrophobicContact CZ-CG 4.35Å; F113-L117 WeakPolarHBondContact O-CG 3.46Å; F113-L117 PolarHBondContact O-N 3.42Å; F113-A189 HydrophobicContact CZ-CB 3.95Å; F113-F192 HydrophobicContact CE2-CB 4.12Å
114	A	92.5	Very high	90.4	Very high	54 Å²	54	60 Å²	60	45%	0.446	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-42.3	176.4	0	0	0	0	0	112.3	W110 N116 L117 A118	W110-A114 WeakPolarHBondContact O-CB 3.5Å; W110-A114 PolarHBondContact O-N 3.33Å; A114-N116 PolarHBondContact O-N 2.92Å; A114-L117 PolarHBondContact O-N 3.02Å; A114-A118 WeakPolarHBondContact O-CB 3.38Å; A114-A118 PolarHBondContact O-N 2.9Å
115	G	92.7	Very high	90.7	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-37.6	176.3	0	0	0	0	0	113.4	F99 R111 Y112 F113 S119	F99-G115 WeakPolarHBondContact CB-O 3.22Å; R111-G115 PolarHBondContact O-N 2.92Å; Y112-G115 PolarHBondContact O-N 3Å; F113-G115 VanDerWaalsContact C-N 3.31Å; F113-G115 PolarHBondContact O-N 3.49Å; G115-S119 WeakPolarHBondContact O-CB 3.48Å; G115-S119 PolarHBondContact O-N 2.72Å
116	N	89.8	Confident	91.2	Very high	13 Å²	13	53.7 Å²	53.7	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-70.4	-37.6	176	-87.9	-70.5	0	0	0	112.7	L100 Y112 F113 A114 G120	L100-N116 WeakPolarHBondContact CD1-OD1 3.5Å; Y112-N116 WeakPolarHBondContact CD1-ND2 3.44Å; Y112-N116 WeakPolarHBondContact CE1-ND2 3.27Å; Y112-N116 WeakPolarHBondContact O-CB 3.17Å; Y112-N116 PolarHBondContact O-N 2.96Å; Y112-N116 PolarHBondContact O-ND2 3.21Å; F113-N116 PolarHBondContact O-N 3Å; F113-N116 VanDerWaalsContact O-N 3.13Å; A114-N116 PolarHBondContact O-N 2.92Å; N116-G120 PolarHBondContact O-N 2.88Å
117	L	92.1	Very high	91.6	Very high	26 Å²	26	44.7 Å²	44.7	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-47.3	173.3	-64	-171.6	0	0	0	111	F113 A114 G120 G121 I185 R188 A189	F113-L117 HydrophobicContact CD1-CD1 4Å; F113-L117 HydrophobicContact CD1-CG 4.43Å; F113-L117 HydrophobicContact CE1-CD1 3.49Å; F113-L117 VanDerWaalsContact CE1-CD1 3.49Å; F113-L117 HydrophobicContact CE1-CG 4.2Å; F113-L117 HydrophobicContact CZ-CD1 3.89Å; F113-L117 HydrophobicContact CZ-CD2 4.4Å; F113-L117 HydrophobicContact CZ-CG 4.35Å; F113-L117 WeakPolarHBondContact O-CG 3.46Å; F113-L117 PolarHBondContact O-N 3.42Å; A114-L117 PolarHBondContact O-N 3.02Å; L117-G120 PolarHBondContact O-N 3.19Å; L117-G121 PolarHBondContact O-N 3.03Å; L117-I185 HydrophobicContact CB-CG2 4.5Å; L117-R188 HydrophobicContact CD2-CB 3.85Å; L117-A189 HydrophobicContact CD1-CB 3.99Å; L117-A189 HydrophobicContact CD2-CB 3.85Å
118	A	93.4	Very high	91.8	Very high	39 Å²	39	40 Å²	40	32%	0.322	21%	0.205	S	C	.	.	H	α-helix	trans	-63	-47.3	177.7	0	0	0	0	0	111.8	F99 A114 G120 G121 A122	F99-A118 HydrophobicContact CB-CB 4.44Å; F99-A118 HydrophobicContact CD1-CB 3.68Å; F99-A118 HydrophobicContact CD2-CB 4.3Å; F99-A118 HydrophobicContact CE1-CB 3.91Å; F99-A118 HydrophobicContact CE2-CB 4.49Å; F99-A118 HydrophobicContact CG-CB 3.89Å; F99-A118 HydrophobicContact CZ-CB 4.31Å; A114-A118 WeakPolarHBondContact O-CB 3.38Å; A114-A118 PolarHBondContact O-N 2.9Å; A118-G120 VanDerWaalsContact C-N 3.3Å; A118-G120 PolarHBondContact O-N 3.43Å; A118-G121 PolarHBondContact O-N 3.36Å; A118-A122 VanDerWaalsContact O-CB 3.23Å; A118-A122 WeakPolarHBondContact O-CB 3.35Å; A118-A122 PolarHBondContact O-N 3.36Å
119	S	92.2	Very high	92	Very high	4 Å²	4	39 Å²	39	3%	0.028	21%	0.207	C	C	.	.	H	α-helix	trans	-57.4	-44.4	175.3	177	0	0	0	0	111.8	K96 F99 G115 A123	K96-S119 PolarHBondContact N-OG 2.95Å; F99-S119 VanDerWaalsContact CD2-CA 3.49Å; G115-S119 WeakPolarHBondContact O-CB 3.48Å; G115-S119 PolarHBondContact O-N 2.72Å; S119-A123 VanDerWaalsContact O-CB 3.28Å; S119-A123 WeakPolarHBondContact O-CB 3.29Å; S119-A123 PolarHBondContact O-N 3.26Å
120	G	88.6	Confident	92.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-69	-44.9	178.6	0	0	0	0	0	115.2	N116 L117 A118 G124	N116-G120 PolarHBondContact O-N 2.88Å; L117-G120 PolarHBondContact O-N 3.19Å; A118-G120 VanDerWaalsContact C-N 3.3Å; A118-G120 PolarHBondContact O-N 3.43Å; G120-G124 PolarHBondContact O-N 3.1Å
121	G	91.9	Very high	92.5	Very high	6 Å²	6	31.8 Å²	31.8	6%	0.062	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-46.1	176.5	0	0	0	0	0	110.9	L117 A118 G124 A125	L117-G121 PolarHBondContact O-N 3.03Å; A118-G121 PolarHBondContact O-N 3.36Å; G121-G124 PolarHBondContact O-N 3.43Å; G121-A125 VanDerWaalsContact O-CB 3.25Å; G121-A125 WeakPolarHBondContact O-CB 3.4Å; G121-A125 PolarHBondContact O-N 2.91Å
122	A	93.8	Very high	92.8	Very high	24 Å²	24	26.2 Å²	26.2	20%	0.198	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-49.9	177.5	0	0	0	0	0	112.1	Y95 F99 A118 G124 A125 T126	Y95-A122 HydrophobicContact CD1-CB 3.77Å; Y95-A122 HydrophobicContact CD2-CB 4.22Å; Y95-A122 HydrophobicContact CE1-CB 3.78Å; Y95-A122 HydrophobicContact CE2-CB 4.2Å; Y95-A122 HydrophobicContact CG-CB 4.01Å; F99-A122 HydrophobicContact CE2-CB 3.83Å; F99-A122 HydrophobicContact CZ-CB 4.36Å; A118-A122 VanDerWaalsContact O-CB 3.23Å; A118-A122 WeakPolarHBondContact O-CB 3.35Å; A118-A122 PolarHBondContact O-N 3.36Å; A122-G124 VanDerWaalsContact C-N 3.29Å; A122-G124 PolarHBondContact O-N 3.25Å; A122-A125 PolarHBondContact O-N 2.91Å; A122-T126 WeakPolarHBondContact O-CB 3.41Å; A122-T126 PolarHBondContact O-N 3.19Å; A122-T126 PolarHBondContact O-OG1 3.1Å; A122-T126 VanDerWaalsContact O-OG1 3.04Å
123	A	91.3	Very high	93.1	Very high	6 Å²	6	24.3 Å²	24.3	5%	0.05	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-40.1	176.8	0	0	0	0	0	112.2	Y95 S119 S127	Y95-A123 HydrophobicContact CD2-CB 3.82Å; Y95-A123 HydrophobicContact CE2-CB 4.39Å; S119-A123 VanDerWaalsContact O-CB 3.28Å; S119-A123 WeakPolarHBondContact O-CB 3.29Å; S119-A123 PolarHBondContact O-N 3.26Å; A123-S127 WeakPolarHBondContact O-CB 3.34Å; A123-S127 PolarHBondContact O-N 2.65Å; A123-S127 PolarHBondContact O-OG 3.29Å
124	G	90.2	Very high	93.5	Very high	14 Å²	14	23.8 Å²	23.8	14%	0.144	15%	0.153	C	C	.	.	H	α-helix	trans	-65.3	-48.3	176.4	0	0	0	0	0	112.6	G120 G121 A122 S127 L128	G120-G124 PolarHBondContact O-N 3.1Å; G121-G124 PolarHBondContact O-N 3.43Å; A122-G124 VanDerWaalsContact C-N 3.29Å; A122-G124 PolarHBondContact O-N 3.25Å; G124-S127 PolarHBondContact O-N 2.75Å; G124-L128 WeakPolarHBondContact O-CB 3.24Å; G124-L128 VanDerWaalsContact O-CG 3.31Å; G124-L128 WeakPolarHBondContact O-CG 3.48Å; G124-L128 PolarHBondContact O-N 3.29Å
125	A	94.8	Very high	93.7	Very high	22 Å²	22	21.5 Å²	21.5	18%	0.182	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-47.6	177.9	0	0	0	0	0	111.3	G121 A122 S127 L128 C129 V181	G121-A125 VanDerWaalsContact O-CB 3.25Å; G121-A125 WeakPolarHBondContact O-CB 3.4Å; G121-A125 PolarHBondContact O-N 2.91Å; A122-A125 PolarHBondContact O-N 2.91Å; A125-S127 VanDerWaalsContact C-N 3.33Å; A125-S127 PolarHBondContact O-N 3.37Å; A125-L128 CarbonylContact O-C 3.56Å; A125-L128 PolarHBondContact O-N 3.39Å; A125-L128 VanDerWaalsContact O-N 3.12Å; A125-C129 PolarHBondContact O-N 3.39Å; A125-C129 PolarHBondContact O-SG 3.22Å; A125-V181 HydrophobicContact CB-CG1 4.14Å; A125-V181 HydrophobicContact CB-CG2 3.91Å
126	T	94.9	Very high	93.9	Very high	25 Å²	25	21.5 Å²	21.5	15%	0.153	13%	0.134	C	C	.	.	H	α-helix	trans	-59.1	-43.7	176.6	-61.2	0	0	0	0	111.6	F91 Y95 A122 L128 C129 F130	F91-T126 HydrophobicContact CD2-CG2 3.85Å; F91-T126 HydrophobicContact CE2-CG2 4.05Å; F91-T126 HydrophobicContact CG-CG2 4.12Å; F91-T126 HydrophobicContact CZ-CG2 4.47Å; Y95-T126 PolarHBondContact OH-OG1 3.47Å; A122-T126 WeakPolarHBondContact O-CB 3.41Å; A122-T126 PolarHBondContact O-N 3.19Å; A122-T126 PolarHBondContact O-OG1 3.1Å; A122-T126 VanDerWaalsContact O-OG1 3.04Å; T126-L128 VanDerWaalsContact C-N 3.35Å; T126-L128 PolarHBondContact O-N 3.27Å; T126-C129 WeakPolarHBondContact O-CB 3.28Å; T126-C129 PolarHBondContact O-N 2.66Å; T126-F130 VanDerWaalsContact O-CD2 3.24Å; T126-F130 WeakPolarHBondContact O-CD2 3.46Å
127	S	92.7	Very high	94.3	Very high	10 Å²	10	20.9 Å²	20.9	7%	0.07	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-46.5	175	-59.9	0	0	0	0	111.5	A123 G124 A125 C129 F130 V131	A123-S127 WeakPolarHBondContact O-CB 3.34Å; A123-S127 PolarHBondContact O-N 2.65Å; A123-S127 PolarHBondContact O-OG 3.29Å; G124-S127 PolarHBondContact O-N 2.75Å; A125-S127 VanDerWaalsContact C-N 3.33Å; A125-S127 PolarHBondContact O-N 3.37Å; S127-C129 VanDerWaalsContact C-N 3.28Å; S127-C129 PolarHBondContact O-N 3.29Å; S127-F130 PolarHBondContact O-N 3.37Å; S127-F130 VanDerWaalsContact O-N 3.13Å; S127-V131 WeakPolarHBondContact O-CG2 3.28Å; S127-V131 PolarHBondContact O-N 2.84Å
128	L	94	Very high	94.5	Very high	11 Å²	11	20.3 Å²	20.3	6%	0.058	13%	0.126	C	C	.	.	H	α-helix	trans	-64	-30	178.9	-70.9	-179	0	0	0	112.5	G124 A125 T126 F130 V131 Y132 F177 S180 I184	G124-L128 WeakPolarHBondContact O-CB 3.24Å; G124-L128 VanDerWaalsContact O-CG 3.31Å; G124-L128 WeakPolarHBondContact O-CG 3.48Å; G124-L128 PolarHBondContact O-N 3.29Å; A125-L128 CarbonylContact O-C 3.56Å; A125-L128 PolarHBondContact O-N 3.39Å; A125-L128 VanDerWaalsContact O-N 3.12Å; T126-L128 VanDerWaalsContact C-N 3.35Å; T126-L128 PolarHBondContact O-N 3.27Å; L128-F130 PolarHBondContact O-N 3.45Å; L128-V131 HydrophobicContact CD2-CG2 4.32Å; L128-V131 PolarHBondContact O-N 2.98Å; L128-Y132 HydrophobicContact CB-CD2 4.28Å; L128-Y132 HydrophobicContact CD1-CD2 4.3Å; L128-Y132 HydrophobicContact CD2-CD2 4.06Å; L128-Y132 HydrophobicContact CG-CD2 4.45Å; L128-Y132 WeakPolarHBondContact O-CB 3.43Å; L128-Y132 PolarHBondContact O-N 3Å; L128-F177 HydrophobicContact CB-CD2 4.22Å; L128-F177 HydrophobicContact CB-CE2 3.53Å; L128-F177 HydrophobicContact CB-CZ 4.31Å; L128-S180 WeakPolarHBondContact CD1-OG 3.47Å; L128-I184 HydrophobicContact CD1-CD1 3.62Å; L128-I184 HydrophobicContact CG-CD1 4.4Å
129	C	95.4	Very high	94.7	Very high	64 Å²	64	18.5 Å²	18.5	43%	0.432	11%	0.111	S	C	.	.	H	α-helix	trans	-56	-20.3	174.1	-68.9	0	0	0	0	113.4	A125 T126 S127 Y174	A125-C129 PolarHBondContact O-N 3.39Å; A125-C129 PolarHBondContact O-SG 3.22Å; T126-C129 WeakPolarHBondContact O-CB 3.28Å; T126-C129 PolarHBondContact O-N 2.66Å; S127-C129 VanDerWaalsContact C-N 3.28Å; S127-C129 PolarHBondContact O-N 3.29Å; C129-Y174 PolarHBondContact O-OH 3.46Å
130	F	95.2	Very high	95	Very high	131 Å²	131	18.4 Å²	18.4	58%	0.575	11%	0.11	S	C	*	.	H	α-helix	trans	-110.6	-42.2	176.9	-60.4	-86.6	0	0	0	112.6	L87 T126 S127 L128	L87-F130 HydrophobicContact CD1-CB 3.77Å; L87-F130 HydrophobicContact CD1-CD2 3.67Å; L87-F130 HydrophobicContact CD1-CG 3.96Å; L87-F130 HydrophobicContact CD2-CD2 3.82Å; L87-F130 HydrophobicContact CD2-CE2 3.97Å; L87-F130 HydrophobicContact CD2-CG 4.44Å; L87-F130 HydrophobicContact CG-CD2 4.43Å; T126-F130 VanDerWaalsContact O-CD2 3.24Å; T126-F130 WeakPolarHBondContact O-CD2 3.46Å; S127-F130 PolarHBondContact O-N 3.37Å; S127-F130 VanDerWaalsContact O-N 3.13Å; L128-F130 PolarHBondContact O-N 3.45Å
131	V	95.8	Very high	95.4	Very high	3 Å²	3	18.7 Å²	18.7	2%	0.018	11%	0.112	C	C	.	.	H	α-helix	trans	-96.9	-5.4	-169.8	-49.1	0	0	0	0	114.1	R80 P83 L87 S127 L128 P133 L134 D135	R80-V131 HydrophobicContact CG-CB 4.21Å; R80-V131 HydrophobicContact CG-CG2 4.23Å; P83-V131 HydrophobicContact CB-CG1 3.9Å; P83-V131 HydrophobicContact CG-CG1 3.82Å; L87-V131 HydrophobicContact CD1-CG1 4.28Å; S127-V131 WeakPolarHBondContact O-CG2 3.28Å; S127-V131 PolarHBondContact O-N 2.84Å; L128-V131 HydrophobicContact CD2-CG2 4.32Å; L128-V131 PolarHBondContact O-N 2.98Å; V131-P133 VanDerWaalsContact C-CD 3.47Å; V131-L134 WeakPolarHBondContact O-CB 3.44Å; V131-L134 PolarHBondContact O-N 3.01Å; V131-D135 PolarHBondContact O-N 3.46Å
132	Y	97.3	Very high	95.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.2	-36.3	-179.5	-165.9	-80.4	0	0	0	114	L128 L134 D135 F136 L173 Y174 L175 G176 F177 S180 M239	L128-Y132 HydrophobicContact CB-CD2 4.28Å; L128-Y132 HydrophobicContact CD1-CD2 4.3Å; L128-Y132 HydrophobicContact CD2-CD2 4.06Å; L128-Y132 HydrophobicContact CG-CD2 4.45Å; L128-Y132 WeakPolarHBondContact O-CB 3.43Å; L128-Y132 PolarHBondContact O-N 3Å; Y132-L134 PolarHBondContact O-N 3.34Å; Y132-D135 WeakPolarHBondContact O-CB 3.22Å; Y132-D135 PolarHBondContact O-N 3.02Å; Y132-F136 WeakPolarHBondContact O-CB 3.38Å; Y132-F136 PolarHBondContact O-N 3.27Å; Y132-L173 VanDerWaalsContact CD1-O 3.22Å; Y132-L173 WeakPolarHBondContact CD1-O 3.16Å; Y132-L173 WeakPolarHBondContact CE1-O 3.42Å; Y132-Y174 HydrophobicContact CD1-CD1 4.08Å; Y132-Y174 HydrophobicContact CD1-CG 4.35Å; Y132-Y174 HydrophobicContact CG-CD1 4.14Å; Y132-Y174 HydrophobicContact CG-CE1 4.45Å; Y132-L175 PolarHBondContact OH-O 3.21Å; Y132-G176 VanDerWaalsContact OH-CA 3.28Å; Y132-G176 WeakPolarHBondContact OH-CA 3.3Å; Y132-G176 PolarHBondContact OH-O 2.95Å; Y132-F177 AromaticContact CD2-CD2 3.8Å; Y132-F177 HydrophobicContact CD2-CD2 3.8Å; Y132-F177 HydrophobicContact CE2-CB 4.29Å; Y132-F177 HydrophobicContact CE2-CD2 4.25Å; Y132-F177 HydrophobicContact CG-CD2 4.16Å; Y132-F177 PolarHBondContact OH-N 3.06Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.36Å; Y132-M239 HydrophobicContact CD1-CE 4.5Å; Y132-M239 HydrophobicContact CE1-CE 3.67Å; Y132-M239 HydrophobicContact CE2-CE 3.96Å; Y132-M239 WeakPolarHBondContact OH-CE 3.16Å
133	P	97.8	Very high	95.7	Very high	18 Å²	18	17.5 Å²	17.5	12%	0.117	10%	0.101	C	C	.	.	H	α-helix	trans	-58.2	-30.3	173.6	-28.1	37.7	0	0	0	113.8	V131 A137 L173 Y174	V131-P133 VanDerWaalsContact C-CD 3.47Å; P133-A137 WeakPolarHBondContact O-CB 3.48Å; P133-A137 PolarHBondContact O-N 3.13Å; P133-L173 HydrophobicContact CB-CB 4.43Å; P133-L173 HydrophobicContact CB-CD1 4.47Å; P133-L173 HydrophobicContact CG-CB 4.37Å; P133-Y174 WeakPolarHBondContact CD-OH 3.24Å; P133-Y174 HydrophobicContact CG-CD2 4.46Å; P133-Y174 HydrophobicContact CG-CE2 3.61Å; P133-Y174 WeakPolarHBondContact CG-OH 3.25Å
134	L	97.4	Very high	95.9	Very high	27 Å²	27	17.2 Å²	17.2	14%	0.141	10%	0.098	C	C	.	.	H	α-helix	trans	-70.4	-43.7	174	-60.4	175.5	0	0	0	111.1	A76 I79 R80 P83 V131 Y132 F136 A137 R138 L157 I161	A76-L134 HydrophobicContact CB-CB 4.47Å; I79-L134 HydrophobicContact CG2-CD1 4.01Å; R80-L134 HydrophobicContact CB-CD1 4.06Å; R80-L134 HydrophobicContact CG-CD1 4.42Å; P83-L134 HydrophobicContact CG-CD1 4.44Å; V131-L134 WeakPolarHBondContact O-CB 3.44Å; V131-L134 PolarHBondContact O-N 3.01Å; Y132-L134 PolarHBondContact O-N 3.34Å; L134-F136 VanDerWaalsContact C-N 3.3Å; L134-F136 PolarHBondContact O-N 3.46Å; L134-A137 PolarHBondContact O-N 3.5Å; L134-R138 VanDerWaalsContact O-CB 3.26Å; L134-R138 WeakPolarHBondContact O-CB 3.41Å; L134-R138 PolarHBondContact O-N 3.29Å; L134-L157 HydrophobicContact CD2-CD1 4.23Å; L134-L157 HydrophobicContact CD2-CD2 4.09Å; L134-I161 HydrophobicContact CD2-CD1 4.43Å
135	D	95.9	Very high	96.1	Very high	7 Å²	7	17.5 Å²	17.5	4%	0.037	10%	0.096	C	C	.	.	H	α-helix	trans	-62.3	-39.3	174.9	-82.5	-18.2	0	0	0	111.8	R80 V131 Y132 T139 R235 M239	R80-D135 WeakPolarHBondContact CD-OD1 3Å; R80-D135 IonicContact NE-OD1 3.34Å; V131-D135 PolarHBondContact O-N 3.46Å; Y132-D135 WeakPolarHBondContact O-CB 3.22Å; Y132-D135 PolarHBondContact O-N 3.02Å; D135-T139 PolarHBondContact O-N 3.41Å; D135-T139 PolarHBondContact O-OG1 2.86Å; D135-R235 IonicContact OD2-CZ 2.85Å; D135-R235 IonicContact OD2-NH1 3.6Å; D135-R235 IonicContact OD2-NH2 3.47Å; D135-R235 PolarHBondContact OD2-NH2 3.34Å; D135-M239 HydrophobicContact CB-CE 4.32Å
136	F	97.7	Very high	96	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.6	-56.9	174.8	170.3	-91.6	0	0	0	110.8	Y132 L134 R138 T139 R140 I164 G172 L173 M239 S242	Y132-F136 WeakPolarHBondContact O-CB 3.38Å; Y132-F136 PolarHBondContact O-N 3.27Å; L134-F136 VanDerWaalsContact C-N 3.3Å; L134-F136 PolarHBondContact O-N 3.46Å; F136-R138 VanDerWaalsContact C-N 3.32Å; F136-R138 PolarHBondContact O-N 2.87Å; F136-T139 WeakPolarHBondContact O-CB 3.05Å; F136-T139 PolarHBondContact O-N 3.34Å; F136-R140 HydrophobicContact CD1-CG 4.43Å; F136-R140 HydrophobicContact CD2-CG 4.46Å; F136-R140 HydrophobicContact CE1-CG 3.91Å; F136-R140 HydrophobicContact CE2-CG 3.95Å; F136-R140 HydrophobicContact CZ-CG 3.65Å; F136-R140 PolarHBondContact O-N 3.18Å; F136-I164 HydrophobicContact CE1-CB 4.09Å; F136-I164 HydrophobicContact CE1-CG1 3.82Å; F136-I164 HydrophobicContact CE1-CG2 3.98Å; F136-I164 HydrophobicContact CZ-CB 4.28Å; F136-I164 HydrophobicContact CZ-CD1 4.45Å; F136-I164 HydrophobicContact CZ-CG1 3.87Å; F136-I164 HydrophobicContact CZ-CG2 3.84Å; F136-G172 WeakPolarHBondContact CE2-O 3.25Å; F136-L173 WeakPolarHBondContact CB-O 3.45Å; F136-L173 HydrophobicContact CD1-CD2 3.8Å; F136-L173 HydrophobicContact CE1-CD2 3.84Å; F136-M239 HydrophobicContact CD2-CB 3.88Å; F136-M239 HydrophobicContact CD2-CG 3.98Å; F136-M239 HydrophobicContact CE2-CB 4.16Å; F136-M239 VanDerWaalsContact CE2-O 3.29Å; F136-M239 WeakPolarHBondContact CE2-O 3.48Å; F136-S242 VanDerWaalsContact CE2-OG 3.24Å; F136-S242 WeakPolarHBondContact CE2-OG 3.35Å
137	A	97.7	Very high	95.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.4	-37.9	-175.9	0	0	0	0	0	112.2	P133 L134 T139 R140 L141 L157 C160 I161	P133-A137 WeakPolarHBondContact O-CB 3.48Å; P133-A137 PolarHBondContact O-N 3.13Å; L134-A137 PolarHBondContact O-N 3.5Å; A137-T139 VanDerWaalsContact C-N 3.31Å; A137-T139 PolarHBondContact O-N 2.72Å; A137-R140 PolarHBondContact O-N 3.33Å; A137-L141 VanDerWaalsContact O-CB 3.3Å; A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 WeakPolarHBondContact O-CD1 3.42Å; A137-L141 WeakPolarHBondContact O-CG 3.35Å; A137-L141 PolarHBondContact O-N 2.98Å; A137-L157 HydrophobicContact CB-CD1 3.32Å; A137-C160 HydrophobicContact CB-CB 4.14Å; A137-I161 HydrophobicContact CB-CD1 4.36Å; A137-I161 HydrophobicContact CB-CG1 3.88Å
138	R	97.3	Very high	95.6	Very high	15 Å²	15	22 Å²	22	6%	0.057	12%	0.116	C	C	.	.	H	α-helix	trans	-53.4	-48.7	170.4	-175.7	-148	-176.8	146.4	25.6	111.7	E30 A76 N77 L134 F136 A142	E30-R138 VanDerWaalsContact CD-CZ 3.44Å; E30-R138 IonicContact OE1-CZ 3.8Å; E30-R138 IonicContact OE1-NH1 3.94Å; E30-R138 PolarHBondContact OE1-NH1 3.37Å; E30-R138 IonicContact OE1-NH2 2.66Å; E30-R138 PolarHBondContact OE1-NH2 2.91Å; E30-R138 IonicContact OE2-CZ 3.72Å; E30-R138 IonicContact OE2-NH2 2.93Å; E30-R138 PolarHBondContact OE2-NH2 3.35Å; A76-R138 HydrophobicContact CB-CB 3.8Å; A76-R138 HydrophobicContact CB-CG 4.41Å; N77-R138 PolarHBondContact ND2-NE 2.93Å; N77-R138 PolarHBondContact ND2-NH2 2.64Å; N77-R138 WeakPolarHBondContact OD1-CD 3.44Å; N77-R138 WeakPolarHBondContact OD1-CG 3.21Å; N77-R138 PolarHBondContact OD1-NE 3.14Å; N77-R138 PolarHBondContact OD1-NH1 3.3Å; N77-R138 PolarHBondContact OD1-NH2 3.05Å; L134-R138 VanDerWaalsContact O-CB 3.26Å; L134-R138 WeakPolarHBondContact O-CB 3.41Å; L134-R138 PolarHBondContact O-N 3.29Å; F136-R138 VanDerWaalsContact C-N 3.32Å; F136-R138 PolarHBondContact O-N 2.87Å; R138-A142 VanDerWaalsContact O-CB 3.29Å; R138-A142 WeakPolarHBondContact O-CB 3.47Å; R138-A142 PolarHBondContact O-N 3.48Å
139	T	97.1	Very high	95.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.7	-46.6	-177.9	-54.3	0	0	0	0	110.9	L34 D135 F136 A137 A142 A143 R236 M239	L34-T139 HydrophobicContact CD2-CG2 4.49Å; D135-T139 PolarHBondContact O-N 3.41Å; D135-T139 PolarHBondContact O-OG1 2.86Å; F136-T139 WeakPolarHBondContact O-CB 3.05Å; F136-T139 PolarHBondContact O-N 3.34Å; A137-T139 VanDerWaalsContact C-N 3.31Å; A137-T139 PolarHBondContact O-N 2.72Å; T139-A142 PolarHBondContact O-N 2.88Å; T139-A143 WeakPolarHBondContact O-CB 3.48Å; T139-A143 PolarHBondContact O-N 3.25Å; T139-R236 HydrophobicContact CG2-CB 4.22Å; T139-R236 HydrophobicContact CG2-CG 4.39Å; T139-R236 PolarHBondContact OG1-NH1 3.18Å; T139-M239 HydrophobicContact CG2-SD 4.05Å; T139-M239 PolarHBondContact OG1-SD 2.86Å; T139-M239 VanDerWaalsContact OG1-SD 3.39Å
140	R	97.6	Very high	95	Very high	3 Å²	3	28.8 Å²	28.8	1%	0.011	17%	0.169	C	C	.	.	H	α-helix	trans	-64.7	-43	179.9	-68.4	-61	-71.2	-90.7	-1.1	112.7	F136 A137 A143 D144 E153 F154 M239 S242	F136-R140 HydrophobicContact CD1-CG 4.43Å; F136-R140 HydrophobicContact CD2-CG 4.46Å; F136-R140 HydrophobicContact CE1-CG 3.91Å; F136-R140 HydrophobicContact CE2-CG 3.95Å; F136-R140 HydrophobicContact CZ-CG 3.65Å; F136-R140 PolarHBondContact O-N 3.18Å; A137-R140 PolarHBondContact O-N 3.33Å; R140-A143 PolarHBondContact O-N 3.26Å; R140-D144 PolarHBondContact O-N 2.91Å; R140-D144 VanDerWaalsContact O-N 3.1Å; R140-E153 IonicContact CZ-OE1 3.29Å; R140-E153 IonicContact NE-OE2 3.88Å; R140-E153 IonicContact NH2-OE1 2.92Å; R140-E153 PolarHBondContact NH2-OE1 3.31Å; R140-E153 IonicContact NH2-OE2 3.3Å; R140-F154 HydrophobicContact CB-CD2 4.23Å; R140-F154 HydrophobicContact CB-CE2 3.81Å; R140-F154 HydrophobicContact CG-CE2 4.46Å; R140-M239 PolarHBondContact NH1-O 3.45Å; R140-S242 VanDerWaalsContact CZ-O 3.32Å; R140-S242 PolarHBondContact NH1-O 3.11Å; R140-S242 PolarHBondContact NH2-O 3.1Å
141	L	97.5	Very high	94.8	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-65.4	-39.2	175.1	-71.7	167.9	0	0	0	112.3	R72 A137 A143 D144 F154 L157 C160	R72-L141 WeakPolarHBondContact CD-O 3.41Å; R72-L141 HydrophobicContact CG-CB 4.37Å; R72-L141 VanDerWaalsContact CG-O 3.24Å; R72-L141 WeakPolarHBondContact CG-O 3.37Å; R72-L141 PolarHBondContact NE-O 2.91Å; A137-L141 VanDerWaalsContact O-CB 3.3Å; A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 WeakPolarHBondContact O-CD1 3.42Å; A137-L141 WeakPolarHBondContact O-CG 3.35Å; A137-L141 PolarHBondContact O-N 2.98Å; L141-A143 VanDerWaalsContact C-N 3.33Å; L141-D144 PolarHBondContact O-N 3.11Å; L141-F154 HydrophobicContact CD2-CB 3.74Å; L141-L157 HydrophobicContact CD1-CB 4.38Å; L141-C160 HydrophobicContact CG-CB 4.47Å
142	A	96.6	Very high	94.7	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.017	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-38.2	177.8	0	0	0	0	0	112.1	R31 L34 R138 T139 D144	R31-A142 HydrophobicContact CG-CB 4.33Å; R31-A142 PolarHBondContact NE-O 3.3Å; L34-A142 HydrophobicContact CB-CB 4.08Å; L34-A142 HydrophobicContact CD1-CB 3.51Å; L34-A142 HydrophobicContact CG-CB 4.44Å; R138-A142 VanDerWaalsContact O-CB 3.29Å; R138-A142 WeakPolarHBondContact O-CB 3.47Å; R138-A142 PolarHBondContact O-N 3.48Å; T139-A142 PolarHBondContact O-N 2.88Å; A142-D144 VanDerWaalsContact C-N 3.33Å
143	A	96.5	Very high	94.5	Very high	2 Å²	2	34.5 Å²	34.5	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-74.8	-19	178.8	0	0	0	0	0	114.1	V38 T139 R140 L141 I145 M240	V38-A143 HydrophobicContact CG2-CB 3.62Å; T139-A143 WeakPolarHBondContact O-CB 3.48Å; T139-A143 PolarHBondContact O-N 3.25Å; R140-A143 PolarHBondContact O-N 3.26Å; L141-A143 VanDerWaalsContact C-N 3.33Å; A143-I145 PolarHBondContact O-N 3.14Å; A143-M240 HydrophobicContact CB-CE 3.62Å; A143-M240 HydrophobicContact CB-SD 3.84Å
144	D	95.6	Very high	94.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.			trans	-70.6	111.3	178.7	-173.4	-11.4	0	0	0	110.6	R31 Q44 Q65 R72 R140 L141 A142 G146 E153 F154	R31-D144 PolarHBondContact NH2-O 3.07Å; Q44-D144 PolarHBondContact NE2-OD1 3.4Å; Q44-D144 PolarHBondContact OE1-OD1 3.35Å; Q65-D144 PolarHBondContact NE2-O 3.09Å; R72-D144 VanDerWaalsContact CZ-CG 3.48Å; R72-D144 IonicContact CZ-OD1 3.93Å; R72-D144 IonicContact CZ-OD2 3.34Å; R72-D144 PolarHBondContact NH1-O 3.15Å; R72-D144 IonicContact NH1-OD1 3.77Å; R72-D144 IonicContact NH1-OD2 3.9Å; R72-D144 IonicContact NH2-OD1 3.77Å; R72-D144 IonicContact NH2-OD2 2.64Å; R72-D144 PolarHBondContact NH2-OD2 3.32Å; R140-D144 PolarHBondContact O-N 2.91Å; R140-D144 VanDerWaalsContact O-N 3.1Å; L141-D144 PolarHBondContact O-N 3.11Å; A142-D144 VanDerWaalsContact C-N 3.33Å; D144-G146 PolarHBondContact OD1-N 2.8Å; D144-E153 PolarHBondContact OD1-N 2.95Å; D144-E153 PolarHBondContact OD2-N 3.4Å; D144-F154 PolarHBondContact OD2-N 3.11Å; D144-F154 VanDerWaalsContact OD2-N 3.09Å
145	I	94.1	Very high	94.3	Very high	20 Å²	20	37.1 Å²	37.1	10%	0.103	21%	0.211	C	C	.	.			trans	-96.2	5.6	179.7	61.2	146.4	0	0	0	113.6	L35 Q44 I45 Y51 Q65 A143 K147	L35-I145 HydrophobicContact CD2-CG2 3.75Å; Q44-I145 HydrophobicContact CB-CD1 3.86Å; Q44-I145 HydrophobicContact CB-CG1 3.47Å; Q44-I145 VanDerWaalsContact CB-CG1 3.47Å; Q44-I145 HydrophobicContact CG-CG1 4.37Å; I45-I145 HydrophobicContact CD1-CD1 4.38Å; I45-I145 HydrophobicContact CD1-CG1 4.46Å; I45-I145 HydrophobicContact CD1-CG2 3.95Å; I45-I145 HydrophobicContact CG1-CD1 3.44Å; I45-I145 VanDerWaalsContact CG1-CD1 3.44Å; I45-I145 HydrophobicContact CG1-CG1 3.85Å; I45-I145 HydrophobicContact CG1-CG2 4.23Å; Y51-I145 HydrophobicContact CE2-CG2 4.48Å; Q65-I145 PolarHBondContact NE2-O 3.32Å; Q65-I145 VanDerWaalsContact NE2-O 3.14Å; A143-I145 PolarHBondContact O-N 3.14Å; I145-K147 PolarHBondContact O-N 2.99Å
146	G	92.4	Very high	94.3	Very high	3 Å²	3	37.9 Å²	37.9	3%	0.031	22%	0.22	C	C	.	.			trans	-58.4	132.3	-179.8	0	0	0	0	0	112.3	Q65 R72 D144	Q65-G146 PolarHBondContact NE2-O 3.46Å; R72-G146 PolarHBondContact NH1-O 2.98Å; D144-G146 PolarHBondContact OD1-N 2.8Å
147	K	90.4	Very high	94.2	Very high	124 Å²	124	38.9 Å²	38.9	54%	0.539	23%	0.225	S	C	.	.	S	Bend	trans	-79.4	-44.3	-170.5	-54.6	-176.8	179.4	172.8	0	112.2	E64 I145 E151	E64-K147 WeakPolarHBondContact O-CD 3.44Å; E64-K147 WeakPolarHBondContact O-CG 3.33Å; I145-K147 PolarHBondContact O-N 2.99Å; K147-E151 WeakPolarHBondContact CB-OE2 3.34Å; K147-E151 VanDerWaalsContact CG-OE2 3.28Å; K147-E151 WeakPolarHBondContact CG-OE2 3.49Å; K147-E151 PolarHBondContact N-OE2 2.92Å; K147-E151 VanDerWaalsContact N-OE2 3.15Å
148	G	87.8	Confident	94.2	Very high	24 Å²	24	41.7 Å²	41.7	25%	0.247	25%	0.254	C	S	.	.	S	Bend	trans	-123.2	173	178.6	0	0	0	0	0	113.6	A150 E151 R152	G148-A150 PolarHBondContact O-N 3.42Å; G148-A150 VanDerWaalsContact O-N 3.09Å; G148-E151 PolarHBondContact O-N 2.81Å; G148-R152 VanDerWaalsContact O-CG 3.25Å; G148-R152 WeakPolarHBondContact O-CG 3.15Å; G148-R152 PolarHBondContact O-N 2.94Å; G148-R152 VanDerWaalsContact O-N 3.14Å
149	P	87.3	Confident	94.2	Very high	113 Å²	113	44 Å²	44	73%	0.734	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-33.4	-178.2	-27.8	35.5	0	0	0	115
150	A	89.6	Confident	94.2	Very high	105 Å²	105	44 Å²	44	87%	0.868	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-30.2	178.7	0	0	0	0	0	113.9	G148	G148-A150 PolarHBondContact O-N 3.42Å; G148-A150 VanDerWaalsContact O-N 3.09Å
151	E	91.5	Very high	94.2	Very high	110 Å²	110	46.1 Å²	46.1	51%	0.514	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-15.2	-178.5	-66.4	174.5	-147.8	0	0	113.1	Q44 K147 G148	Q44-E151 PolarHBondContact NE2-O 3Å; K147-E151 WeakPolarHBondContact CB-OE2 3.34Å; K147-E151 VanDerWaalsContact CG-OE2 3.28Å; K147-E151 WeakPolarHBondContact CG-OE2 3.49Å; K147-E151 PolarHBondContact N-OE2 2.92Å; K147-E151 VanDerWaalsContact N-OE2 3.15Å; G148-E151 PolarHBondContact O-N 2.81Å
152	R	93.6	Very high	94.3	Very high	86 Å²	86	47.2 Å²	47.2	33%	0.325	29%	0.291	S	S	.	.			trans	-70.7	130.6	-178	-76	-179.3	173.9	-152.3	6.7	110.6	G148 F154	G148-R152 VanDerWaalsContact O-CG 3.25Å; G148-R152 WeakPolarHBondContact O-CG 3.15Å; G148-R152 PolarHBondContact O-N 2.94Å; G148-R152 VanDerWaalsContact O-N 3.14Å; R152-F154 VanDerWaalsContact C-N 3.28Å; R152-F154 PolarHBondContact O-N 3Å
153	E	93.5	Very high	94.3	Very high	58 Å²	58	51.7 Å²	51.7	27%	0.271	31%	0.311	S	S	.	.	S	Bend	trans	-65.4	-38.1	172.7	-167.6	-175.3	179.6	0	0	111	R140 D144 K163	R140-E153 IonicContact CZ-OE1 3.29Å; R140-E153 IonicContact NE-OE2 3.88Å; R140-E153 IonicContact NH2-OE1 2.92Å; R140-E153 PolarHBondContact NH2-OE1 3.31Å; R140-E153 IonicContact NH2-OE2 3.3Å; D144-E153 PolarHBondContact OD1-N 2.95Å; D144-E153 PolarHBondContact OD2-N 3.4Å; E153-K163 PolarHBondContact O-NZ 3.06Å
154	F	95.8	Very high	94.4	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	31%	0.31	C	S	.	.			trans	-138.1	135.9	179.1	-51.8	-72.8	0	0	0	112.3	R72 R140 L141 D144 R152 N159 C160 K163 I164	R72-F154 PolarHBondContact NH2-O 2.89Å; R140-F154 HydrophobicContact CB-CD2 4.23Å; R140-F154 HydrophobicContact CB-CE2 3.81Å; R140-F154 HydrophobicContact CG-CE2 4.46Å; L141-F154 HydrophobicContact CD2-CB 3.74Å; D144-F154 PolarHBondContact OD2-N 3.11Å; D144-F154 VanDerWaalsContact OD2-N 3.09Å; R152-F154 VanDerWaalsContact C-N 3.28Å; R152-F154 PolarHBondContact O-N 3Å; F154-N159 WeakPolarHBondContact CA-OD1 3.45Å; F154-C160 HydrophobicContact CB-CB 4.01Å; F154-C160 VanDerWaalsContact CD1-CA 3.43Å; F154-C160 HydrophobicContact CD1-CB 3.82Å; F154-C160 HydrophobicContact CD2-CB 4.33Å; F154-C160 HydrophobicContact CE1-CB 4.35Å; F154-C160 HydrophobicContact CG-CB 3.78Å; F154-K163 HydrophobicContact CD1-CB 4.43Å; F154-K163 HydrophobicContact CD1-CD 3.97Å; F154-K163 HydrophobicContact CE1-CB 4.22Å; F154-K163 HydrophobicContact CE1-CD 3.84Å; F154-K163 HydrophobicContact CE1-CG 4.24Å; F154-I164 HydrophobicContact CE1-CD1 4.2Å; F154-I164 HydrophobicContact CE1-CG1 4.01Å; F154-I164 HydrophobicContact CZ-CD1 3.97Å; F154-I164 HydrophobicContact CZ-CG1 4.02Å
155	T	94.9	Very high	94.5	Very high	100 Å²	100	56.7 Å²	56.7	61%	0.613	33%	0.332	S	S	*	.	S	Bend	trans	-77.6	-22.1	178.3	60	0	0	0	0	113	N159	T155-N159 PolarHBondContact N-OD1 3.21Å; T155-N159 VanDerWaalsContact N-OD1 3.09Å; T155-N159 WeakPolarHBondContact OG1-CB 3.39Å; T155-N159 VanDerWaalsContact OG1-CG 3.24Å; T155-N159 PolarHBondContact OG1-OD1 3.28Å
156	G	95.1	Very high	94.6	Very high	23 Å²	23	64.7 Å²	64.7	24%	0.237	37%	0.366	C	S	.	.	S	Bend	trans	176.4	-171.5	-179.7	0	0	0	0	0	113.5	N159 C160	G156-N159 PolarHBondContact O-N 3.4Å; G156-C160 WeakPolarHBondContact O-CB 3.39Å; G156-C160 PolarHBondContact O-N 3.34Å
157	L	96.4	Very high	94.7	Very high	21 Å²	21	67.6 Å²	67.6	11%	0.11	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-54.4	-176.3	176.5	57.8	0	0	0	112.7	L75 A76 I79 L134 A137 L141 N159 C160 I161	L75-L157 HydrophobicContact CD2-CB 4.3Å; L75-L157 HydrophobicContact CD2-CD2 4.22Å; L75-L157 HydrophobicContact CG-CD2 4.22Å; A76-L157 HydrophobicContact CB-CD1 4.09Å; A76-L157 HydrophobicContact CB-CD2 4.3Å; I79-L157 HydrophobicContact CD1-CD2 3.88Å; L134-L157 HydrophobicContact CD2-CD1 4.23Å; L134-L157 HydrophobicContact CD2-CD2 4.09Å; A137-L157 HydrophobicContact CB-CD1 3.32Å; L141-L157 HydrophobicContact CD1-CB 4.38Å; L157-N159 VanDerWaalsContact C-N 3.34Å; L157-N159 PolarHBondContact O-N 3.32Å; L157-C160 PolarHBondContact O-N 3.38Å; L157-I161 HydrophobicContact CD1-CD1 3.81Å; L157-I161 HydrophobicContact CD1-CG1 4.32Å; L157-I161 HydrophobicContact CG-CD1 4.3Å; L157-I161 PolarHBondContact O-N 3.28Å
158	G	97.4	Very high	94.9	Very high	58 Å²	58	64 Å²	64	60%	0.598	37%	0.37	S	S	*	.	H	α-helix	trans	-62.8	-40.5	-179.8	0	0	0	0	0	112.5	G162	G158-G162 PolarHBondContact O-N 3.25Å
159	N	97.6	Very high	95.3	Very high	65 Å²	65	64.1 Å²	64.1	35%	0.348	37%	0.371	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.2	177.3	-103.6	0	0	0	112.1	F154 T155 G156 L157 K163	F154-N159 WeakPolarHBondContact CA-OD1 3.45Å; T155-N159 PolarHBondContact N-OD1 3.21Å; T155-N159 VanDerWaalsContact N-OD1 3.09Å; T155-N159 WeakPolarHBondContact OG1-CB 3.39Å; T155-N159 VanDerWaalsContact OG1-CG 3.24Å; T155-N159 PolarHBondContact OG1-OD1 3.28Å; G156-N159 PolarHBondContact O-N 3.4Å; L157-N159 VanDerWaalsContact C-N 3.34Å; L157-N159 PolarHBondContact O-N 3.32Å; N159-K163 WeakPolarHBondContact O-CB 3.31Å; N159-K163 PolarHBondContact O-N 3.11Å
160	C	97.8	Very high	95.7	Very high	0 Å²	0	64 Å²	64	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.4	-50.4	177.2	-175.8	0	0	0	0	112.2	A137 L141 F154 G156 L157 I164	A137-C160 HydrophobicContact CB-CB 4.14Å; L141-C160 HydrophobicContact CG-CB 4.47Å; F154-C160 HydrophobicContact CB-CB 4.01Å; F154-C160 VanDerWaalsContact CD1-CA 3.43Å; F154-C160 HydrophobicContact CD1-CB 3.82Å; F154-C160 HydrophobicContact CD2-CB 4.33Å; F154-C160 HydrophobicContact CE1-CB 4.35Å; F154-C160 HydrophobicContact CG-CB 3.78Å; G156-C160 WeakPolarHBondContact O-CB 3.39Å; G156-C160 PolarHBondContact O-N 3.34Å; L157-C160 PolarHBondContact O-N 3.38Å; C160-I164 WeakPolarHBondContact O-CB 3.49Å; C160-I164 WeakPolarHBondContact O-CG1 3.33Å; C160-I164 PolarHBondContact O-N 3.31Å; C160-I164 VanDerWaalsContact O-N 3.12Å
161	I	97.9	Very high	95.9	Very high	46 Å²	46	67 Å²	67	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-50.2	178.5	-65.5	174	0	0	0	110.2	L134 A137 L157 F165 L173	L134-I161 HydrophobicContact CD2-CD1 4.43Å; A137-I161 HydrophobicContact CB-CD1 4.36Å; A137-I161 HydrophobicContact CB-CG1 3.88Å; L157-I161 HydrophobicContact CD1-CD1 3.81Å; L157-I161 HydrophobicContact CD1-CG1 4.32Å; L157-I161 HydrophobicContact CG-CD1 4.3Å; L157-I161 PolarHBondContact O-N 3.28Å; I161-F165 WeakPolarHBondContact O-CB 3.47Å; I161-F165 PolarHBondContact O-N 3.33Å; I161-L173 HydrophobicContact CG2-CD1 3.97Å; I161-L173 HydrophobicContact CG2-CD2 4.31Å
162	G	97.9	Very high	96.1	Very high	30 Å²	30	61.9 Å²	61.9	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-64.1	-42.5	-177.8	0	0	0	0	0	113.4	G158 K166	G158-G162 PolarHBondContact O-N 3.25Å; G162-K166 WeakPolarHBondContact O-CB 3.24Å; G162-K166 VanDerWaalsContact O-CG 3.3Å; G162-K166 WeakPolarHBondContact O-CG 3.48Å; G162-K166 PolarHBondContact O-N 3.26Å
163	K	97.4	Very high	96.3	Very high	96 Å²	96	58 Å²	58	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-64.1	-47.5	179	-177.2	171.1	172.6	-177	0	111.1	E153 F154 N159 K166 T167	E153-K163 PolarHBondContact O-NZ 3.06Å; F154-K163 HydrophobicContact CD1-CB 4.43Å; F154-K163 HydrophobicContact CD1-CD 3.97Å; F154-K163 HydrophobicContact CE1-CB 4.22Å; F154-K163 HydrophobicContact CE1-CD 3.84Å; F154-K163 HydrophobicContact CE1-CG 4.24Å; N159-K163 WeakPolarHBondContact O-CB 3.31Å; N159-K163 PolarHBondContact O-N 3.11Å; K163-K166 PolarHBondContact O-N 3.17Å; K163-T167 WeakPolarHBondContact O-CG2 3.33Å; K163-T167 PolarHBondContact O-N 2.92Å
164	I	97.6	Very high	96.5	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-69.8	-37.8	179.5	-65.2	-62.7	0	0	0	111.9	F136 F154 C160 K166 T167 D168 L173	F136-I164 HydrophobicContact CE1-CB 4.09Å; F136-I164 HydrophobicContact CE1-CG1 3.82Å; F136-I164 HydrophobicContact CE1-CG2 3.98Å; F136-I164 HydrophobicContact CZ-CB 4.28Å; F136-I164 HydrophobicContact CZ-CD1 4.45Å; F136-I164 HydrophobicContact CZ-CG1 3.87Å; F136-I164 HydrophobicContact CZ-CG2 3.84Å; F154-I164 HydrophobicContact CE1-CD1 4.2Å; F154-I164 HydrophobicContact CE1-CG1 4.01Å; F154-I164 HydrophobicContact CZ-CD1 3.97Å; F154-I164 HydrophobicContact CZ-CG1 4.02Å; C160-I164 WeakPolarHBondContact O-CB 3.49Å; C160-I164 WeakPolarHBondContact O-CG1 3.33Å; C160-I164 PolarHBondContact O-N 3.31Å; C160-I164 VanDerWaalsContact O-N 3.12Å; I164-K166 VanDerWaalsContact C-N 3.29Å; I164-K166 PolarHBondContact O-N 3.28Å; I164-T167 PolarHBondContact O-N 2.9Å; I164-T167 PolarHBondContact O-OG1 3.5Å; I164-D168 PolarHBondContact O-N 3.15Å; I164-L173 HydrophobicContact CB-CD2 3.95Å; I164-L173 HydrophobicContact CG2-CD2 3.76Å; I164-L173 HydrophobicContact CG2-CG 4.29Å
165	F	97.7	Very high	96.5	Very high	105 Å²	105	60 Å²	60	46%	0.461	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-40.6	174.4	-175.5	-96.1	0	0	0	111.8	I161 T167 G169 L170 L173	I161-F165 WeakPolarHBondContact O-CB 3.47Å; I161-F165 PolarHBondContact O-N 3.33Å; F165-T167 VanDerWaalsContact C-N 3.35Å; F165-T167 PolarHBondContact O-N 3.18Å; F165-G169 WeakPolarHBondContact O-CA 3.47Å; F165-G169 PolarHBondContact O-N 2.73Å; F165-L170 HydrophobicContact CD2-CD2 4.05Å; F165-L170 HydrophobicContact CD2-CG 4.4Å; F165-L170 HydrophobicContact CE2-CD2 3.64Å; F165-L170 HydrophobicContact CE2-CG 3.76Å; F165-L173 HydrophobicContact CB-CD1 4.22Å; F165-L173 HydrophobicContact CD2-CD1 4.06Å
166	K	97.1	Very high	96.5	Very high	187 Å²	187	55.5 Å²	55.5	81%	0.813	30%	0.301	S	S	*	.	H	α-helix	trans	-66.2	-32.8	176.3	-74.9	178.3	-179.6	-171.9	0	113.3	G162 K163 I164	G162-K166 WeakPolarHBondContact O-CB 3.24Å; G162-K166 VanDerWaalsContact O-CG 3.3Å; G162-K166 WeakPolarHBondContact O-CG 3.48Å; G162-K166 PolarHBondContact O-N 3.26Å; K163-K166 PolarHBondContact O-N 3.17Å; I164-K166 VanDerWaalsContact C-N 3.29Å; I164-K166 PolarHBondContact O-N 3.28Å
167	T	94.9	Very high	96.6	Very high	64 Å²	64	56.3 Å²	56.3	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-87.3	-40	-177.8	61.7	0	0	0	0	113.7	K163 I164 F165	K163-T167 WeakPolarHBondContact O-CG2 3.33Å; K163-T167 PolarHBondContact O-N 2.92Å; I164-T167 PolarHBondContact O-N 2.9Å; I164-T167 PolarHBondContact O-OG1 3.5Å; F165-T167 VanDerWaalsContact C-N 3.35Å; F165-T167 PolarHBondContact O-N 3.18Å
168	D	94.1	Very high	96.6	Very high	49 Å²	49	60.7 Å²	60.7	26%	0.262	32%	0.322	S	S	.	.	H	α-helix	trans	-127.2	-1	-166.6	-65.5	28.2	0	0	0	112.8	I164 G172 S242 G243	I164-D168 PolarHBondContact O-N 3.15Å; D168-G172 PolarHBondContact O-N 2.74Å; D168-S242 WeakPolarHBondContact OD2-CA 3.19Å; D168-G243 WeakPolarHBondContact OD1-CA 3.44Å; D168-G243 PolarHBondContact OD1-N 3.47Å; D168-G243 PolarHBondContact OD2-N 2.93Å
169	G	96	Very high	96.6	Very high	26 Å²	26	57.9 Å²	57.9	27%	0.268	29%	0.293	S	S	.	.	H	α-helix	trans	64.5	-157.7	-175.1	0	0	0	0	0	113.4	F165 K171 G172	F165-G169 WeakPolarHBondContact O-CA 3.47Å; F165-G169 PolarHBondContact O-N 2.73Å; G169-K171 VanDerWaalsContact C-N 3.25Å; G169-K171 PolarHBondContact O-N 3.38Å; G169-G172 PolarHBondContact O-N 2.74Å
170	L	95.4	Very high	96.5	Very high	111 Å²	111	55 Å²	55	58%	0.581	28%	0.278	S	S	*	.	H	α-helix	trans	-60.7	-36.3	175.3	-71.3	175.6	0	0	0	111.9	F165 G172 L173 Y174	F165-L170 HydrophobicContact CD2-CD2 4.05Å; F165-L170 HydrophobicContact CD2-CG 4.4Å; F165-L170 HydrophobicContact CE2-CD2 3.64Å; F165-L170 HydrophobicContact CE2-CG 3.76Å; L170-G172 PolarHBondContact O-N 3.18Å; L170-L173 PolarHBondContact O-N 3.3Å; L170-Y174 WeakPolarHBondContact O-CD2 3.42Å; L170-Y174 PolarHBondContact O-N 3.02Å
171	K	94.8	Very high	96.4	Very high	169 Å²	169	56.4 Å²	56.4	74%	0.735	29%	0.286	S	S	*	.	H	α-helix	trans	-56.4	-40.3	-178.4	-172.8	178.8	177.9	-178.6	0	111.8	G169 L173 Y174 L175	G169-K171 VanDerWaalsContact C-N 3.25Å; G169-K171 PolarHBondContact O-N 3.38Å; K171-L173 PolarHBondContact O-N 2.61Å; K171-Y174 PolarHBondContact O-N 3Å; K171-L175 PolarHBondContact O-N 3.39Å
172	G	95	Very high	96.3	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-62.4	-38.6	176.5	0	0	0	0	0	113.6	F136 D168 G169 L170 Y174 S242	F136-G172 WeakPolarHBondContact CE2-O 3.25Å; D168-G172 PolarHBondContact O-N 2.74Å; G169-G172 PolarHBondContact O-N 2.74Å; L170-G172 PolarHBondContact O-N 3.18Å; G172-Y174 VanDerWaalsContact C-N 3.27Å; G172-Y174 PolarHBondContact O-N 2.85Å; G172-S242 WeakPolarHBondContact O-CB 3.24Å; G172-S242 PolarHBondContact O-OG 3.35Å
173	L	97.4	Very high	96.3	Very high	6 Å²	6	57.8 Å²	57.8	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-72.1	-20.7	179.7	-62.6	176.3	0	0	0	113.2	Y132 P133 F136 I161 I164 F165 L170 K171	Y132-L173 VanDerWaalsContact CD1-O 3.22Å; Y132-L173 WeakPolarHBondContact CD1-O 3.16Å; Y132-L173 WeakPolarHBondContact CE1-O 3.42Å; P133-L173 HydrophobicContact CB-CB 4.43Å; P133-L173 HydrophobicContact CB-CD1 4.47Å; P133-L173 HydrophobicContact CG-CB 4.37Å; F136-L173 WeakPolarHBondContact CB-O 3.45Å; F136-L173 HydrophobicContact CD1-CD2 3.8Å; F136-L173 HydrophobicContact CE1-CD2 3.84Å; I161-L173 HydrophobicContact CG2-CD1 3.97Å; I161-L173 HydrophobicContact CG2-CD2 4.31Å; I164-L173 HydrophobicContact CB-CD2 3.95Å; I164-L173 HydrophobicContact CG2-CD2 3.76Å; I164-L173 HydrophobicContact CG2-CG 4.29Å; F165-L173 HydrophobicContact CB-CD1 4.22Å; F165-L173 HydrophobicContact CD2-CD1 4.06Å; L170-L173 PolarHBondContact O-N 3.3Å; K171-L173 PolarHBondContact O-N 2.61Å
174	Y	97.8	Very high	96.1	Very high	59 Å²	59	55.2 Å²	55.2	23%	0.231	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	10.5	-175.7	-74.2	-97.6	0	0	0	114.1	C129 Y132 P133 L170 K171 G172 G176 F177	C129-Y174 PolarHBondContact O-OH 3.46Å; Y132-Y174 HydrophobicContact CD1-CD1 4.08Å; Y132-Y174 HydrophobicContact CD1-CG 4.35Å; Y132-Y174 HydrophobicContact CG-CD1 4.14Å; Y132-Y174 HydrophobicContact CG-CE1 4.45Å; P133-Y174 WeakPolarHBondContact CD-OH 3.24Å; P133-Y174 HydrophobicContact CG-CD2 4.46Å; P133-Y174 HydrophobicContact CG-CE2 3.61Å; P133-Y174 WeakPolarHBondContact CG-OH 3.25Å; L170-Y174 WeakPolarHBondContact O-CD2 3.42Å; L170-Y174 PolarHBondContact O-N 3.02Å; K171-Y174 PolarHBondContact O-N 3Å; G172-Y174 VanDerWaalsContact C-N 3.27Å; G172-Y174 PolarHBondContact O-N 2.85Å; Y174-G176 PolarHBondContact O-N 3.05Å; Y174-F177 AromaticContact CD1-CD2 3.91Å; Y174-F177 HydrophobicContact CD1-CD2 3.91Å; Y174-F177 HydrophobicContact CD1-CE2 4.44Å; Y174-F177 VanDerWaalsContact O-CB 3.25Å; Y174-F177 WeakPolarHBondContact O-CB 3.29Å; Y174-F177 PolarHBondContact O-N 3.38Å
175	L	96.1	Very high	96	Very high	41 Å²	41	58.1 Å²	58.1	22%	0.215	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	128.6	175.4	-81.5	-175.5	0	0	0	111.4	Y132 K171 M238 M239 Q241 S242	Y132-L175 PolarHBondContact OH-O 3.21Å; K171-L175 PolarHBondContact O-N 3.39Å; L175-M238 HydrophobicContact CD2-CE 4.22Å; L175-M239 WeakPolarHBondContact O-CG 3.34Å; L175-Q241 HydrophobicContact CD1-CB 4.2Å; L175-S242 WeakPolarHBondContact CD1-OG 3.32Å
176	G	95.9	Very high	95.9	Very high	5 Å²	5	55.9 Å²	55.9	5%	0.052	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	2.5	-174.5	0	0	0	0	0	115.1	Y132 Y174 N178 V179 S180	Y132-G176 VanDerWaalsContact OH-CA 3.28Å; Y132-G176 WeakPolarHBondContact OH-CA 3.3Å; Y132-G176 PolarHBondContact OH-O 2.95Å; Y174-G176 PolarHBondContact O-N 3.05Å; G176-N178 PolarHBondContact O-N 3.49Å; G176-V179 WeakPolarHBondContact O-CG1 3.48Å; G176-V179 PolarHBondContact O-N 2.88Å; G176-S180 WeakPolarHBondContact O-CB 3.45Å; G176-S180 PolarHBondContact O-N 2.89Å
177	F	97	Very high	95.8	Very high	40 Å²	40	50.8 Å²	50.8	18%	0.175	26%	0.26	C	S	.	.	H	α-helix	trans	-55.3	-49.9	-178.9	-176.2	-91.1	0	0	0	112.8	L128 Y132 Y174 V179 S180 V181	L128-F177 HydrophobicContact CB-CD2 4.22Å; L128-F177 HydrophobicContact CB-CE2 3.53Å; L128-F177 HydrophobicContact CB-CZ 4.31Å; Y132-F177 AromaticContact CD2-CD2 3.8Å; Y132-F177 HydrophobicContact CD2-CD2 3.8Å; Y132-F177 HydrophobicContact CE2-CB 4.29Å; Y132-F177 HydrophobicContact CE2-CD2 4.25Å; Y132-F177 HydrophobicContact CG-CD2 4.16Å; Y132-F177 PolarHBondContact OH-N 3.06Å; Y174-F177 AromaticContact CD1-CD2 3.91Å; Y174-F177 HydrophobicContact CD1-CD2 3.91Å; Y174-F177 HydrophobicContact CD1-CE2 4.44Å; Y174-F177 VanDerWaalsContact O-CB 3.25Å; Y174-F177 WeakPolarHBondContact O-CB 3.29Å; Y174-F177 PolarHBondContact O-N 3.38Å; F177-V179 PolarHBondContact O-N 2.91Å; F177-S180 WeakPolarHBondContact O-CA 3.06Å; F177-S180 WeakPolarHBondContact O-CB 3.49Å; F177-S180 PolarHBondContact O-N 3.42Å; F177-S180 PolarHBondContact O-OG 3.23Å; F177-V181 HydrophobicContact CD1-CG2 4.19Å; F177-V181 HydrophobicContact CE1-CG2 3.79Å; F177-V181 HydrophobicContact CZ-CG2 4.07Å; F177-V181 PolarHBondContact O-N 3.29Å
178	N	95.5	Very high	95.6	Very high	113 Å²	113	51.1 Å²	51.1	60%	0.604	26%	0.255	S	S	*	.	H	α-helix	trans	-60.1	-48.5	-176.5	-64.6	-9.6	0	0	0	112.9	G176 S180 V181 Q182	G176-N178 PolarHBondContact O-N 3.49Å; N178-S180 PolarHBondContact O-N 3.06Å; N178-V181 PolarHBondContact O-N 3.25Å; N178-Q182 WeakPolarHBondContact O-CG 3.43Å; N178-Q182 PolarHBondContact O-N 3.03Å; N178-Q182 VanDerWaalsContact O-N 3.1Å
179	V	97	Very high	95.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-27.3	177.8	65.7	0	0	0	0	111.8	G176 F177 G183 F231 V234 R235 T254 W258	G176-V179 WeakPolarHBondContact O-CG1 3.48Å; G176-V179 PolarHBondContact O-N 2.88Å; F177-V179 PolarHBondContact O-N 2.91Å; V179-G183 PolarHBondContact O-N 3.47Å; V179-F231 HydrophobicContact CG2-CB 4.12Å; V179-F231 HydrophobicContact CG2-CD1 3.83Å; V179-F231 HydrophobicContact CG2-CG 4.42Å; V179-V234 HydrophobicContact CG1-CG1 4.28Å; V179-V234 HydrophobicContact CG2-CB 4.21Å; V179-V234 HydrophobicContact CG2-CG1 4.12Å; V179-R235 HydrophobicContact CG1-CB 3.86Å; V179-T254 HydrophobicContact CB-CG2 3.76Å; V179-T254 HydrophobicContact CG1-CG2 4.32Å; V179-T254 HydrophobicContact CG2-CG2 4.12Å; V179-W258 HydrophobicContact CG2-CZ2 4.3Å
180	S	95.9	Very high	95.4	Very high	5 Å²	5	49.5 Å²	49.5	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-68.4	-39.6	174.1	81.5	0	0	0	0	112.8	L128 Y132 G176 F177 N178 G183 I184 R235	L128-S180 WeakPolarHBondContact CD1-OG 3.47Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.36Å; G176-S180 WeakPolarHBondContact O-CB 3.45Å; G176-S180 PolarHBondContact O-N 2.89Å; F177-S180 WeakPolarHBondContact O-CA 3.06Å; F177-S180 WeakPolarHBondContact O-CB 3.49Å; F177-S180 PolarHBondContact O-N 3.42Å; F177-S180 PolarHBondContact O-OG 3.23Å; N178-S180 PolarHBondContact O-N 3.06Å; S180-G183 PolarHBondContact O-N 2.88Å; S180-I184 WeakPolarHBondContact O-CG1 3.36Å; S180-I184 PolarHBondContact O-N 3.35Å; S180-R235 VanDerWaalsContact CB-CD 3.42Å
181	V	95.8	Very high	95.3	Very high	28 Å²	28	47.2 Å²	47.2	17%	0.17	23%	0.23	C	C	.	.	H	α-helix	trans	-67.4	-43.4	176.1	176.7	0	0	0	0	110.3	A125 F177 N178 G183 I184 I185	A125-V181 HydrophobicContact CB-CG1 4.14Å; A125-V181 HydrophobicContact CB-CG2 3.91Å; F177-V181 HydrophobicContact CD1-CG2 4.19Å; F177-V181 HydrophobicContact CE1-CG2 3.79Å; F177-V181 HydrophobicContact CZ-CG2 4.07Å; F177-V181 PolarHBondContact O-N 3.29Å; N178-V181 PolarHBondContact O-N 3.25Å; V181-G183 VanDerWaalsContact C-N 3.32Å; V181-G183 PolarHBondContact O-N 2.89Å; V181-I184 WeakPolarHBondContact O-CB 3.35Å; V181-I184 PolarHBondContact O-N 3.01Å; V181-I185 HydrophobicContact CG1-CD1 4.39Å; V181-I185 WeakPolarHBondContact O-CG1 3.11Å; V181-I185 PolarHBondContact O-N 3.17Å; V181-I185 VanDerWaalsContact O-N 3.15Å
182	Q	96.6	Very high	94.8	Very high	95 Å²	95	41.7 Å²	41.7	44%	0.444	21%	0.206	S	C	.	.	H	α-helix	trans	-57	-46.9	172.2	-67.4	168.9	2.8	0	0	111.1	N178 I184 I185 I186 F231	N178-Q182 WeakPolarHBondContact O-CG 3.43Å; N178-Q182 PolarHBondContact O-N 3.03Å; N178-Q182 VanDerWaalsContact O-N 3.1Å; Q182-I184 VanDerWaalsContact C-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.48Å; Q182-I185 PolarHBondContact O-N 2.97Å; Q182-I185 VanDerWaalsContact O-N 3.11Å; Q182-I186 WeakPolarHBondContact O-CG1 3.19Å; Q182-I186 PolarHBondContact O-N 3.34Å; Q182-F231 HydrophobicContact CB-CD1 3.89Å; Q182-F231 HydrophobicContact CB-CE1 3.92Å
183	G	96.4	Very high	94.3	Very high	11 Å²	11	43 Å²	43	11%	0.113	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-37.2	176.5	0	0	0	0	0	113.5	V179 S180 V181 Y187	V179-G183 PolarHBondContact O-N 3.47Å; S180-G183 PolarHBondContact O-N 2.88Å; V181-G183 VanDerWaalsContact C-N 3.32Å; V181-G183 PolarHBondContact O-N 2.89Å; G183-Y187 WeakPolarHBondContact O-CB 3.08Å; G183-Y187 PolarHBondContact O-N 3.47Å
184	I	94	Very high	93.8	Very high	42 Å²	42	44.7 Å²	44.7	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-43.5	174.7	-71.4	166.9	0	0	0	111.3	L128 S180 V181 Q182 R188	L128-I184 HydrophobicContact CD1-CD1 3.62Å; L128-I184 HydrophobicContact CG-CD1 4.4Å; S180-I184 WeakPolarHBondContact O-CG1 3.36Å; S180-I184 PolarHBondContact O-N 3.35Å; V181-I184 WeakPolarHBondContact O-CB 3.35Å; V181-I184 PolarHBondContact O-N 3.01Å; Q182-I184 VanDerWaalsContact C-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.48Å; I184-R188 WeakPolarHBondContact O-CB 3.41Å; I184-R188 PolarHBondContact O-N 3.45Å
185	I	94.7	Very high	93.2	Very high	64 Å²	64	44.3 Å²	44.3	33%	0.328	23%	0.23	S	C	.	.	H	α-helix	trans	-65	-47.5	179.6	-64.2	167.1	0	0	0	109.9	L117 V181 Q182 R188 A189	L117-I185 HydrophobicContact CB-CG2 4.5Å; V181-I185 HydrophobicContact CG1-CD1 4.39Å; V181-I185 WeakPolarHBondContact O-CG1 3.11Å; V181-I185 PolarHBondContact O-N 3.17Å; V181-I185 VanDerWaalsContact O-N 3.15Å; Q182-I185 PolarHBondContact O-N 2.97Å; Q182-I185 VanDerWaalsContact O-N 3.11Å; I185-R188 PolarHBondContact O-N 2.98Å; I185-A189 WeakPolarHBondContact O-CB 3.27Å; I185-A189 PolarHBondContact O-N 2.87Å
186	I	96.3	Very high	92.4	Very high	58 Å²	58	44.8 Å²	44.8	30%	0.297	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-44.2	177.7	-63.5	-60.2	0	0	0	111.4	Q182 R188 A189 A190 V227 F231	Q182-I186 WeakPolarHBondContact O-CG1 3.19Å; Q182-I186 PolarHBondContact O-N 3.34Å; I186-R188 VanDerWaalsContact C-N 3.33Å; I186-R188 PolarHBondContact O-N 3.33Å; I186-A189 PolarHBondContact O-N 2.94Å; I186-A190 WeakPolarHBondContact O-CB 3.48Å; I186-A190 PolarHBondContact O-N 3.17Å; I186-V227 HydrophobicContact CG2-CG1 3.9Å; I186-F231 HydrophobicContact CB-CE2 4.41Å; I186-F231 HydrophobicContact CG1-CE1 4.41Å; I186-F231 HydrophobicContact CG1-CE2 3.95Å; I186-F231 HydrophobicContact CG1-CZ 3.88Å; I186-F231 HydrophobicContact CG2-CE2 4.24Å
187	Y	95.1	Very high	91.7	Very high	79 Å²	79	48.7 Å²	48.7	31%	0.31	26%	0.256	S	S	.	.	H	α-helix	trans	-57.3	-47	175.3	175.6	-91.4	0	0	0	111.1	G183 Y191 A224	G183-Y187 WeakPolarHBondContact O-CB 3.08Å; G183-Y187 PolarHBondContact O-N 3.47Å; Y187-Y191 HydrophobicContact CE1-CD2 4.46Å; Y187-Y191 WeakPolarHBondContact O-CB 2.97Å; Y187-Y191 PolarHBondContact O-N 3.36Å; Y187-A224 HydrophobicContact CD2-CB 3.93Å; Y187-A224 HydrophobicContact CE2-CB 3.81Å
188	R	91	Very high	90.9	Very high	71 Å²	71	47.8 Å²	47.8	27%	0.268	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-42.6	178.8	-82.4	-169.8	170.8	-138.1	5	112.4	L117 I184 I185 I186 Y191 F192	L117-R188 HydrophobicContact CD2-CB 3.85Å; I184-R188 WeakPolarHBondContact O-CB 3.41Å; I184-R188 PolarHBondContact O-N 3.45Å; I185-R188 PolarHBondContact O-N 2.98Å; I186-R188 VanDerWaalsContact C-N 3.33Å; I186-R188 PolarHBondContact O-N 3.33Å; R188-Y191 PolarHBondContact O-N 3.15Å; R188-F192 HydrophobicContact CB-CD2 4.43Å; R188-F192 VanDerWaalsContact O-CD2 3.28Å; R188-F192 WeakPolarHBondContact O-CD2 3.35Å; R188-F192 PolarHBondContact O-N 3.26Å
189	A	92.1	Very high	90	Very high	25 Å²	25	47.3 Å²	47.3	21%	0.207	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-48.8	177.9	0	0	0	0	0	111.3	F113 L117 I185 I186 G193	F113-A189 HydrophobicContact CZ-CB 3.95Å; L117-A189 HydrophobicContact CD1-CB 3.99Å; L117-A189 HydrophobicContact CD2-CB 3.85Å; I185-A189 WeakPolarHBondContact O-CB 3.27Å; I185-A189 PolarHBondContact O-N 2.87Å; I186-A189 PolarHBondContact O-N 2.94Å; A189-G193 PolarHBondContact O-N 3.04Å
190	A	94.1	Very high	88.9	Confident	16 Å²	16	50.6 Å²	50.6	13%	0.132	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-43.8	175.7	0	0	0	0	0	111.8	I186 C194 A224 V227	I186-A190 WeakPolarHBondContact O-CB 3.48Å; I186-A190 PolarHBondContact O-N 3.17Å; A190-C194 WeakPolarHBondContact O-CB 3.28Å; A190-C194 PolarHBondContact O-N 2.96Å; A190-C194 PolarHBondContact O-SG 3.18Å; A190-A224 HydrophobicContact CB-CB 4Å; A190-V227 HydrophobicContact CB-CB 4.06Å; A190-V227 HydrophobicContact CB-CG1 4.02Å; A190-V227 HydrophobicContact CB-CG2 4.38Å
191	Y	91.8	Very high	87.9	Confident	64 Å²	64	57.6 Å²	57.6	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-60	-52.4	179.4	-175.4	-84.4	0	0	0	111.8	Y187 R188 F195 V220 A224	Y187-Y191 HydrophobicContact CE1-CD2 4.46Å; Y187-Y191 WeakPolarHBondContact O-CB 2.97Å; Y187-Y191 PolarHBondContact O-N 3.36Å; R188-Y191 PolarHBondContact O-N 3.15Å; Y191-F195 WeakPolarHBondContact O-CB 3.22Å; Y191-F195 PolarHBondContact O-N 2.82Å; Y191-V220 HydrophobicContact CD2-CG1 3.79Å; Y191-V220 HydrophobicContact CE2-CG1 3.92Å; Y191-V220 HydrophobicContact CG-CG1 4.18Å; Y191-V220 WeakPolarHBondContact O-CG1 3.36Å; Y191-A224 HydrophobicContact CD2-CB 4.39Å
192	F	85.6	Confident	87	Confident	53 Å²	53	58.2 Å²	58.2	23%	0.232	32%	0.319	C	S	.	.	H	α-helix	trans	-66.1	-46.2	180	-80.9	-71.8	0	0	0	111.7	F113 R188 C194 F195 D196	F113-F192 HydrophobicContact CE2-CB 4.12Å; R188-F192 HydrophobicContact CB-CD2 4.43Å; R188-F192 VanDerWaalsContact O-CD2 3.28Å; R188-F192 WeakPolarHBondContact O-CD2 3.35Å; R188-F192 PolarHBondContact O-N 3.26Å; F192-C194 PolarHBondContact O-N 3.4Å; F192-F195 PolarHBondContact O-N 2.83Å; F192-D196 WeakPolarHBondContact O-CB 3.36Å; F192-D196 VanDerWaalsContact O-CG 3.31Å; F192-D196 PolarHBondContact O-N 3.29Å
193	G	84.6	Confident	85.7	Confident	27 Å²	27	60.1 Å²	60.1	28%	0.278	34%	0.339	S	S	.	.	H	α-helix	trans	-58.6	-45.8	178.4	0	0	0	0	0	112.6	A189 T197	A189-G193 PolarHBondContact O-N 3.04Å; G193-T197 WeakPolarHBondContact O-CB 3.28Å; G193-T197 PolarHBondContact O-N 3.2Å; G193-T197 VanDerWaalsContact O-N 3.14Å; G193-T197 PolarHBondContact O-OG1 2.98Å
194	C	86.9	Confident	84.7	Confident	42 Å²	42	62.7 Å²	62.7	28%	0.284	35%	0.35	S	S	.	.	H	α-helix	trans	-68.5	-39.3	176.6	-68.6	0	0	0	0	112.5	A190 F192 A198 V220	A190-C194 WeakPolarHBondContact O-CB 3.28Å; A190-C194 PolarHBondContact O-N 2.96Å; A190-C194 PolarHBondContact O-SG 3.18Å; F192-C194 PolarHBondContact O-N 3.4Å; C194-A198 WeakPolarHBondContact O-CB 3.46Å; C194-A198 PolarHBondContact O-N 2.6Å; C194-V220 HydrophobicContact CB-CG1 4.03Å; C194-V220 HydrophobicContact CB-CG2 4.23Å
195	F	84.1	Confident	83.4	Confident	51 Å²	51	64 Å²	64	22%	0.224	36%	0.362	C	S	.	.	H	α-helix	trans	-68	-41.6	-179.7	-165.6	-111.1	0	0	0	112.5	Y191 F192 A198 K199 V220	Y191-F195 WeakPolarHBondContact O-CB 3.22Å; Y191-F195 PolarHBondContact O-N 2.82Å; F192-F195 PolarHBondContact O-N 2.83Å; F195-A198 PolarHBondContact O-N 3.41Å; F195-K199 HydrophobicContact CD1-CD 3.99Å; F195-K199 HydrophobicContact CE1-CD 3.77Å; F195-K199 HydrophobicContact CE1-CG 4.44Å; F195-K199 VanDerWaalsContact CE1-NZ 3.28Å; F195-K199 HydrophobicContact CZ-CD 4.36Å; F195-K199 VanDerWaalsContact CZ-CE 3.5Å; F195-K199 WeakPolarHBondContact O-CB 3.35Å; F195-K199 WeakPolarHBondContact O-CG 3.3Å; F195-K199 PolarHBondContact O-N 3.5Å; F195-V220 HydrophobicContact CB-CG1 4.06Å; F195-V220 HydrophobicContact CD2-CG1 4.37Å; F195-V220 HydrophobicContact CD2-CG2 4.36Å
196	D	80.6	Confident	82.2	Confident	52 Å²	52	70.2 Å²	70.2	28%	0.278	39%	0.386	S	S	.	.	H	α-helix	trans	-67.1	-41.7	178	-69.9	-16.7	0	0	0	110.7	F192 K199 G200	F192-D196 WeakPolarHBondContact O-CB 3.36Å; F192-D196 VanDerWaalsContact O-CG 3.31Å; F192-D196 PolarHBondContact O-N 3.29Å; D196-K199 PolarHBondContact O-N 2.92Å; D196-G200 PolarHBondContact O-N 3.25Å
197	T	80.9	Confident	81.3	Confident	86 Å²	86	73.8 Å²	73.8	53%	0.528	41%	0.406	S	S	.	.	H	α-helix	trans	-61.6	-48	173	-53.2	0	0	0	0	111.1	G193 K199 G200 M201	G193-T197 WeakPolarHBondContact O-CB 3.28Å; G193-T197 PolarHBondContact O-N 3.2Å; G193-T197 VanDerWaalsContact O-N 3.14Å; G193-T197 PolarHBondContact O-OG1 2.98Å; T197-K199 VanDerWaalsContact C-N 3.31Å; T197-K199 PolarHBondContact O-N 2.89Å; T197-G200 PolarHBondContact O-N 3.41Å; T197-G200 VanDerWaalsContact O-N 3.14Å; T197-M201 HydrophobicContact CG2-SD 4.13Å; T197-M201 WeakPolarHBondContact O-CG 3.1Å; T197-M201 PolarHBondContact O-N 3.45Å; T197-M201 VanDerWaalsContact O-N 3.12Å
198	A	80.6	Confident	80.4	Confident	21 Å²	21	71.5 Å²	71.5	17%	0.174	40%	0.401	C	S	.	.	H	α-helix	trans	-60.9	-39.8	179.2	0	0	0	0	0	112.2	C194 F195 M201 L202 I216 V220	C194-A198 WeakPolarHBondContact O-CB 3.46Å; C194-A198 PolarHBondContact O-N 2.6Å; F195-A198 PolarHBondContact O-N 3.41Å; A198-M201 PolarHBondContact O-N 3.2Å; A198-L202 WeakPolarHBondContact O-CG 3.18Å; A198-L202 PolarHBondContact O-N 3Å; A198-I216 HydrophobicContact CB-CG2 3.91Å; A198-V220 HydrophobicContact CB-CG2 4.33Å
199	K	75.2	Confident	79.9	Confident	103 Å²	103	73.6 Å²	73.6	45%	0.448	41%	0.413	S	S	.	.	H	α-helix	trans	-64.9	-38.7	174.5	-82.1	-178.4	163.7	-177.7	0	113.1	F195 D196 T197 M201 L202	F195-K199 HydrophobicContact CD1-CD 3.99Å; F195-K199 HydrophobicContact CE1-CD 3.77Å; F195-K199 HydrophobicContact CE1-CG 4.44Å; F195-K199 VanDerWaalsContact CE1-NZ 3.28Å; F195-K199 HydrophobicContact CZ-CD 4.36Å; F195-K199 VanDerWaalsContact CZ-CE 3.5Å; F195-K199 WeakPolarHBondContact O-CB 3.35Å; F195-K199 WeakPolarHBondContact O-CG 3.3Å; F195-K199 PolarHBondContact O-N 3.5Å; D196-K199 PolarHBondContact O-N 2.92Å; T197-K199 VanDerWaalsContact C-N 3.31Å; T197-K199 PolarHBondContact O-N 2.89Å; K199-M201 VanDerWaalsContact C-N 3.26Å; K199-M201 PolarHBondContact O-N 2.99Å; K199-L202 PolarHBondContact O-N 2.91Å
200	G	74.1	Confident	79.3	Confident	70 Å²	70	78.7 Å²	78.7	72%	0.722	44%	0.435	S	S	*	.	H	α-helix	trans	-68.1	-24.3	176.9	0	0	0	0	0	113.8	D196 T197	D196-G200 PolarHBondContact O-N 3.25Å; T197-G200 PolarHBondContact O-N 3.41Å; T197-G200 VanDerWaalsContact O-N 3.14Å
201	M	76.1	Confident	78.8	Confident	152 Å²	152	82.6 Å²	82.6	75%	0.749	45%	0.453	S	S	*	.	H	α-helix	trans	-87.4	-11.3	177.4	-65.4	177.3	74.2	0	0	113.7	T197 A198 K199	T197-M201 HydrophobicContact CG2-SD 4.13Å; T197-M201 WeakPolarHBondContact O-CG 3.1Å; T197-M201 PolarHBondContact O-N 3.45Å; T197-M201 VanDerWaalsContact O-N 3.12Å; A198-M201 PolarHBondContact O-N 3.2Å; K199-M201 VanDerWaalsContact C-N 3.26Å; K199-M201 PolarHBondContact O-N 2.99Å
202	L	76.2	Confident	78.4	Confident	41 Å²	41	82.3 Å²	82.3	22%	0.215	46%	0.458	C	S	.	.			trans	-80.7	127.3	179.5	-78.3	170.3	0	0	0	110.8	A198 K199 D204 P205 T208 I216	A198-L202 WeakPolarHBondContact O-CG 3.18Å; A198-L202 PolarHBondContact O-N 3Å; K199-L202 PolarHBondContact O-N 2.91Å; L202-D204 VanDerWaalsContact C-N 3.31Å; L202-D204 PolarHBondContact O-N 3.44Å; L202-P205 HydrophobicContact CB-CG 4.05Å; L202-T208 HydrophobicContact CD2-CG2 4.49Å; L202-I216 HydrophobicContact CD1-CD1 3.8Å; L202-I216 HydrophobicContact CD2-CD1 3.64Å; L202-I216 HydrophobicContact CG-CD1 4.09Å
203	P	69.5	Low	78.2	Confident	135 Å²	135	82.2 Å²	82.2	88%	0.877	46%	0.464	S	S	*	.	S	Bend	trans	-60.8	-38	179.4	-22.4	31.7	0	0	0	113.3
204	D	74.9	Confident	78.2	Confident	64 Å²	64	84.9 Å²	84.9	34%	0.342	47%	0.465	S	S	.	.			trans	-143.5	93.7	173	-172.2	-17.1	0	0	0	110.8	L202 K206 N207 T208	L202-D204 VanDerWaalsContact C-N 3.31Å; L202-D204 PolarHBondContact O-N 3.44Å; D204-K206 PolarHBondContact O-N 3.4Å; D204-K206 VanDerWaalsContact O-N 3.15Å; D204-K206 PolarHBondContact OD1-N 2.89Å; D204-N207 HydrophobicContact CB-CB 4.48Å; D204-N207 PolarHBondContact O-N 3.4Å; D204-N207 PolarHBondContact OD1-N 2.85Å; D204-N207 VanDerWaalsContact OD1-N 3.11Å; D204-N207 WeakPolarHBondContact OD2-CB 3.47Å; D204-N207 PolarHBondContact OD2-ND2 2.99Å; D204-T208 PolarHBondContact O-N 2.94Å; D204-T208 PolarHBondContact O-OG1 3.41Å
205	P	67.1	Low	78.3	Confident	70 Å²	70	87.2 Å²	87.2	46%	0.455	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.7	179.4	-21.1	31.4	0	0	0	114.4	L202	L202-P205 HydrophobicContact CB-CG 4.05Å
206	K	69.6	Low	78.4	Confident	194 Å²	194	86.6 Å²	86.6	84%	0.843	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-31.7	-176.7	-68.4	-175.8	179.9	178.6	0	112.5	D204	D204-K206 PolarHBondContact O-N 3.4Å; D204-K206 VanDerWaalsContact O-N 3.15Å; D204-K206 PolarHBondContact OD1-N 2.89Å
207	N	76.4	Confident	78.7	Confident	134 Å²	134	85.5 Å²	85.5	72%	0.717	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	11.5	179.1	-65.2	-43.8	0	0	0	114.1	D204 H209	D204-N207 HydrophobicContact CB-CB 4.48Å; D204-N207 PolarHBondContact O-N 3.4Å; D204-N207 PolarHBondContact OD1-N 2.85Å; D204-N207 VanDerWaalsContact OD1-N 3.11Å; D204-N207 WeakPolarHBondContact OD2-CB 3.47Å; D204-N207 PolarHBondContact OD2-ND2 2.99Å; N207-H209 PolarHBondContact O-N 3.29Å
208	T	76.4	Confident	79.2	Confident	31 Å²	31	82.4 Å²	82.4	19%	0.19	45%	0.45	C	S	.	.			trans	-65	128.9	176.7	-64.2	0	0	0	0	110.9	L202 D204 V212 S213	L202-T208 HydrophobicContact CD2-CG2 4.49Å; D204-T208 PolarHBondContact O-N 2.94Å; D204-T208 PolarHBondContact O-OG1 3.41Å; T208-V212 HydrophobicContact CG2-CB 3.65Å; T208-V212 HydrophobicContact CG2-CG1 3.58Å; T208-S213 WeakPolarHBondContact CG2-OG 3.32Å
209	H	81.1	Confident	79.7	Confident	115 Å²	115	85.6 Å²	85.6	53%	0.532	47%	0.467	S	S	.	.			trans	-52.5	140.7	178.5	-171.2	-98	0	0	0	112	N207 I211 V212 S213	N207-H209 PolarHBondContact O-N 3.29Å; H209-I211 PolarHBondContact ND1-N 3.01Å; H209-I211 PolarHBondContact O-N 2.61Å; H209-I211 VanDerWaalsContact O-N 3.11Å; H209-V212 HydrophobicContact CB-CG2 4.32Å; H209-V212 WeakPolarHBondContact O-CB 3.23Å; H209-V212 PolarHBondContact O-N 2.6Å; H209-S213 PolarHBondContact O-N 3.34Å
210	I	79.9	Confident	80.6	Confident	131 Å²	131	81 Å²	81	67%	0.672	45%	0.447	S	S	*	.	H	α-helix	trans	-54.8	-37	-173.3	-170.5	165.2	0	0	0	113.3	S213 W214	I210-S213 PolarHBondContact O-N 3.25Å; I210-W214 WeakPolarHBondContact O-CB 3.39Å; I210-W214 PolarHBondContact O-N 3.32Å
211	I	83.4	Confident	81.4	Confident	99 Å²	99	79.7 Å²	79.7	51%	0.508	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-41.7	177.4	-60.6	176.3	0	0	0	111.1	H209 W214 M215	H209-I211 PolarHBondContact ND1-N 3.01Å; H209-I211 PolarHBondContact O-N 2.61Å; H209-I211 VanDerWaalsContact O-N 3.11Å; I211-W214 PolarHBondContact O-N 3.33Å; I211-M215 HydrophobicContact CG2-CE 4.21Å; I211-M215 HydrophobicContact CG2-CG 4.46Å; I211-M215 HydrophobicContact CG2-SD 4.48Å; I211-M215 WeakPolarHBondContact O-CG 3.37Å; I211-M215 PolarHBondContact O-N 3.37Å
212	V	83.8	Confident	82.3	Confident	57 Å²	57	73.5 Å²	73.5	35%	0.345	40%	0.399	S	S	.	.	H	α-helix	trans	-67.6	-45.7	179.6	178.2	0	0	0	0	109.9	T208 H209 W214 M215 I216	T208-V212 HydrophobicContact CG2-CB 3.65Å; T208-V212 HydrophobicContact CG2-CG1 3.58Å; H209-V212 HydrophobicContact CB-CG2 4.32Å; H209-V212 WeakPolarHBondContact O-CB 3.23Å; H209-V212 PolarHBondContact O-N 2.6Å; V212-W214 VanDerWaalsContact C-N 3.28Å; V212-W214 PolarHBondContact O-N 2.73Å; V212-M215 HydrophobicContact CG2-CE 4.21Å; V212-M215 PolarHBondContact O-N 3.49Å; V212-I216 HydrophobicContact CG1-CD1 3.94Å; V212-I216 VanDerWaalsContact O-CG1 3.31Å; V212-I216 WeakPolarHBondContact O-CG1 3.38Å; V212-I216 PolarHBondContact O-N 3.32Å
213	S	81.6	Confident	83.2	Confident	51 Å²	51	74.3 Å²	74.3	36%	0.357	41%	0.405	S	S	.	.	H	α-helix	trans	-57.8	-40.5	173.8	-66.7	0	0	0	0	112.2	T208 H209 I210 A217	T208-S213 WeakPolarHBondContact CG2-OG 3.32Å; H209-S213 PolarHBondContact O-N 3.34Å; I210-S213 PolarHBondContact O-N 3.25Å; S213-A217 WeakPolarHBondContact O-CB 3.36Å; S213-A217 PolarHBondContact O-N 2.87Å
214	W	84.6	Confident	84.4	Confident	84 Å²	84	67.9 Å²	67.9	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-46.6	175.1	-179.3	87.9	0	0	0	112.2	I210 I211 V212 I216 A217 Q218	I210-W214 WeakPolarHBondContact O-CB 3.39Å; I210-W214 PolarHBondContact O-N 3.32Å; I211-W214 PolarHBondContact O-N 3.33Å; V212-W214 VanDerWaalsContact C-N 3.28Å; V212-W214 PolarHBondContact O-N 2.73Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.12Å; W214-A217 WeakPolarHBondContact O-CB 3.43Å; W214-A217 PolarHBondContact O-N 2.94Å; W214-Q218 HydrophobicContact CD2-CG 3.9Å; W214-Q218 HydrophobicContact CE3-CG 4.12Å; W214-Q218 HydrophobicContact CH2-CG 3.93Å; W214-Q218 HydrophobicContact CZ2-CG 3.69Å; W214-Q218 HydrophobicContact CZ3-CG 4.14Å; W214-Q218 WeakPolarHBondContact O-CG 3.41Å; W214-Q218 PolarHBondContact O-N 3.5Å
215	M	87.1	Confident	85.4	Confident	90 Å²	90	65.3 Å²	65.3	44%	0.443	35%	0.352	S	S	.	.	H	α-helix	trans	-60.5	-39.5	177.5	-73.7	-170.1	-61	0	0	112.2	I211 V212 Q218 T219	I211-M215 HydrophobicContact CG2-CE 4.21Å; I211-M215 HydrophobicContact CG2-CG 4.46Å; I211-M215 HydrophobicContact CG2-SD 4.48Å; I211-M215 WeakPolarHBondContact O-CG 3.37Å; I211-M215 PolarHBondContact O-N 3.37Å; V212-M215 HydrophobicContact CG2-CE 4.21Å; V212-M215 PolarHBondContact O-N 3.49Å; M215-Q218 PolarHBondContact O-N 2.95Å; M215-T219 WeakPolarHBondContact O-CB 3.48Å; M215-T219 PolarHBondContact O-N 2.98Å; M215-T219 PolarHBondContact O-OG1 2.96Å
216	I	87	Confident	86.9	Confident	39 Å²	39	65.1 Å²	65.1	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-64.6	-46.7	175.4	-68.2	168.7	0	0	0	110.3	A198 L202 V212 W214 Q218 T219 V220	A198-I216 HydrophobicContact CB-CG2 3.91Å; L202-I216 HydrophobicContact CD1-CD1 3.8Å; L202-I216 HydrophobicContact CD2-CD1 3.64Å; L202-I216 HydrophobicContact CG-CD1 4.09Å; V212-I216 HydrophobicContact CG1-CD1 3.94Å; V212-I216 VanDerWaalsContact O-CG1 3.31Å; V212-I216 WeakPolarHBondContact O-CG1 3.38Å; V212-I216 PolarHBondContact O-N 3.32Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.12Å; I216-Q218 VanDerWaalsContact C-N 3.3Å; I216-Q218 PolarHBondContact O-N 3.49Å; I216-T219 PolarHBondContact O-N 3.23Å; I216-V220 HydrophobicContact CG2-CG2 4.32Å; I216-V220 WeakPolarHBondContact O-CB 3.36Å; I216-V220 WeakPolarHBondContact O-CG2 3.46Å; I216-V220 PolarHBondContact O-N 2.74Å
217	A	87.4	Confident	88.2	Confident	28 Å²	28	59.6 Å²	59.6	23%	0.231	33%	0.329	C	S	.	.	H	α-helix	trans	-59.3	-40.6	176.3	0	0	0	0	0	112.2	S213 W214 T221	S213-A217 WeakPolarHBondContact O-CB 3.36Å; S213-A217 PolarHBondContact O-N 2.87Å; W214-A217 WeakPolarHBondContact O-CB 3.43Å; W214-A217 PolarHBondContact O-N 2.94Å; A217-T221 VanDerWaalsContact O-CB 3.27Å; A217-T221 WeakPolarHBondContact O-CB 3.27Å; A217-T221 PolarHBondContact O-N 3.37Å; A217-T221 PolarHBondContact O-OG1 3.01Å
218	Q	91.1	Very high	89.2	Confident	22 Å²	22	53.9 Å²	53.9	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-66.2	-42.6	174.7	-65.7	-43.3	-55.8	0	0	112	W214 M215 I216 T221 A222 A285	W214-Q218 HydrophobicContact CD2-CG 3.9Å; W214-Q218 HydrophobicContact CE3-CG 4.12Å; W214-Q218 HydrophobicContact CH2-CG 3.93Å; W214-Q218 HydrophobicContact CZ2-CG 3.69Å; W214-Q218 HydrophobicContact CZ3-CG 4.14Å; W214-Q218 WeakPolarHBondContact O-CG 3.41Å; W214-Q218 PolarHBondContact O-N 3.5Å; M215-Q218 PolarHBondContact O-N 2.95Å; I216-Q218 VanDerWaalsContact C-N 3.3Å; I216-Q218 PolarHBondContact O-N 3.49Å; Q218-T221 PolarHBondContact O-N 3.41Å; Q218-A222 WeakPolarHBondContact O-CB 3.49Å; Q218-A222 PolarHBondContact O-N 3.26Å; Q218-A285 VanDerWaalsContact NE2-CB 3.31Å
219	T	91.8	Very high	90.2	Very high	87 Å²	87	52.6 Å²	52.6	53%	0.534	29%	0.291	S	S	.	.	H	α-helix	trans	-63	-48.8	179.3	-58.7	0	0	0	0	110.9	M215 I216 T221 A222 V223	M215-T219 WeakPolarHBondContact O-CB 3.48Å; M215-T219 PolarHBondContact O-N 2.98Å; M215-T219 PolarHBondContact O-OG1 2.96Å; I216-T219 PolarHBondContact O-N 3.23Å; T219-T221 VanDerWaalsContact C-N 3.31Å; T219-T221 PolarHBondContact O-N 2.67Å; T219-A222 PolarHBondContact O-N 2.93Å; T219-V223 WeakPolarHBondContact O-CG2 3.42Å; T219-V223 PolarHBondContact O-N 3.04Å
220	V	92.4	Very high	91	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-43.3	175.7	170.2	0	0	0	0	111	Y191 C194 F195 A198 I216 A222 V223 A224	Y191-V220 HydrophobicContact CD2-CG1 3.79Å; Y191-V220 HydrophobicContact CE2-CG1 3.92Å; Y191-V220 HydrophobicContact CG-CG1 4.18Å; Y191-V220 WeakPolarHBondContact O-CG1 3.36Å; C194-V220 HydrophobicContact CB-CG1 4.03Å; C194-V220 HydrophobicContact CB-CG2 4.23Å; F195-V220 HydrophobicContact CB-CG1 4.06Å; F195-V220 HydrophobicContact CD2-CG1 4.37Å; F195-V220 HydrophobicContact CD2-CG2 4.36Å; A198-V220 HydrophobicContact CB-CG2 4.33Å; I216-V220 HydrophobicContact CG2-CG2 4.32Å; I216-V220 WeakPolarHBondContact O-CB 3.36Å; I216-V220 WeakPolarHBondContact O-CG2 3.46Å; I216-V220 PolarHBondContact O-N 2.74Å; V220-A222 PolarHBondContact O-N 2.66Å; V220-V223 PolarHBondContact O-N 2.93Å; V220-A224 WeakPolarHBondContact O-CB 3.38Å; V220-A224 PolarHBondContact O-N 2.88Å
221	T	92.1	Very high	91.9	Very high	42 Å²	42	43.8 Å²	43.8	26%	0.258	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-41.9	177.2	-60.9	0	0	0	0	111.8	A217 Q218 T219 G225	A217-T221 VanDerWaalsContact O-CB 3.27Å; A217-T221 WeakPolarHBondContact O-CB 3.27Å; A217-T221 PolarHBondContact O-N 3.37Å; A217-T221 PolarHBondContact O-OG1 3.01Å; Q218-T221 PolarHBondContact O-N 3.41Å; T219-T221 VanDerWaalsContact C-N 3.31Å; T219-T221 PolarHBondContact O-N 2.67Å; T221-G225 PolarHBondContact O-N 2.78Å
222	A	94.7	Very high	92.5	Very high	23 Å²	23	40.5 Å²	40.5	19%	0.19	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-47.6	177.8	0	0	0	0	0	111.2	Q218 T219 V220 G225 L226 V278	Q218-A222 WeakPolarHBondContact O-CB 3.49Å; Q218-A222 PolarHBondContact O-N 3.26Å; T219-A222 PolarHBondContact O-N 2.93Å; V220-A222 PolarHBondContact O-N 2.66Å; A222-G225 CarbonylContact O-C 3.57Å; A222-G225 PolarHBondContact O-N 3.4Å; A222-L226 VanDerWaalsContact O-CG 3.29Å; A222-L226 WeakPolarHBondContact O-CG 3.48Å; A222-L226 PolarHBondContact O-N 3.5Å; A222-V278 HydrophobicContact CB-CG1 4.14Å; A222-V278 HydrophobicContact CB-CG2 4.32Å
223	V	95.4	Very high	93.2	Very high	57 Å²	57	37.8 Å²	37.8	35%	0.345	22%	0.215	S	C	.	.	H	α-helix	trans	-61.2	-49.9	178.2	173.2	0	0	0	0	111	T219 V220 G225 L226 V227	T219-V223 WeakPolarHBondContact O-CG2 3.42Å; T219-V223 PolarHBondContact O-N 3.04Å; V220-V223 PolarHBondContact O-N 2.93Å; V223-G225 VanDerWaalsContact C-N 3.26Å; V223-G225 PolarHBondContact O-N 3.36Å; V223-L226 PolarHBondContact O-N 2.94Å; V223-L226 VanDerWaalsContact O-N 3.1Å; V223-V227 HydrophobicContact CG1-CG2 4.38Å; V223-V227 WeakPolarHBondContact O-CG2 3.05Å; V223-V227 PolarHBondContact O-N 2.97Å
224	A	95.3	Very high	94	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-39	176.9	0	0	0	0	0	112.2	Y187 A190 Y191 V220 S228	Y187-A224 HydrophobicContact CD2-CB 3.93Å; Y187-A224 HydrophobicContact CE2-CB 3.81Å; A190-A224 HydrophobicContact CB-CB 4Å; Y191-A224 HydrophobicContact CD2-CB 4.39Å; V220-A224 WeakPolarHBondContact O-CB 3.38Å; V220-A224 PolarHBondContact O-N 2.88Å; A224-S228 WeakPolarHBondContact O-CB 3.38Å; A224-S228 PolarHBondContact O-N 2.92Å; A224-S228 VanDerWaalsContact O-N 3.11Å; A224-S228 PolarHBondContact O-OG 2.97Å
225	G	95.7	Very high	94.6	Very high	10 Å²	10	32.5 Å²	32.5	10%	0.103	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-39.5	174.3	0	0	0	0	0	113	T221 A222 V223 S228 Y229	T221-G225 PolarHBondContact O-N 2.78Å; A222-G225 CarbonylContact O-C 3.57Å; A222-G225 PolarHBondContact O-N 3.4Å; V223-G225 VanDerWaalsContact C-N 3.26Å; V223-G225 PolarHBondContact O-N 3.36Å; G225-S228 PolarHBondContact O-OG 3.47Å; G225-Y229 WeakPolarHBondContact O-CA 3.26Å; G225-Y229 VanDerWaalsContact O-CB 3.28Å; G225-Y229 WeakPolarHBondContact O-CB 3.24Å; G225-Y229 PolarHBondContact O-N 3Å; G225-Y229 VanDerWaalsContact O-N 3.07Å
226	L	96.9	Very high	95.1	Very high	67 Å²	67	29 Å²	29	35%	0.351	17%	0.169	S	C	.	.	H	α-helix	trans	-70.3	-45.4	177	-72.4	171	0	0	0	111.8	A222 V223 S228 Y229 F271 A274 V278	A222-L226 VanDerWaalsContact O-CG 3.29Å; A222-L226 WeakPolarHBondContact O-CG 3.48Å; A222-L226 PolarHBondContact O-N 3.5Å; V223-L226 PolarHBondContact O-N 2.94Å; V223-L226 VanDerWaalsContact O-N 3.1Å; L226-S228 VanDerWaalsContact C-N 3.3Å; L226-S228 PolarHBondContact O-N 2.86Å; L226-Y229 VanDerWaalsContact O-CB 3.24Å; L226-Y229 WeakPolarHBondContact O-CB 3.22Å; L226-Y229 PolarHBondContact O-N 2.9Å; L226-Y229 VanDerWaalsContact O-N 3.11Å; L226-F271 WeakPolarHBondContact O-CE1 3.3Å; L226-A274 HydrophobicContact CD2-CB 3.87Å; L226-V278 HydrophobicContact CD2-CG2 4.29Å; L226-V278 HydrophobicContact CG-CG2 4.38Å
227	V	97.2	Very high	95.6	Very high	78 Å²	78	27.1 Å²	27.1	47%	0.473	16%	0.16	S	C	.	.	H	α-helix	trans	-60.6	-40.9	179.2	172.3	0	0	0	0	111.5	I186 A190 V223	I186-V227 HydrophobicContact CG2-CG1 3.9Å; A190-V227 HydrophobicContact CB-CB 4.06Å; A190-V227 HydrophobicContact CB-CG1 4.02Å; A190-V227 HydrophobicContact CB-CG2 4.38Å; V223-V227 HydrophobicContact CG1-CG2 4.38Å; V223-V227 WeakPolarHBondContact O-CG2 3.05Å; V223-V227 PolarHBondContact O-N 2.97Å
228	S	97.3	Very high	96.1	Very high	14 Å²	14	26.1 Å²	26.1	10%	0.098	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.1	178	59.9	0	0	0	0	114.1	A224 G225 L226 F231 D232	A224-S228 WeakPolarHBondContact O-CB 3.38Å; A224-S228 PolarHBondContact O-N 2.92Å; A224-S228 VanDerWaalsContact O-N 3.11Å; A224-S228 PolarHBondContact O-OG 2.97Å; G225-S228 PolarHBondContact O-OG 3.47Å; L226-S228 VanDerWaalsContact C-N 3.3Å; L226-S228 PolarHBondContact O-N 2.86Å; S228-F231 WeakPolarHBondContact O-CB 3.4Å; S228-F231 PolarHBondContact O-N 3.27Å; S228-F231 VanDerWaalsContact O-N 3.12Å; S228-D232 PolarHBondContact O-N 3.36Å
229	Y	97.8	Very high	96.4	Very high	3 Å²	3	25 Å²	25	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-40.2	-172.3	-158.6	-96.5	0	0	0	114.5	K33 Q37 G225 L226 F231 D232 T233 F270 F271 K272 G273 A274 N277	K33-Y229 WeakPolarHBondContact CE-OH 3.31Å; Q37-Y229 PolarHBondContact NE2-OH 2.96Å; G225-Y229 WeakPolarHBondContact O-CA 3.26Å; G225-Y229 VanDerWaalsContact O-CB 3.28Å; G225-Y229 WeakPolarHBondContact O-CB 3.24Å; G225-Y229 PolarHBondContact O-N 3Å; G225-Y229 VanDerWaalsContact O-N 3.07Å; L226-Y229 VanDerWaalsContact O-CB 3.24Å; L226-Y229 WeakPolarHBondContact O-CB 3.22Å; L226-Y229 PolarHBondContact O-N 2.9Å; L226-Y229 VanDerWaalsContact O-N 3.11Å; Y229-F231 PolarHBondContact O-N 3.3Å; Y229-D232 PolarHBondContact O-N 3.44Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.15Å; Y229-T233 PolarHBondContact O-N 3.29Å; Y229-T233 PolarHBondContact O-OG1 3.32Å; Y229-F270 WeakPolarHBondContact CD1-O 3.46Å; Y229-F270 WeakPolarHBondContact CE1-O 3.35Å; Y229-F271 HydrophobicContact CD1-CD1 4.32Å; Y229-K272 WeakPolarHBondContact CE1-O 3.32Å; Y229-K272 PolarHBondContact OH-O 3.18Å; Y229-G273 WeakPolarHBondContact OH-CA 3.44Å; Y229-G273 PolarHBondContact OH-O 2.84Å; Y229-A274 HydrophobicContact CD1-CB 3.81Å; Y229-A274 HydrophobicContact CD2-CB 4.3Å; Y229-A274 HydrophobicContact CE1-CB 3.81Å; Y229-A274 HydrophobicContact CE2-CB 4.3Å; Y229-A274 HydrophobicContact CG-CB 4.07Å; Y229-A274 VanDerWaalsContact CZ-CA 3.49Å; Y229-A274 PolarHBondContact OH-N 3.09Å; Y229-N277 HydrophobicContact CD2-CB 4.33Å; Y229-N277 HydrophobicContact CE2-CB 3.6Å
230	P	98.3	Very high	96.7	Very high	17 Å²	17	21.1 Å²	21.1	11%	0.11	12%	0.121	C	C	.	.	H	α-helix	trans	-55.1	-36.5	175.7	-30.4	39.8	0	0	0	113.7	T233 V234 W258 F270 F271	P230-T233 PolarHBondContact O-N 2.85Å; P230-V234 PolarHBondContact O-N 3.34Å; P230-W258 HydrophobicContact CB-CH2 3.52Å; P230-W258 HydrophobicContact CB-CZ3 3.74Å; P230-F270 HydrophobicContact CB-CB 3.87Å; P230-F270 HydrophobicContact CB-CD1 4.13Å; P230-F270 HydrophobicContact CB-CG 4.13Å; P230-F270 HydrophobicContact CG-CB 4.02Å; P230-F271 HydrophobicContact CG-CE1 3.97Å; P230-F271 HydrophobicContact CG-CE2 4.1Å; P230-F271 HydrophobicContact CG-CZ 3.61Å
231	F	98.1	Very high	96.8	Very high	45 Å²	45	21.1 Å²	21.1	20%	0.197	12%	0.121	C	C	.	.	H	α-helix	trans	-67.8	-39.9	175.9	-64.4	-99.6	0	0	0	111.9	V179 Q182 I186 S228 Y229 R235 W258	V179-F231 HydrophobicContact CG2-CB 4.12Å; V179-F231 HydrophobicContact CG2-CD1 3.83Å; V179-F231 HydrophobicContact CG2-CG 4.42Å; Q182-F231 HydrophobicContact CB-CD1 3.89Å; Q182-F231 HydrophobicContact CB-CE1 3.92Å; I186-F231 HydrophobicContact CB-CE2 4.41Å; I186-F231 HydrophobicContact CG1-CE1 4.41Å; I186-F231 HydrophobicContact CG1-CE2 3.95Å; I186-F231 HydrophobicContact CG1-CZ 3.88Å; I186-F231 HydrophobicContact CG2-CE2 4.24Å; S228-F231 WeakPolarHBondContact O-CB 3.4Å; S228-F231 PolarHBondContact O-N 3.27Å; S228-F231 VanDerWaalsContact O-N 3.12Å; Y229-F231 PolarHBondContact O-N 3.3Å; F231-R235 VanDerWaalsContact O-CB 3.24Å; F231-R235 WeakPolarHBondContact O-CB 3.38Å; F231-R235 PolarHBondContact O-N 2.93Å; F231-W258 HydrophobicContact CD1-CZ2 4.01Å; F231-W258 HydrophobicContact CD2-CH2 4.42Å; F231-W258 HydrophobicContact CE1-CZ2 4.2Å; F231-W258 HydrophobicContact CG-CH2 4.44Å; F231-W258 HydrophobicContact CG-CZ2 4.18Å
232	D	97.5	Very high	96.9	Very high	29 Å²	29	19.1 Å²	19.1	16%	0.155	11%	0.108	C	C	.	.	H	α-helix	trans	-63.9	-41.6	173.2	-174.5	59.3	0	0	0	110.4	K33 Q37 S228 Y229 V234 R235 R236	K33-D232 IonicContact NZ-OD2 3.15Å; K33-D232 PolarHBondContact NZ-OD2 3.44Å; Q37-D232 PolarHBondContact NE2-OD2 3.11Å; Q37-D232 PolarHBondContact OE1-OD2 3.15Å; S228-D232 PolarHBondContact O-N 3.36Å; Y229-D232 PolarHBondContact O-N 3.44Å; D232-V234 PolarHBondContact O-N 2.86Å; D232-R235 WeakPolarHBondContact O-CB 3.48Å; D232-R235 PolarHBondContact O-N 3.36Å; D232-R236 VanDerWaalsContact O-CG 3.28Å; D232-R236 WeakPolarHBondContact O-CG 3.49Å; D232-R236 PolarHBondContact O-N 3.41Å; D232-R236 IonicContact OD1-CZ 2.88Å; D232-R236 IonicContact OD1-NE 3.61Å; D232-R236 PolarHBondContact OD1-NE 3.2Å; D232-R236 VanDerWaalsContact OD1-NE 3.1Å; D232-R236 IonicContact OD1-NH2 3.71Å; D232-R236 PolarHBondContact OD1-NH2 3.12Å
233	T	98	Very high	96.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60	-51.1	177.4	-63.7	0	0	0	0	111.6	Q37 Y229 P230 R235 R236 R237 F270	Q37-T233 HydrophobicContact CG-CG2 4.18Å; Q37-T233 VanDerWaalsContact NE2-CA 3.29Å; Q37-T233 PolarHBondContact NE2-OG1 3.05Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.15Å; Y229-T233 PolarHBondContact O-N 3.29Å; Y229-T233 PolarHBondContact O-OG1 3.32Å; P230-T233 PolarHBondContact O-N 2.85Å; T233-R235 VanDerWaalsContact C-N 3.32Å; T233-R235 PolarHBondContact O-N 2.96Å; T233-R236 PolarHBondContact O-N 3.2Å; T233-R237 HydrophobicContact CG2-CG 4.35Å; T233-R237 WeakPolarHBondContact O-CB 3.24Å; T233-R237 WeakPolarHBondContact O-CG 3.45Å; T233-R237 PolarHBondContact O-N 3.41Å; T233-F270 WeakPolarHBondContact CB-O 3.08Å; T233-F270 PolarHBondContact OG1-O 3.02Å
234	V	98.1	Very high	96.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-40.7	176.9	174.2	0	0	0	0	111.6	V179 P230 D232 R236 R237 M238 T254 C257 W258 I261 F270	V179-V234 HydrophobicContact CG1-CG1 4.28Å; V179-V234 HydrophobicContact CG2-CB 4.21Å; V179-V234 HydrophobicContact CG2-CG1 4.12Å; P230-V234 PolarHBondContact O-N 3.34Å; D232-V234 PolarHBondContact O-N 2.86Å; V234-R236 PolarHBondContact O-N 3.11Å; V234-R237 PolarHBondContact O-N 3.45Å; V234-M238 HydrophobicContact CG1-CG 4.36Å; V234-M238 WeakPolarHBondContact O-CB 3.32Å; V234-M238 VanDerWaalsContact O-CG 3.29Å; V234-M238 WeakPolarHBondContact O-CG 3.42Å; V234-M238 PolarHBondContact O-N 2.89Å; V234-T254 HydrophobicContact CG1-CG2 3.97Å; V234-C257 HydrophobicContact CG1-CB 3.96Å; V234-W258 HydrophobicContact CB-CZ2 4.31Å; V234-W258 HydrophobicContact CG2-CD2 3.62Å; V234-W258 HydrophobicContact CG2-CE3 3.92Å; V234-W258 HydrophobicContact CG2-CG 4.08Å; V234-W258 HydrophobicContact CG2-CH2 4.19Å; V234-W258 HydrophobicContact CG2-CZ2 3.91Å; V234-W258 HydrophobicContact CG2-CZ3 4.19Å; V234-I261 HydrophobicContact CG2-CD1 3.91Å; V234-F270 HydrophobicContact CG2-CD1 4.23Å; V234-F270 HydrophobicContact CG2-CE1 3.82Å
235	R	98.1	Very high	96.4	Very high	24 Å²	24	24.9 Å²	24.9	9%	0.091	13%	0.133	C	C	.	.	H	α-helix	trans	-53.3	-52.7	173.6	178.9	-168.2	-177.4	-176.3	-4	111.2	D135 V179 S180 F231 D232 T233 M238 M239	D135-R235 IonicContact OD2-CZ 2.85Å; D135-R235 IonicContact OD2-NH1 3.6Å; D135-R235 IonicContact OD2-NH2 3.47Å; D135-R235 PolarHBondContact OD2-NH2 3.34Å; V179-R235 HydrophobicContact CG1-CB 3.86Å; S180-R235 VanDerWaalsContact CB-CD 3.42Å; F231-R235 VanDerWaalsContact O-CB 3.24Å; F231-R235 WeakPolarHBondContact O-CB 3.38Å; F231-R235 PolarHBondContact O-N 2.93Å; D232-R235 WeakPolarHBondContact O-CB 3.48Å; D232-R235 PolarHBondContact O-N 3.36Å; T233-R235 VanDerWaalsContact C-N 3.32Å; T233-R235 PolarHBondContact O-N 2.96Å; R235-M238 PolarHBondContact O-N 3.06Å; R235-M239 HydrophobicContact CG-CE 4.01Å; R235-M239 WeakPolarHBondContact O-CG 3.35Å; R235-M239 PolarHBondContact O-N 2.94Å; R235-M239 VanDerWaalsContact O-N 3.1Å
236	R	97.9	Very high	96	Very high	16 Å²	16	27.4 Å²	27.4	6%	0.06	16%	0.158	C	C	.	.	H	α-helix	trans	-67.7	-39	-177.1	-58.3	-59.9	167.7	-179	-3.4	111.8	L34 V38 T139 D232 T233 V234 M238 M239 M240	L34-R236 HydrophobicContact CD2-CG 4.36Å; V38-R236 HydrophobicContact CG1-CB 3.42Å; V38-R236 VanDerWaalsContact CG1-CB 3.42Å; V38-R236 HydrophobicContact CG1-CG 4.46Å; T139-R236 HydrophobicContact CG2-CB 4.22Å; T139-R236 HydrophobicContact CG2-CG 4.39Å; T139-R236 PolarHBondContact OG1-NH1 3.18Å; D232-R236 VanDerWaalsContact O-CG 3.28Å; D232-R236 WeakPolarHBondContact O-CG 3.49Å; D232-R236 PolarHBondContact O-N 3.41Å; D232-R236 IonicContact OD1-CZ 2.88Å; D232-R236 IonicContact OD1-NE 3.61Å; D232-R236 PolarHBondContact OD1-NE 3.2Å; D232-R236 VanDerWaalsContact OD1-NE 3.1Å; D232-R236 IonicContact OD1-NH2 3.71Å; D232-R236 PolarHBondContact OD1-NH2 3.12Å; T233-R236 PolarHBondContact O-N 3.2Å; V234-R236 PolarHBondContact O-N 3.11Å; R236-M238 VanDerWaalsContact C-N 3.32Å; R236-M238 PolarHBondContact O-N 2.86Å; R236-M239 WeakPolarHBondContact O-CB 3.46Å; R236-M239 PolarHBondContact O-N 3.09Å; R236-M240 WeakPolarHBondContact O-CG 3.3Å; R236-M240 PolarHBondContact O-N 2.96Å
237	R	97.2	Very high	95.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-37.6	175.6	-67.7	-62.6	-171.9	88.8	5.1	112.8	Q37 T233 V234 M240 Q241 Y251 I261 E265	Q37-R237 PolarHBondContact O-NE 3.01Å; Q37-R237 PolarHBondContact O-NH2 2.84Å; T233-R237 HydrophobicContact CG2-CG 4.35Å; T233-R237 WeakPolarHBondContact O-CB 3.24Å; T233-R237 WeakPolarHBondContact O-CG 3.45Å; T233-R237 PolarHBondContact O-N 3.41Å; V234-R237 PolarHBondContact O-N 3.45Å; R237-M240 PolarHBondContact O-N 3.34Å; R237-Q241 PolarHBondContact O-NE2 2.95Å; R237-Q241 VanDerWaalsContact O-NE2 3.11Å; R237-Y251 HydrophobicContact CB-CD2 4.26Å; R237-Y251 HydrophobicContact CB-CE2 3.75Å; R237-Y251 HydrophobicContact CG-CE2 4.45Å; R237-Y251 PolarHBondContact NH1-OH 3.29Å; R237-I261 HydrophobicContact CG-CD1 4.07Å; R237-E265 IonicContact CZ-OE1 2.92Å; R237-E265 IonicContact CZ-OE2 2.6Å; R237-E265 IonicContact NH1-OE1 3.96Å; R237-E265 PolarHBondContact NH1-OE1 3.15Å; R237-E265 IonicContact NH1-OE2 3.67Å; R237-E265 IonicContact NH2-OE1 3.59Å; R237-E265 PolarHBondContact NH2-OE1 2.95Å; R237-E265 IonicContact NH2-OE2 2.61Å; R237-E265 PolarHBondContact NH2-OE2 2.87Å
238	M	97.8	Very high	94.9	Very high	7 Å²	7	29.6 Å²	29.6	3%	0.034	18%	0.183	C	C	.	.	H	α-helix	trans	-65.7	-41	172.3	-71.8	-60	-59	0	0	112.2	L175 V234 R235 R236 M240 Q241 C257	L175-M238 HydrophobicContact CD2-CE 4.22Å; V234-M238 HydrophobicContact CG1-CG 4.36Å; V234-M238 WeakPolarHBondContact O-CB 3.32Å; V234-M238 VanDerWaalsContact O-CG 3.29Å; V234-M238 WeakPolarHBondContact O-CG 3.42Å; V234-M238 PolarHBondContact O-N 2.89Å; R235-M238 PolarHBondContact O-N 3.06Å; R236-M238 VanDerWaalsContact C-N 3.32Å; R236-M238 PolarHBondContact O-N 2.86Å; M238-M240 PolarHBondContact O-N 3.48Å; M238-Q241 WeakPolarHBondContact O-CB 3.47Å; M238-Q241 PolarHBondContact O-N 3.37Å; M238-C257 HydrophobicContact CG-CB 4.34Å; M238-C257 HydrophobicContact SD-CB 3.79Å
239	M	97.4	Very high	94.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.2	-30.4	174.9	-65.9	173.8	168.6	0	0	112.6	Y132 D135 F136 T139 R140 L175 R235 R236 Q241	Y132-M239 HydrophobicContact CD1-CE 4.5Å; Y132-M239 HydrophobicContact CE1-CE 3.67Å; Y132-M239 HydrophobicContact CE2-CE 3.96Å; Y132-M239 WeakPolarHBondContact OH-CE 3.16Å; D135-M239 HydrophobicContact CB-CE 4.32Å; F136-M239 HydrophobicContact CD2-CB 3.88Å; F136-M239 HydrophobicContact CD2-CG 3.98Å; F136-M239 HydrophobicContact CE2-CB 4.16Å; F136-M239 VanDerWaalsContact CE2-O 3.29Å; F136-M239 WeakPolarHBondContact CE2-O 3.48Å; T139-M239 HydrophobicContact CG2-SD 4.05Å; T139-M239 PolarHBondContact OG1-SD 2.86Å; T139-M239 VanDerWaalsContact OG1-SD 3.39Å; R140-M239 PolarHBondContact NH1-O 3.45Å; L175-M239 WeakPolarHBondContact O-CG 3.34Å; R235-M239 HydrophobicContact CG-CE 4.01Å; R235-M239 WeakPolarHBondContact O-CG 3.35Å; R235-M239 PolarHBondContact O-N 2.94Å; R235-M239 VanDerWaalsContact O-N 3.1Å; R236-M239 WeakPolarHBondContact O-CB 3.46Å; R236-M239 PolarHBondContact O-N 3.09Å; M239-Q241 PolarHBondContact O-N 3.46Å
240	M	96.8	Very high	94.4	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.02	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.5	177.3	-63.1	-51.1	-66.2	0	0	113.9	V38 A41 A143 R236 R237 M238 R244	V38-M240 HydrophobicContact CB-CG 3.88Å; V38-M240 HydrophobicContact CB-SD 4.32Å; V38-M240 HydrophobicContact CG1-CG 4.21Å; V38-M240 HydrophobicContact CG2-CE 4.45Å; V38-M240 HydrophobicContact CG2-CG 4.2Å; V38-M240 HydrophobicContact CG2-SD 3.98Å; A41-M240 HydrophobicContact CB-CB 4.25Å; A41-M240 HydrophobicContact CB-CG 4.43Å; A143-M240 HydrophobicContact CB-CE 3.62Å; A143-M240 HydrophobicContact CB-SD 3.84Å; R236-M240 WeakPolarHBondContact O-CG 3.3Å; R236-M240 PolarHBondContact O-N 2.96Å; R237-M240 PolarHBondContact O-N 3.34Å; M238-M240 PolarHBondContact O-N 3.48Å; M240-R244 PolarHBondContact O-NE 3.29Å
241	Q	95.9	Very high	94.2	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.037	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-21.5	-179.9	-54.7	-46	-64.7	0	0	113.5	L175 R237 M238 M239 R244 M250 Y251	L175-Q241 HydrophobicContact CD1-CB 4.2Å; R237-Q241 PolarHBondContact O-NE2 2.95Å; R237-Q241 VanDerWaalsContact O-NE2 3.11Å; M238-Q241 WeakPolarHBondContact O-CB 3.47Å; M238-Q241 PolarHBondContact O-N 3.37Å; M239-Q241 PolarHBondContact O-N 3.46Å; Q241-R244 VanDerWaalsContact O-CB 3.25Å; Q241-R244 WeakPolarHBondContact O-CB 3.11Å; Q241-R244 VanDerWaalsContact O-CG 3.3Å; Q241-R244 WeakPolarHBondContact O-CG 3.38Å; Q241-R244 PolarHBondContact O-N 3.27Å; Q241-R244 VanDerWaalsContact O-N 3.15Å; Q241-M250 VanDerWaalsContact NE2-CE 3.27Å; Q241-Y251 HydrophobicContact CG-CD2 3.92Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.29Å
242	S	94.4	Very high	93.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	139.7	-178.4	-37	0	0	0	0	111.4	F136 R140 D168 G172 L175 R244	F136-S242 VanDerWaalsContact CE2-OG 3.24Å; F136-S242 WeakPolarHBondContact CE2-OG 3.35Å; R140-S242 VanDerWaalsContact CZ-O 3.32Å; R140-S242 PolarHBondContact NH1-O 3.11Å; R140-S242 PolarHBondContact NH2-O 3.1Å; D168-S242 WeakPolarHBondContact OD2-CA 3.19Å; G172-S242 WeakPolarHBondContact O-CB 3.24Å; G172-S242 PolarHBondContact O-OG 3.35Å; L175-S242 WeakPolarHBondContact CD1-OG 3.32Å; S242-R244 PolarHBondContact O-N 2.98Å
243	G	91.7	Very high	93.8	Very high	31 Å²	31	40.9 Å²	40.9	32%	0.32	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	1	-174.6	0	0	0	0	0	113.9	D168	D168-G243 WeakPolarHBondContact OD1-CA 3.44Å; D168-G243 PolarHBondContact OD1-N 3.47Å; D168-G243 PolarHBondContact OD2-N 2.93Å
244	R	92.9	Very high	93.7	Very high	22 Å²	22	42.5 Å²	42.5	8%	0.083	25%	0.247	C	C	.	.			trans	-92	146.7	172.6	-55.1	-166.5	-177.9	-150.6	-7.7	110.6	A41 M240 Q241 S242 D248 I249	A41-R244 PolarHBondContact O-NH2 3.4Å; M240-R244 PolarHBondContact O-NE 3.29Å; Q241-R244 VanDerWaalsContact O-CB 3.25Å; Q241-R244 WeakPolarHBondContact O-CB 3.11Å; Q241-R244 VanDerWaalsContact O-CG 3.3Å; Q241-R244 WeakPolarHBondContact O-CG 3.38Å; Q241-R244 PolarHBondContact O-N 3.27Å; Q241-R244 VanDerWaalsContact O-N 3.15Å; S242-R244 PolarHBondContact O-N 2.98Å; R244-D248 HydrophobicContact CB-CB 4.15Å; R244-D248 WeakPolarHBondContact CD-O 3.23Å; R244-D248 PolarHBondContact NH1-O 3.3Å; R244-I249 HydrophobicContact CB-CG1 3.99Å
245	K	88.9	Confident	93.7	Very high	148 Å²	148	48.3 Å²	48.3	64%	0.643	28%	0.277	S	S	*	.			trans	-130.3	149.8	179.7	-62.5	-171.9	179.4	-175	0	110.6	A247 D248	K245-A247 PolarHBondContact O-N 3.19Å; K245-D248 PolarHBondContact O-N 3.21Å
246	G	87.1	Confident	93.6	Very high	62 Å²	62	49.1 Å²	49.1	64%	0.639	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	56.5	-128.3	172.9	0	0	0	0	0	113.5	D248 I249	G246-D248 PolarHBondContact O-N 3.39Å; G246-I249 PolarHBondContact O-N 3.47Å
247	A	83.6	Confident	93.6	Very high	107 Å²	107	48.4 Å²	48.4	88%	0.884	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-64.3	-18.3	-175.9	0	0	0	0	0	114.4	K245 I249	K245-A247 PolarHBondContact O-N 3.19Å; A247-I249 PolarHBondContact O-N 3.11Å
248	D	87.6	Confident	93.7	Very high	84 Å²	84	51.6 Å²	51.6	45%	0.449	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-74.6	-13.2	179.8	-70	-22.5	0	0	0	113.8	K43 R244 K245 G246 M250	K43-D248 VanDerWaalsContact NZ-CG 3.35Å; K43-D248 IonicContact NZ-OD2 2.67Å; K43-D248 PolarHBondContact NZ-OD2 3Å; R244-D248 HydrophobicContact CB-CB 4.15Å; R244-D248 WeakPolarHBondContact CD-O 3.23Å; R244-D248 PolarHBondContact NH1-O 3.3Å; K245-D248 PolarHBondContact O-N 3.21Å; G246-D248 PolarHBondContact O-N 3.39Å; D248-M250 PolarHBondContact O-N 3.37Å
249	I	91.8	Very high	93.7	Very high	71 Å²	71	58.1 Å²	58.1	36%	0.364	32%	0.321	S	S	.	.			trans	-76.7	108.6	179.8	-60.7	173.6	0	0	0	108.7	R244 G246 A247 Y251	R244-I249 HydrophobicContact CB-CG1 3.99Å; G246-I249 PolarHBondContact O-N 3.47Å; A247-I249 PolarHBondContact O-N 3.11Å; I249-Y251 WeakPolarHBondContact CG2-O 3.44Å
250	M	93.3	Very high	93.7	Very high	54 Å²	54	60.9 Å²	60.9	27%	0.266	33%	0.333	S	S	.	.			trans	-80.6	-31.7	178.8	-63.6	175.3	-58.1	0	0	112.1	A41 Q241 D248 K260	A41-M250 HydrophobicContact CB-CE 3.32Å; A41-M250 HydrophobicContact CB-SD 4.47Å; Q241-M250 VanDerWaalsContact NE2-CE 3.27Å; D248-M250 PolarHBondContact O-N 3.37Å; M250-K260 WeakPolarHBondContact O-CD 3.45Å; M250-K260 WeakPolarHBondContact O-CE 3.25Å; M250-K260 PolarHBondContact O-NZ 2.93Å
251	Y	94.8	Very high	93.7	Very high	10 Å²	10	60.7 Å²	60.7	4%	0.039	33%	0.332	C	S	.	.			trans	-126.9	118.3	-176.7	-46.6	-61.1	0	0	0	110.9	A41 R237 Q241 I249 G253 D256 C257 K260	A41-Y251 HydrophobicContact CB-CE2 4.23Å; R237-Y251 HydrophobicContact CB-CD2 4.26Å; R237-Y251 HydrophobicContact CB-CE2 3.75Å; R237-Y251 HydrophobicContact CG-CE2 4.45Å; R237-Y251 PolarHBondContact NH1-OH 3.29Å; Q241-Y251 HydrophobicContact CG-CD2 3.92Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.29Å; I249-Y251 WeakPolarHBondContact CG2-O 3.44Å; Y251-G253 VanDerWaalsContact C-N 3.3Å; Y251-D256 WeakPolarHBondContact CA-OD2 3.44Å; Y251-C257 HydrophobicContact CD1-CB 3.96Å; Y251-C257 HydrophobicContact CD2-CB 4.4Å; Y251-C257 HydrophobicContact CG-CB 3.84Å; Y251-K260 HydrophobicContact CD1-CB 4.07Å; Y251-K260 HydrophobicContact CD1-CD 3.87Å; Y251-K260 HydrophobicContact CE1-CB 3.81Å; Y251-K260 HydrophobicContact CE1-CD 4.23Å
252	K	91.9	Very high	93.7	Very high	188 Å²	188	65.3 Å²	65.3	82%	0.817	36%	0.356	S	S	*	.	S	Bend	trans	-76	-20.2	179.1	-64.4	-177.9	178.7	-179.1	0	112.8	D256	K252-D256 HydrophobicContact CB-CB 4.4Å; K252-D256 PolarHBondContact N-OD2 3.39Å
253	G	94.7	Very high	93.8	Very high	23 Å²	23	73.8 Å²	73.8	24%	0.237	39%	0.393	C	S	.	.	S	Bend	trans	-176.9	176.7	-178.5	0	0	0	0	0	111.8	Y251 I255 D256 C257	Y251-G253 VanDerWaalsContact C-N 3.3Å; G253-I255 PolarHBondContact O-N 3.1Å; G253-D256 PolarHBondContact O-N 3.39Å; G253-C257 WeakPolarHBondContact O-CB 3.29Å; G253-C257 PolarHBondContact O-N 3.17Å
254	T	96.4	Very high	94	Very high	34 Å²	34	77.1 Å²	77.1	21%	0.209	40%	0.403	C	S	.	.	H	α-helix	trans	-58.2	-45.8	-177.2	-60.7	0	0	0	0	112.6	V179 V234 C257 W258	V179-T254 HydrophobicContact CB-CG2 3.76Å; V179-T254 HydrophobicContact CG1-CG2 4.32Å; V179-T254 HydrophobicContact CG2-CG2 4.12Å; V234-T254 HydrophobicContact CG1-CG2 3.97Å; T254-C257 WeakPolarHBondContact O-CB 3.34Å; T254-C257 PolarHBondContact O-N 2.86Å; T254-W258 PolarHBondContact O-N 3.33Å
255	I	97.1	Very high	94	Very high	122 Å²	122	77.8 Å²	77.8	63%	0.626	41%	0.407	S	S	*	.	H	α-helix	trans	-65.7	-41	179.9	-61.5	172.3	0	0	0	111	G253 C257 W258 K259	G253-I255 PolarHBondContact O-N 3.1Å; I255-C257 VanDerWaalsContact C-N 3.3Å; I255-C257 PolarHBondContact O-N 2.99Å; I255-W258 PolarHBondContact O-N 3.42Å; I255-K259 HydrophobicContact CG2-CD 4.33Å; I255-K259 WeakPolarHBondContact O-CG 3.05Å; I255-K259 PolarHBondContact O-N 2.8Å
256	D	97.4	Very high	94.4	Very high	41 Å²	41	72 Å²	72	22%	0.219	39%	0.391	C	S	.	.	H	α-helix	trans	-61.7	-40	174.3	-174.1	49.6	0	0	0	111	Y251 K252 G253 K259 K260	Y251-D256 WeakPolarHBondContact CA-OD2 3.44Å; K252-D256 HydrophobicContact CB-CB 4.4Å; K252-D256 PolarHBondContact N-OD2 3.39Å; G253-D256 PolarHBondContact O-N 3.39Å; D256-K259 PolarHBondContact O-N 3.4Å; D256-K260 WeakPolarHBondContact O-CB 3.44Å; D256-K260 WeakPolarHBondContact O-CG 3.45Å; D256-K260 PolarHBondContact O-N 3.49Å; D256-K260 VanDerWaalsContact OD1-CE 3.31Å; D256-K260 WeakPolarHBondContact OD1-CE 3.46Å; D256-K260 IonicContact OD1-NZ 2.72Å; D256-K260 PolarHBondContact OD1-NZ 3.22Å; D256-K260 WeakPolarHBondContact OD2-CE 3.18Å; D256-K260 IonicContact OD2-NZ 3.41Å; D256-K260 PolarHBondContact OD2-NZ 3.32Å
257	C	97.6	Very high	94.7	Very high	0 Å²	0	71 Å²	71	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-62.4	-44.7	175.2	-168.8	0	0	0	0	112.6	V234 M238 Y251 G253 T254 I255 I261	V234-C257 HydrophobicContact CG1-CB 3.96Å; M238-C257 HydrophobicContact CG-CB 4.34Å; M238-C257 HydrophobicContact SD-CB 3.79Å; Y251-C257 HydrophobicContact CD1-CB 3.96Å; Y251-C257 HydrophobicContact CD2-CB 4.4Å; Y251-C257 HydrophobicContact CG-CB 3.84Å; G253-C257 WeakPolarHBondContact O-CB 3.29Å; G253-C257 PolarHBondContact O-N 3.17Å; T254-C257 WeakPolarHBondContact O-CB 3.34Å; T254-C257 PolarHBondContact O-N 2.86Å; I255-C257 VanDerWaalsContact C-N 3.3Å; I255-C257 PolarHBondContact O-N 2.99Å; C257-I261 WeakPolarHBondContact O-CB 3.33Å; C257-I261 WeakPolarHBondContact O-CD1 3.48Å; C257-I261 WeakPolarHBondContact O-CG1 3.15Å; C257-I261 PolarHBondContact O-N 3.35Å
258	W	98.1	Very high	95.3	Very high	68 Å²	68	76.8 Å²	76.8	26%	0.258	38%	0.378	S	S	.	.	H	α-helix	trans	-58.3	-49.4	174	-78.8	107	0	0	0	111.5	V179 P230 F231 V234 T254 I255 L262 F270	V179-W258 HydrophobicContact CG2-CZ2 4.3Å; P230-W258 HydrophobicContact CB-CH2 3.52Å; P230-W258 HydrophobicContact CB-CZ3 3.74Å; F231-W258 HydrophobicContact CD1-CZ2 4.01Å; F231-W258 HydrophobicContact CD2-CH2 4.42Å; F231-W258 HydrophobicContact CE1-CZ2 4.2Å; F231-W258 HydrophobicContact CG-CH2 4.44Å; F231-W258 HydrophobicContact CG-CZ2 4.18Å; V234-W258 HydrophobicContact CB-CZ2 4.31Å; V234-W258 HydrophobicContact CG2-CD2 3.62Å; V234-W258 HydrophobicContact CG2-CE3 3.92Å; V234-W258 HydrophobicContact CG2-CG 4.08Å; V234-W258 HydrophobicContact CG2-CH2 4.19Å; V234-W258 HydrophobicContact CG2-CZ2 3.91Å; V234-W258 HydrophobicContact CG2-CZ3 4.19Å; T254-W258 PolarHBondContact O-N 3.33Å; I255-W258 PolarHBondContact O-N 3.42Å; W258-L262 WeakPolarHBondContact O-CB 3.24Å; W258-L262 PolarHBondContact O-N 3.22Å; W258-L262 VanDerWaalsContact O-N 3.12Å; W258-F270 HydrophobicContact CD2-CE1 4.16Å; W258-F270 AromaticContact CE3-CD1 3.98Å; W258-F270 HydrophobicContact CE3-CD1 3.98Å; W258-F270 AromaticContact CE3-CE1 3.2Å; W258-F270 HydrophobicContact CE3-CE1 3.2Å; W258-F270 HydrophobicContact CE3-CE2 4.35Å; W258-F270 AromaticContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CE3-CZ 3.44Å; W258-F270 VanDerWaalsContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CH2-CE1 4.47Å; W258-F270 AromaticContact CZ3-CD1 3.67Å; W258-F270 HydrophobicContact CZ3-CD1 3.67Å; W258-F270 AromaticContact CZ3-CE1 3.4Å; W258-F270 HydrophobicContact CZ3-CE1 3.4Å; W258-F270 HydrophobicContact CZ3-CE2 4.48Å; W258-F270 HydrophobicContact CZ3-CG 4.34Å; W258-F270 AromaticContact CZ3-CZ 3.86Å; W258-F270 HydrophobicContact CZ3-CZ 3.86Å
259	K	97.8	Very high	95.6	Very high	143 Å²	143	72.8 Å²	72.8	62%	0.622	36%	0.357	S	S	*	.	H	α-helix	trans	-62.3	-47.4	-178.2	-72.4	-179.7	179	-174.7	0	112	I255 D256 L262 K263	I255-K259 HydrophobicContact CG2-CD 4.33Å; I255-K259 WeakPolarHBondContact O-CG 3.05Å; I255-K259 PolarHBondContact O-N 2.8Å; D256-K259 PolarHBondContact O-N 3.4Å; K259-L262 PolarHBondContact O-N 3.46Å; K259-K263 VanDerWaalsContact O-CB 3.28Å; K259-K263 WeakPolarHBondContact O-CB 3.21Å; K259-K263 PolarHBondContact O-N 3.48Å
260	K	97.4	Very high	95.9	Very high	58 Å²	58	70.1 Å²	70.1	25%	0.252	34%	0.343	S	S	.	.	H	α-helix	trans	-67	-42.1	-179	-77.6	175.1	172.3	164.3	0	112.8	M250 Y251 D256 L262 K263 D264	M250-K260 WeakPolarHBondContact O-CD 3.45Å; M250-K260 WeakPolarHBondContact O-CE 3.25Å; M250-K260 PolarHBondContact O-NZ 2.93Å; Y251-K260 HydrophobicContact CD1-CB 4.07Å; Y251-K260 HydrophobicContact CD1-CD 3.87Å; Y251-K260 HydrophobicContact CE1-CB 3.81Å; Y251-K260 HydrophobicContact CE1-CD 4.23Å; D256-K260 WeakPolarHBondContact O-CB 3.44Å; D256-K260 WeakPolarHBondContact O-CG 3.45Å; D256-K260 PolarHBondContact O-N 3.49Å; D256-K260 VanDerWaalsContact OD1-CE 3.31Å; D256-K260 WeakPolarHBondContact OD1-CE 3.46Å; D256-K260 IonicContact OD1-NZ 2.72Å; D256-K260 PolarHBondContact OD1-NZ 3.22Å; D256-K260 WeakPolarHBondContact OD2-CE 3.18Å; D256-K260 IonicContact OD2-NZ 3.41Å; D256-K260 PolarHBondContact OD2-NZ 3.32Å; K260-L262 VanDerWaalsContact C-N 3.3Å; K260-L262 PolarHBondContact O-N 2.94Å; K260-K263 PolarHBondContact O-N 3.44Å; K260-D264 WeakPolarHBondContact O-CB 3.41Å; K260-D264 VanDerWaalsContact O-CG 3.25Å; K260-D264 PolarHBondContact O-N 2.89Å
261	I	96.8	Very high	96.1	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.35	C	S	.	.	I	π-helix	trans	-59.5	-45.9	174.6	-67.3	167.3	0	0	0	110.3	V234 R237 C257 E265 G266 A269 F270	V234-I261 HydrophobicContact CG2-CD1 3.91Å; R237-I261 HydrophobicContact CG-CD1 4.07Å; C257-I261 WeakPolarHBondContact O-CB 3.33Å; C257-I261 WeakPolarHBondContact O-CD1 3.48Å; C257-I261 WeakPolarHBondContact O-CG1 3.15Å; C257-I261 PolarHBondContact O-N 3.35Å; I261-E265 CarbonylContact O-C 3.42Å; I261-E265 WeakPolarHBondContact O-CA 3.17Å; I261-E265 WeakPolarHBondContact O-CB 3.37Å; I261-E265 PolarHBondContact O-N 3.3Å; I261-G266 PolarHBondContact O-N 2.69Å; I261-G266 VanDerWaalsContact O-N 3.09Å; I261-A269 HydrophobicContact CG2-CB 3.76Å; I261-F270 HydrophobicContact CB-CE1 3.82Å; I261-F270 HydrophobicContact CB-CZ 3.81Å; I261-F270 HydrophobicContact CD1-CD1 4.47Å; I261-F270 HydrophobicContact CD1-CE1 3.97Å; I261-F270 HydrophobicContact CG2-CD1 3.89Å; I261-F270 HydrophobicContact CG2-CD2 4.29Å; I261-F270 HydrophobicContact CG2-CE1 3.56Å; I261-F270 HydrophobicContact CG2-CE2 3.99Å; I261-F270 HydrophobicContact CG2-CG 4.22Å; I261-F270 HydrophobicContact CG2-CZ 3.61Å
262	L	96.9	Very high	96.1	Very high	105 Å²	105	74.6 Å²	74.6	55%	0.55	36%	0.361	S	S	.	.	I	π-helix	trans	-65.2	-41.6	-179.8	-177.1	61.1	0	0	0	112.4	W258 K259 K260 G266 F270	W258-L262 WeakPolarHBondContact O-CB 3.24Å; W258-L262 PolarHBondContact O-N 3.22Å; W258-L262 VanDerWaalsContact O-N 3.12Å; K259-L262 PolarHBondContact O-N 3.46Å; K260-L262 VanDerWaalsContact C-N 3.3Å; K260-L262 PolarHBondContact O-N 2.94Å; L262-G266 VanDerWaalsContact O-CA 3.29Å; L262-G266 WeakPolarHBondContact O-CA 3.14Å; L262-G266 PolarHBondContact O-N 3.09Å; L262-F270 HydrophobicContact CB-CE2 4.19Å; L262-F270 HydrophobicContact CB-CZ 4.34Å; L262-F270 HydrophobicContact CD1-CE2 4.38Å
263	K	96.6	Very high	96.1	Very high	179 Å²	179	66.1 Å²	66.1	78%	0.778	33%	0.327	S	S	*	.	I	π-helix	trans	-74.6	-45.3	-177.9	-173.3	-176	176.9	-174.2	0	112.8	K259 K260	K259-K263 VanDerWaalsContact O-CB 3.28Å; K259-K263 WeakPolarHBondContact O-CB 3.21Å; K259-K263 PolarHBondContact O-N 3.48Å; K260-K263 PolarHBondContact O-N 3.44Å
264	D	94.9	Very high	96.1	Very high	100 Å²	100	65.3 Å²	65.3	54%	0.535	32%	0.319	S	S	.	.	I	π-helix	trans	-95.4	-27.1	-166.9	-51.7	-27.5	0	0	0	112.2	K260	K260-D264 WeakPolarHBondContact O-CB 3.41Å; K260-D264 VanDerWaalsContact O-CG 3.25Å; K260-D264 PolarHBondContact O-N 2.89Å
265	E	94.3	Very high	96	Very high	36 Å²	36	72.1 Å²	72.1	17%	0.168	34%	0.34	C	S	.	.	I	π-helix	trans	-121	-12	-178.9	-58.7	173.9	-102	0	0	114.2	H40 R237 I261 A269 K272	H40-E265 IonicContact CD2-OE1 2.81Å; H40-E265 PolarHBondContact CD2-OE1 3.31Å; H40-E265 VanDerWaalsContact CD2-OE1 3.3Å; H40-E265 IonicContact CD2-OE2 3.19Å; H40-E265 IonicContact CG-OE1 3.82Å; H40-E265 IonicContact CG-OE2 3.1Å; H40-E265 IonicContact ND1-OE2 2.73Å; H40-E265 IonicContact NE2-OE1 3.93Å; R237-E265 IonicContact CZ-OE1 2.92Å; R237-E265 IonicContact CZ-OE2 2.6Å; R237-E265 IonicContact NH1-OE1 3.96Å; R237-E265 PolarHBondContact NH1-OE1 3.15Å; R237-E265 IonicContact NH1-OE2 3.67Å; R237-E265 IonicContact NH2-OE1 3.59Å; R237-E265 PolarHBondContact NH2-OE1 2.95Å; R237-E265 IonicContact NH2-OE2 2.61Å; R237-E265 PolarHBondContact NH2-OE2 2.87Å; I261-E265 CarbonylContact O-C 3.42Å; I261-E265 WeakPolarHBondContact O-CA 3.17Å; I261-E265 WeakPolarHBondContact O-CB 3.37Å; I261-E265 PolarHBondContact O-N 3.3Å; E265-A269 HydrophobicContact CB-CB 3.31Å; E265-A269 HydrophobicContact CG-CB 4.32Å; E265-K272 IonicContact OE2-NZ 3.75Å; E265-K272 PolarHBondContact OE2-NZ 3.09Å
266	G	95.6	Very high	95.8	Very high	28 Å²	28	66.3 Å²	66.3	29%	0.289	31%	0.311	S	S	.	.			trans	80.3	167.1	-177.9	0	0	0	0	0	114.9	I261 L262 R268 A269	I261-G266 PolarHBondContact O-N 2.69Å; I261-G266 VanDerWaalsContact O-N 3.09Å; L262-G266 VanDerWaalsContact O-CA 3.29Å; L262-G266 WeakPolarHBondContact O-CA 3.14Å; L262-G266 PolarHBondContact O-N 3.09Å; G266-R268 VanDerWaalsContact C-N 3.25Å; G266-R268 PolarHBondContact O-N 3.15Å; G266-R268 VanDerWaalsContact O-N 3.15Å; G266-A269 WeakPolarHBondContact O-CB 3.4Å; G266-A269 PolarHBondContact O-N 2.94Å
267	G	94.5	Very high	95.6	Very high	39 Å²	39	65.5 Å²	65.5	40%	0.402	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-61.6	-26.2	-174.2	0	0	0	0	0	115.2	A269 F270	G267-A269 PolarHBondContact O-N 3.28Å; G267-F270 WeakPolarHBondContact O-CD2 3.39Å
268	R	95.3	Very high	95.4	Very high	229 Å²	229	66.1 Å²	66.1	86%	0.864	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-68.7	-21.9	175.9	-66.7	-177.4	-179.8	176.5	0.3	112.6	G266 F270 F271	G266-R268 VanDerWaalsContact C-N 3.25Å; G266-R268 PolarHBondContact O-N 3.15Å; G266-R268 VanDerWaalsContact O-N 3.15Å; R268-F270 PolarHBondContact O-N 3Å; R268-F271 PolarHBondContact O-N 3.45Å
269	A	95.4	Very high	95.2	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.008	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-64.7	-28	-177.9	0	0	0	0	0	113.3	I261 E265 G266 G267 F271 K272	I261-A269 HydrophobicContact CG2-CB 3.76Å; E265-A269 HydrophobicContact CB-CB 3.31Å; E265-A269 HydrophobicContact CG-CB 4.32Å; G266-A269 WeakPolarHBondContact O-CB 3.4Å; G266-A269 PolarHBondContact O-N 2.94Å; G267-A269 PolarHBondContact O-N 3.28Å; A269-F271 PolarHBondContact O-N 3.29Å; A269-F271 VanDerWaalsContact O-N 3.13Å; A269-K272 HydrophobicContact CB-CD 4.39Å; A269-K272 WeakPolarHBondContact O-CG 3.13Å; A269-K272 PolarHBondContact O-N 2.82Å
270	F	97.1	Very high	95	Very high	15 Å²	15	61.7 Å²	61.7	7%	0.066	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-58.9	-23.9	173	-69	-66.5	0	0	0	112.9	Y229 P230 T233 V234 W258 I261 L262 G267 R268	Y229-F270 WeakPolarHBondContact CD1-O 3.46Å; Y229-F270 WeakPolarHBondContact CE1-O 3.35Å; P230-F270 HydrophobicContact CB-CB 3.87Å; P230-F270 HydrophobicContact CB-CD1 4.13Å; P230-F270 HydrophobicContact CB-CG 4.13Å; P230-F270 HydrophobicContact CG-CB 4.02Å; T233-F270 WeakPolarHBondContact CB-O 3.08Å; T233-F270 PolarHBondContact OG1-O 3.02Å; V234-F270 HydrophobicContact CG2-CD1 4.23Å; V234-F270 HydrophobicContact CG2-CE1 3.82Å; W258-F270 HydrophobicContact CD2-CE1 4.16Å; W258-F270 AromaticContact CE3-CD1 3.98Å; W258-F270 HydrophobicContact CE3-CD1 3.98Å; W258-F270 AromaticContact CE3-CE1 3.2Å; W258-F270 HydrophobicContact CE3-CE1 3.2Å; W258-F270 HydrophobicContact CE3-CE2 4.35Å; W258-F270 AromaticContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CE3-CZ 3.44Å; W258-F270 VanDerWaalsContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CH2-CE1 4.47Å; W258-F270 AromaticContact CZ3-CD1 3.67Å; W258-F270 HydrophobicContact CZ3-CD1 3.67Å; W258-F270 AromaticContact CZ3-CE1 3.4Å; W258-F270 HydrophobicContact CZ3-CE1 3.4Å; W258-F270 HydrophobicContact CZ3-CE2 4.48Å; W258-F270 HydrophobicContact CZ3-CG 4.34Å; W258-F270 AromaticContact CZ3-CZ 3.86Å; W258-F270 HydrophobicContact CZ3-CZ 3.86Å; I261-F270 HydrophobicContact CB-CE1 3.82Å; I261-F270 HydrophobicContact CB-CZ 3.81Å; I261-F270 HydrophobicContact CD1-CD1 4.47Å; I261-F270 HydrophobicContact CD1-CE1 3.97Å; I261-F270 HydrophobicContact CG2-CD1 3.89Å; I261-F270 HydrophobicContact CG2-CD2 4.29Å; I261-F270 HydrophobicContact CG2-CE1 3.56Å; I261-F270 HydrophobicContact CG2-CE2 3.99Å; I261-F270 HydrophobicContact CG2-CG 4.22Å; I261-F270 HydrophobicContact CG2-CZ 3.61Å; L262-F270 HydrophobicContact CB-CE2 4.19Å; L262-F270 HydrophobicContact CB-CZ 4.34Å; L262-F270 HydrophobicContact CD1-CE2 4.38Å; G267-F270 WeakPolarHBondContact O-CD2 3.39Å; R268-F270 PolarHBondContact O-N 3Å
271	F	97.3	Very high	94.6	Very high	94 Å²	94	60 Å²	60	41%	0.412	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-104	12.1	-177	-60.8	-86.4	0	0	0	113.7	L226 Y229 P230 R268 A269 G273 A274	L226-F271 WeakPolarHBondContact O-CE1 3.3Å; Y229-F271 HydrophobicContact CD1-CD1 4.32Å; P230-F271 HydrophobicContact CG-CE1 3.97Å; P230-F271 HydrophobicContact CG-CE2 4.1Å; P230-F271 HydrophobicContact CG-CZ 3.61Å; R268-F271 PolarHBondContact O-N 3.45Å; A269-F271 PolarHBondContact O-N 3.29Å; A269-F271 VanDerWaalsContact O-N 3.13Å; F271-G273 PolarHBondContact O-N 3.48Å; F271-G273 VanDerWaalsContact O-N 3.11Å; F271-A274 HydrophobicContact CB-CB 4.01Å; F271-A274 HydrophobicContact CD1-CB 4.27Å; F271-A274 WeakPolarHBondContact O-CB 3.23Å; F271-A274 PolarHBondContact O-N 3.49Å
272	K	94.3	Very high	94.3	Very high	63 Å²	63	63.8 Å²	63.8	27%	0.274	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	117.8	172.9	-76	176.9	178.5	179.6	0	110.3	L36 Q37 Y229 E265 A269	L36-K272 WeakPolarHBondContact O-CB 3.15Å; Q37-K272 WeakPolarHBondContact CB-O 3.44Å; Y229-K272 WeakPolarHBondContact CE1-O 3.32Å; Y229-K272 PolarHBondContact OH-O 3.18Å; E265-K272 IonicContact OE2-NZ 3.75Å; E265-K272 PolarHBondContact OE2-NZ 3.09Å; A269-K272 HydrophobicContact CB-CD 4.39Å; A269-K272 WeakPolarHBondContact O-CG 3.13Å; A269-K272 PolarHBondContact O-N 2.82Å
273	G	92.8	Very high	93.8	Very high	10 Å²	10	60 Å²	60	10%	0.103	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	2	-175.5	0	0	0	0	0	115.5	Y229 F271 W275 S276 N277	Y229-G273 WeakPolarHBondContact OH-CA 3.44Å; Y229-G273 PolarHBondContact OH-O 2.84Å; F271-G273 PolarHBondContact O-N 3.48Å; F271-G273 VanDerWaalsContact O-N 3.11Å; G273-W275 VanDerWaalsContact C-N 3.31Å; G273-W275 PolarHBondContact O-N 2.9Å; G273-S276 WeakPolarHBondContact O-CB 3.4Å; G273-S276 PolarHBondContact O-N 2.89Å; G273-S276 VanDerWaalsContact O-N 3.14Å; G273-N277 PolarHBondContact O-N 3.24Å
274	A	94.6	Very high	93.2	Very high	7 Å²	7	51.9 Å²	51.9	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-42.7	-178.7	0	0	0	0	0	112.3	L226 Y229 F271 N277 V278	L226-A274 HydrophobicContact CD2-CB 3.87Å; Y229-A274 HydrophobicContact CD1-CB 3.81Å; Y229-A274 HydrophobicContact CD2-CB 4.3Å; Y229-A274 HydrophobicContact CE1-CB 3.81Å; Y229-A274 HydrophobicContact CE2-CB 4.3Å; Y229-A274 HydrophobicContact CG-CB 4.07Å; Y229-A274 VanDerWaalsContact CZ-CA 3.49Å; Y229-A274 PolarHBondContact OH-N 3.09Å; F271-A274 HydrophobicContact CB-CB 4.01Å; F271-A274 HydrophobicContact CD1-CB 4.27Å; F271-A274 WeakPolarHBondContact O-CB 3.23Å; F271-A274 PolarHBondContact O-N 3.49Å; A274-N277 VanDerWaalsContact O-CB 3.31Å; A274-N277 WeakPolarHBondContact O-CB 3.28Å; A274-N277 PolarHBondContact O-N 3.46Å; A274-N277 VanDerWaalsContact O-N 3.15Å; A274-V278 PolarHBondContact O-N 3.47Å
275	W	94.6	Very high	92.8	Very high	176 Å²	176	48.1 Å²	48.1	67%	0.667	25%	0.248	S	C	*	.	H	α-helix	trans	-63.5	-44.2	175.6	-173.5	-122.2	0	0	0	112.6	G273 N277 V278 I279	G273-W275 VanDerWaalsContact C-N 3.31Å; G273-W275 PolarHBondContact O-N 2.9Å; W275-N277 PolarHBondContact O-N 3.47Å; W275-V278 HydrophobicContact CE3-CB 4.3Å; W275-V278 HydrophobicContact CE3-CG1 4.5Å; W275-V278 HydrophobicContact CZ3-CG1 4.23Å; W275-V278 WeakPolarHBondContact O-CB 3.28Å; W275-V278 PolarHBondContact O-N 2.6Å; W275-V278 VanDerWaalsContact O-N 3.09Å; W275-I279 PolarHBondContact O-N 3.45Å
276	S	92.6	Very high	92.5	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-58.4	-35.8	173.2	-46.2	0	0	0	0	111.8	I54 G273 R280	I54-S276 WeakPolarHBondContact CD1-OG 3.14Å; I54-S276 VanDerWaalsContact CG1-OG 3.28Å; I54-S276 WeakPolarHBondContact CG1-OG 3.32Å; G273-S276 WeakPolarHBondContact O-CB 3.4Å; G273-S276 PolarHBondContact O-N 2.89Å; G273-S276 VanDerWaalsContact O-N 3.14Å; S276-R280 VanDerWaalsContact O-CB 3.23Å; S276-R280 WeakPolarHBondContact O-CB 3.48Å; S276-R280 PolarHBondContact O-N 3.04Å
277	N	93.1	Very high	91.8	Very high	23 Å²	23	51.8 Å²	51.8	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-36.7	176.5	-174.6	73.2	0	0	0	112.9	K33 Y229 G273 A274 W275 G281	K33-N277 HydrophobicContact CD-CB 3.77Å; K33-N277 WeakPolarHBondContact CE-OD1 3.43Å; K33-N277 HydrophobicContact CG-CB 4.02Å; K33-N277 PolarHBondContact NZ-OD1 2.9Å; Y229-N277 HydrophobicContact CD2-CB 4.33Å; Y229-N277 HydrophobicContact CE2-CB 3.6Å; G273-N277 PolarHBondContact O-N 3.24Å; A274-N277 VanDerWaalsContact O-CB 3.31Å; A274-N277 WeakPolarHBondContact O-CB 3.28Å; A274-N277 PolarHBondContact O-N 3.46Å; A274-N277 VanDerWaalsContact O-N 3.15Å; W275-N277 PolarHBondContact O-N 3.47Å; N277-G281 PolarHBondContact O-N 3.47Å
278	V	94.1	Very high	91.2	Very high	14 Å²	14	53.1 Å²	53.1	9%	0.085	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-51.8	174	174.1	0	0	0	0	110.1	A222 L226 A274 W275 R280 G281 M282	A222-V278 HydrophobicContact CB-CG1 4.14Å; A222-V278 HydrophobicContact CB-CG2 4.32Å; L226-V278 HydrophobicContact CD2-CG2 4.29Å; L226-V278 HydrophobicContact CG-CG2 4.38Å; A274-V278 PolarHBondContact O-N 3.47Å; W275-V278 HydrophobicContact CE3-CB 4.3Å; W275-V278 HydrophobicContact CE3-CG1 4.5Å; W275-V278 HydrophobicContact CZ3-CG1 4.23Å; W275-V278 WeakPolarHBondContact O-CB 3.28Å; W275-V278 PolarHBondContact O-N 2.6Å; W275-V278 VanDerWaalsContact O-N 3.09Å; V278-R280 VanDerWaalsContact C-N 3.29Å; V278-R280 PolarHBondContact O-N 2.89Å; V278-G281 WeakPolarHBondContact O-CA 3.3Å; V278-G281 PolarHBondContact O-N 2.78Å; V278-M282 HydrophobicContact CG1-CG 4.47Å; V278-M282 HydrophobicContact CG1-SD 3.91Å; V278-M282 WeakPolarHBondContact O-CG 3.18Å; V278-M282 PolarHBondContact O-N 3.34Å
279	I	93.5	Very high	90.6	Very high	68 Å²	68	45.1 Å²	45.1	35%	0.349	23%	0.232	S	C	.	.	H	α-helix	trans	-55.5	-46.8	177.1	-63.6	170.2	0	0	0	110.6	I29 I54 W275 G281 M282 G283	I29-I279 HydrophobicContact CG1-CB 4.32Å; I29-I279 HydrophobicContact CG1-CG2 4.07Å; I54-I279 HydrophobicContact CD1-CD1 4.24Å; W275-I279 PolarHBondContact O-N 3.45Å; I279-G281 VanDerWaalsContact C-N 3.32Å; I279-G281 PolarHBondContact O-N 3.49Å; I279-M282 PolarHBondContact O-N 2.98Å; I279-G283 PolarHBondContact O-N 3.2Å
280	R	93.1	Very high	89.8	Confident	49 Å²	49	48.8 Å²	48.8	19%	0.185	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-41.1	176.8	-177.5	-141.9	60	130.3	5.9	112.2	V26 I29 E30 S276 V278 G284	V26-R280 HydrophobicContact CB-CG 4.02Å; V26-R280 HydrophobicContact CG2-CG 3.84Å; I29-R280 HydrophobicContact CG2-CB 3.84Å; I29-R280 HydrophobicContact CG2-CG 4.1Å; E30-R280 HydrophobicContact CB-CG 3.97Å; E30-R280 HydrophobicContact CG-CG 4.41Å; E30-R280 WeakPolarHBondContact OE1-CD 3.29Å; E30-R280 IonicContact OE1-CZ 2.75Å; E30-R280 IonicContact OE1-NE 3.87Å; E30-R280 IonicContact OE1-NH1 3.92Å; E30-R280 PolarHBondContact OE1-NH1 3.31Å; S276-R280 VanDerWaalsContact O-CB 3.23Å; S276-R280 WeakPolarHBondContact O-CB 3.48Å; S276-R280 PolarHBondContact O-N 3.04Å; V278-R280 VanDerWaalsContact C-N 3.29Å; V278-R280 PolarHBondContact O-N 2.89Å; R280-G284 PolarHBondContact O-N 2.92Å
281	G	88.9	Confident	88.8	Confident	22 Å²	22	50.9 Å²	50.9	23%	0.227	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-51.9	177.4	0	0	0	0	0	112	N277 V278 I279 G284 A285	N277-G281 PolarHBondContact O-N 3.47Å; V278-G281 WeakPolarHBondContact O-CA 3.3Å; V278-G281 PolarHBondContact O-N 2.78Å; I279-G281 VanDerWaalsContact C-N 3.32Å; I279-G281 PolarHBondContact O-N 3.49Å; G281-G284 PolarHBondContact O-N 2.98Å; G281-A285 PolarHBondContact O-N 3.47Å; G281-A285 VanDerWaalsContact O-N 3.11Å
282	M	90.9	Very high	87.8	Confident	81 Å²	81	50.5 Å²	50.5	40%	0.399	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-45.5	179.8	-64.9	175.9	72	0	0	111.8	V278 I279 G284 A285 F286	V278-M282 HydrophobicContact CG1-CG 4.47Å; V278-M282 HydrophobicContact CG1-SD 3.91Å; V278-M282 WeakPolarHBondContact O-CG 3.18Å; V278-M282 PolarHBondContact O-N 3.34Å; I279-M282 PolarHBondContact O-N 2.98Å; M282-G284 VanDerWaalsContact C-N 3.32Å; M282-G284 PolarHBondContact O-N 3.28Å; M282-A285 PolarHBondContact O-N 3.33Å; M282-F286 WeakPolarHBondContact O-CB 3.31Å; M282-F286 PolarHBondContact O-N 2.93Å
283	G	87.7	Confident	87	Confident	25 Å²	25	51 Å²	51	26%	0.258	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-39.1	176.6	0	0	0	0	0	112.4	I279 A285 F286 V287	I279-G283 PolarHBondContact O-N 3.2Å; G283-A285 PolarHBondContact O-N 2.98Å; G283-F286 PolarHBondContact O-N 3.25Å; G283-V287 VanDerWaalsContact O-CG2 3.27Å; G283-V287 WeakPolarHBondContact O-CG2 3.2Å; G283-V287 PolarHBondContact O-N 2.9Å
284	G	83.1	Confident	86	Confident	9 Å²	9	55.6 Å²	55.6	9%	0.093	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-40.6	178.2	0	0	0	0	0	112.2	S22 R280 G281 M282 L288	S22-G284 PolarHBondContact OG-O 3.01Å; R280-G284 PolarHBondContact O-N 2.92Å; G281-G284 PolarHBondContact O-N 2.98Å; M282-G284 VanDerWaalsContact C-N 3.32Å; M282-G284 PolarHBondContact O-N 3.28Å; G284-L288 WeakPolarHBondContact O-CG 3.17Å; G284-L288 PolarHBondContact O-N 3.19Å
285	A	87.3	Confident	84.8	Confident	21 Å²	21	59.9 Å²	59.9	17%	0.174	30%	0.303	C	S	.	.	H	α-helix	trans	-66.9	-42	174.4	0	0	0	0	0	111.9	Q218 G281 M282 G283 V287 L288 V289	Q218-A285 VanDerWaalsContact NE2-CB 3.31Å; G281-A285 PolarHBondContact O-N 3.47Å; G281-A285 VanDerWaalsContact O-N 3.11Å; M282-A285 PolarHBondContact O-N 3.33Å; G283-A285 PolarHBondContact O-N 2.98Å; A285-V287 PolarHBondContact O-N 3.14Å; A285-L288 PolarHBondContact O-N 3.41Å; A285-V289 WeakPolarHBondContact O-CG2 3.25Å; A285-V289 PolarHBondContact O-N 3.42Å; A285-V289 VanDerWaalsContact O-N 3.12Å
286	F	86.8	Confident	83.8	Confident	109 Å²	109	57.6 Å²	57.6	48%	0.478	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-43.2	177.3	-178.6	-111.9	0	0	0	112.4	M282 G283 L288 V289 L290	M282-F286 WeakPolarHBondContact O-CB 3.31Å; M282-F286 PolarHBondContact O-N 2.93Å; G283-F286 PolarHBondContact O-N 3.25Å; F286-L288 VanDerWaalsContact C-N 3.29Å; F286-L288 PolarHBondContact O-N 3.3Å; F286-V289 PolarHBondContact O-N 2.63Å; F286-L290 HydrophobicContact CD1-CD1 3.81Å; F286-L290 HydrophobicContact CD1-CG 4.38Å; F286-L290 HydrophobicContact CE1-CD1 3.3Å; F286-L290 HydrophobicContact CE1-CG 4.02Å; F286-L290 HydrophobicContact CE2-CD1 4.4Å; F286-L290 HydrophobicContact CE2-CD2 4.45Å; F286-L290 HydrophobicContact CE2-CG 4.26Å; F286-L290 HydrophobicContact CZ-CD1 3.64Å; F286-L290 HydrophobicContact CZ-CD2 4.12Å; F286-L290 HydrophobicContact CZ-CG 3.94Å; F286-L290 PolarHBondContact O-N 3.26Å
287	V	82.2	Confident	82.6	Confident	32 Å²	32	66 Å²	66	19%	0.194	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-35.9	177	173.5	0	0	0	0	112	I21 A25 G283 A285 Y291	I21-V287 HydrophobicContact CG2-CG1 4.17Å; A25-V287 HydrophobicContact CB-CG1 4.14Å; A25-V287 HydrophobicContact CB-CG2 3.85Å; G283-V287 VanDerWaalsContact O-CG2 3.27Å; G283-V287 WeakPolarHBondContact O-CG2 3.2Å; G283-V287 PolarHBondContact O-N 2.9Å; A285-V287 PolarHBondContact O-N 3.14Å; V287-Y291 WeakPolarHBondContact O-CB 3.06Å; V287-Y291 PolarHBondContact O-N 3.39Å
288	L	80.2	Confident	81	Confident	67 Å²	67	70.3 Å²	70.3	35%	0.351	36%	0.362	S	S	.	.	H	α-helix	trans	-66.7	-43.6	175.6	-70.8	172.3	0	0	0	111.6	A18 G284 A285 F286 L290 Y291 D292	A18-L288 HydrophobicContact CB-CD2 4.14Å; G284-L288 WeakPolarHBondContact O-CG 3.17Å; G284-L288 PolarHBondContact O-N 3.19Å; A285-L288 PolarHBondContact O-N 3.41Å; F286-L288 VanDerWaalsContact C-N 3.29Å; F286-L288 PolarHBondContact O-N 3.3Å; L288-L290 PolarHBondContact O-N 3.18Å; L288-Y291 PolarHBondContact O-N 3.05Å; L288-D292 PolarHBondContact O-N 2.92Å
289	V	82.9	Confident	78.7	Confident	61 Å²	61	80.9 Å²	80.9	37%	0.37	41%	0.407	S	S	.	.	H	α-helix	trans	-60.4	-47.2	175.8	174.3	0	0	0	0	110.7	A285 F286 Y291 D292 E293	A285-V289 WeakPolarHBondContact O-CG2 3.25Å; A285-V289 PolarHBondContact O-N 3.42Å; A285-V289 VanDerWaalsContact O-N 3.12Å; F286-V289 PolarHBondContact O-N 2.63Å; V289-Y291 VanDerWaalsContact C-N 3.32Å; V289-Y291 PolarHBondContact O-N 2.99Å; V289-D292 PolarHBondContact O-N 3.18Å; V289-E293 WeakPolarHBondContact O-CG 3.42Å; V289-E293 PolarHBondContact O-N 3.16Å
290	L	78.9	Confident	77.9	Confident	77 Å²	77	81.5 Å²	81.5	40%	0.403	41%	0.41	S	S	.	.	H	α-helix	trans	-60.2	-42.1	176.8	-74.7	179.1	0	0	0	112.5	F286 L288 D292 E293 I294	F286-L290 HydrophobicContact CD1-CD1 3.81Å; F286-L290 HydrophobicContact CD1-CG 4.38Å; F286-L290 HydrophobicContact CE1-CD1 3.3Å; F286-L290 HydrophobicContact CE1-CG 4.02Å; F286-L290 HydrophobicContact CE2-CD1 4.4Å; F286-L290 HydrophobicContact CE2-CD2 4.45Å; F286-L290 HydrophobicContact CE2-CG 4.26Å; F286-L290 HydrophobicContact CZ-CD1 3.64Å; F286-L290 HydrophobicContact CZ-CD2 4.12Å; F286-L290 HydrophobicContact CZ-CG 3.94Å; F286-L290 PolarHBondContact O-N 3.26Å; L288-L290 PolarHBondContact O-N 3.18Å; L290-D292 VanDerWaalsContact C-N 3.34Å; L290-D292 PolarHBondContact O-N 3.02Å; L290-E293 PolarHBondContact O-N 2.82Å; L290-I294 VanDerWaalsContact O-CG1 3.25Å; L290-I294 WeakPolarHBondContact O-CG1 3.4Å; L290-I294 PolarHBondContact O-N 3.41Å
291	Y	76.6	Confident	77.2	Confident	59 Å²	59	83.2 Å²	83.2	23%	0.231	42%	0.422	C	S	.	.	H	α-helix	trans	-61	-43.8	177.4	177.4	-99.1	0	0	0	111.7	A18 I21 V287 L288 V289 I294 K295	A18-Y291 HydrophobicContact CB-CD1 3.86Å; A18-Y291 HydrophobicContact CB-CE1 3.7Å; I21-Y291 HydrophobicContact CD1-CD2 3.96Å; I21-Y291 HydrophobicContact CD1-CE2 3.7Å; V287-Y291 WeakPolarHBondContact O-CB 3.06Å; V287-Y291 PolarHBondContact O-N 3.39Å; L288-Y291 PolarHBondContact O-N 3.05Å; V289-Y291 VanDerWaalsContact C-N 3.32Å; V289-Y291 PolarHBondContact O-N 2.99Å; Y291-I294 PolarHBondContact O-N 3.14Å; Y291-K295 WeakPolarHBondContact O-CB 3.18Å; Y291-K295 PolarHBondContact O-N 2.64Å
292	D	76.8	Confident	76.5	Confident	87 Å²	87	86.6 Å²	86.6	47%	0.465	43%	0.432	S	S	.	.	H	α-helix	trans	-65.7	-39.4	177.9	-72.8	-22.1	0	0	0	111.9	L288 V289 L290 K295 K296	L288-D292 PolarHBondContact O-N 2.92Å; V289-D292 PolarHBondContact O-N 3.18Å; L290-D292 VanDerWaalsContact C-N 3.34Å; L290-D292 PolarHBondContact O-N 3.02Å; D292-K295 PolarHBondContact O-N 2.94Å; D292-K296 WeakPolarHBondContact O-CG 3.46Å; D292-K296 PolarHBondContact O-N 3.42Å
293	E	76.8	Confident	75.7	Confident	74 Å²	74	86.9 Å²	86.9	35%	0.346	43%	0.434	S	S	.	.	H	α-helix	trans	-65	-47	174.6	-68.8	-53.2	146.2	0	0	111.9	V289 L290 K295 K296 F297	V289-E293 WeakPolarHBondContact O-CG 3.42Å; V289-E293 PolarHBondContact O-N 3.16Å; L290-E293 PolarHBondContact O-N 2.82Å; E293-K295 VanDerWaalsContact C-N 3.25Å; E293-K295 PolarHBondContact O-N 3.08Å; E293-K296 WeakPolarHBondContact O-CB 3.14Å; E293-K296 PolarHBondContact O-N 3Å; E293-K296 IonicContact OE1-NZ 3.97Å; E293-K296 PolarHBondContact OE1-NZ 3.41Å; E293-K296 WeakPolarHBondContact OE2-CD 3.33Å; E293-K296 IonicContact OE2-NZ 3.04Å; E293-K296 PolarHBondContact OE2-NZ 3.01Å; E293-F297 WeakPolarHBondContact O-CD2 3.28Å; E293-F297 PolarHBondContact O-N 2.83Å
294	I	72.1	Confident	74.9	Confident	106 Å²	106	90.8 Å²	90.8	54%	0.544	45%	0.445	S	S	.	.	H	α-helix	trans	-58.4	-40.6	177.3	-68.4	165.4	0	0	0	110.8	L290 Y291 K296 F297 T298	L290-I294 VanDerWaalsContact O-CG1 3.25Å; L290-I294 WeakPolarHBondContact O-CG1 3.4Å; L290-I294 PolarHBondContact O-N 3.41Å; Y291-I294 PolarHBondContact O-N 3.14Å; I294-K296 PolarHBondContact O-N 3.09Å; I294-F297 PolarHBondContact O-N 2.99Å; I294-F297 VanDerWaalsContact O-N 3.09Å; I294-T298 PolarHBondContact O-N 3.15Å; I294-T298 PolarHBondContact O-OG1 3.06Å
295	K	68.9	Low	74.4	Confident	96 Å²	96	96.3 Å²	96.3	42%	0.417	47%	0.469	S	S	.	.	H	α-helix	trans	-62.4	-28.7	177.7	-170.7	177	178.8	-178	0	113	Y291 D292 E293 T298	Y291-K295 WeakPolarHBondContact O-CB 3.18Å; Y291-K295 PolarHBondContact O-N 2.64Å; D292-K295 PolarHBondContact O-N 2.94Å; E293-K295 VanDerWaalsContact C-N 3.25Å; E293-K295 PolarHBondContact O-N 3.08Å; K295-T298 PolarHBondContact O-N 3.32Å
296	K	74.7	Confident	73.4	Confident	128 Å²	128	101.6 Å²	101.6	56%	0.557	49%	0.49	S	S	*	.	H	α-helix	trans	-68.6	-34.7	174.2	-65.7	173.6	-166.9	166.8	0	112.2	D292 E293 I294 T298	D292-K296 WeakPolarHBondContact O-CG 3.46Å; D292-K296 PolarHBondContact O-N 3.42Å; E293-K296 WeakPolarHBondContact O-CB 3.14Å; E293-K296 PolarHBondContact O-N 3Å; E293-K296 IonicContact OE1-NZ 3.97Å; E293-K296 PolarHBondContact OE1-NZ 3.41Å; E293-K296 WeakPolarHBondContact OE2-CD 3.33Å; E293-K296 IonicContact OE2-NZ 3.04Å; E293-K296 PolarHBondContact OE2-NZ 3.01Å; I294-K296 PolarHBondContact O-N 3.09Å; K296-T298 VanDerWaalsContact C-N 3.35Å
297	F	67.3	Low	72.4	Confident	177 Å²	177	101.1 Å²	101.1	78%	0.776	49%	0.491	S	S	*	.	H	α-helix	trans	-80.8	-13.8	177.5	-66.5	-75.7	0	0	0	114	E293 I294	E293-F297 WeakPolarHBondContact O-CD2 3.28Å; E293-F297 PolarHBondContact O-N 2.83Å; I294-F297 PolarHBondContact O-N 2.99Å; I294-F297 VanDerWaalsContact O-N 3.09Å
298	T	58.5	Low	71.6	Confident	115 Å²	115	106.8 Å²	106.8	71%	0.706	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	13.8	179.9	-32.3	0	0	0	0	112.2	I294 K295 K296	I294-T298 PolarHBondContact O-N 3.15Å; I294-T298 PolarHBondContact O-OG1 3.06Å; K295-T298 PolarHBondContact O-N 3.32Å; K296-T298 VanDerWaalsContact C-N 3.35Å
299	K	45.6	Very low	70.8	Confident	235 Å²	235	110.5 Å²	110.5	100%	1.022	53%	0.531	S	S	*	.			trans	-99	0	173	-90	-169.9	174.9	-173.2	0	111.1

Retrieved 299 of 299 residues in 1298.6 ms (Link to these results)

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