A0A077Z0S7_TRITR Loading...

SNARE domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0S7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 228 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	40.3	Very low	66.5	Low	216 Å²	216	109.9 Å²	109.9	100%	1.064	56%	0.56	S	S	*	*				0	17.5	0	-137.6	-156.9	172.2	0	0	113.5
2	F	49	Very low	68.2	Low	184 Å²	184	107.6 Å²	107.6	81%	0.807	55%	0.549	S	S	*	.			trans	-140.6	34.2	174.6	-68.7	-76.5	0	0	0	109.5	D4	F2-D4 PolarHBondContact O-N 2.99Å
3	D	53.3	Low	69.5	Low	144 Å²	144	100.2 Å²	100.2	77%	0.77	51%	0.513	S	S	*	.			trans	-71	98.3	-176.6	-75.5	-51.8	0	0	0	110.2	Q5	D3-Q5 PolarHBondContact O-N 3.1Å
4	D	56	Low	70.7	Confident	111 Å²	111	97.9 Å²	97.9	59%	0.594	51%	0.51	S	S	*	.			trans	48	59	132.9	-77.8	-21.6	0	0	0	119.4	F2	F2-D4 PolarHBondContact O-N 2.99Å
5	Q	67.5	Low	72	Confident	139 Å²	139	96.3 Å²	96.3	65%	0.65	50%	0.501	S	S	*	.	S	Bend	trans	-78.9	5.4	145.5	-70	-176	-18.2	0	0	112.3	D3 V9	D3-Q5 PolarHBondContact O-N 3.1Å; Q5-V9 WeakPolarHBondContact O-CB 3.39Å; Q5-V9 WeakPolarHBondContact O-CG2 3.38Å; Q5-V9 PolarHBondContact O-N 2.96Å
6	M	68.5	Low	73	Confident	31 Å²	31	94.3 Å²	94.3	15%	0.153	49%	0.49	C	S	.	.	H	α-helix	trans	-70.9	-48.6	-178.7	-66.4	-150.6	70.5	0	0	111.2	V9 D10 M82 R142 T145	M6-V9 PolarHBondContact O-N 3.4Å; M6-D10 WeakPolarHBondContact O-CB 3.47Å; M6-D10 PolarHBondContact O-N 3.48Å; M6-M82 HydrophobicContact CE-SD 3.78Å; M6-R142 HydrophobicContact CE-CG 4.43Å; M6-T145 HydrophobicContact CE-CG2 3.73Å; M6-T145 WeakPolarHBondContact CE-OG1 3.36Å
7	A	74.5	Confident	73.8	Confident	70 Å²	70	92.4 Å²	92.4	58%	0.579	48%	0.478	S	S	*	.	H	α-helix	trans	-63.6	-45.8	178.6	0	0	0	0	0	112.6	V9 D10 E11	A7-V9 PolarHBondContact O-N 2.95Å; A7-D10 PolarHBondContact O-N 3.26Å; A7-E11 PolarHBondContact O-N 3.48Å
8	E	79.5	Confident	74.7	Confident	108 Å²	108	93.8 Å²	93.8	51%	0.505	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-44.1	178.6	-176.8	-177.9	-177.5	0	0	111.6	D10 E11 L12	E8-D10 VanDerWaalsContact C-N 3.34Å; E8-E11 WeakPolarHBondContact O-CB 3.39Å; E8-E11 PolarHBondContact O-N 3.35Å; E8-L12 HydrophobicContact CG-CD1 4.2Å; E8-L12 VanDerWaalsContact O-CG 3.3Å; E8-L12 WeakPolarHBondContact O-CG 3.34Å; E8-L12 PolarHBondContact O-N 2.89Å
9	V	77.1	Confident	75.6	Confident	38 Å²	38	93.1 Å²	93.1	23%	0.23	48%	0.479	C	S	.	.	H	α-helix	trans	-73.3	-30.1	179.7	179.9	0	0	0	0	111.9	Q5 M6 A7 E11 L12 T13	Q5-V9 WeakPolarHBondContact O-CB 3.39Å; Q5-V9 WeakPolarHBondContact O-CG2 3.38Å; Q5-V9 PolarHBondContact O-N 2.96Å; M6-V9 PolarHBondContact O-N 3.4Å; A7-V9 PolarHBondContact O-N 2.95Å; V9-E11 VanDerWaalsContact C-N 3.34Å; V9-L12 PolarHBondContact O-N 3.28Å; V9-T13 WeakPolarHBondContact O-CB 3.2Å; V9-T13 PolarHBondContact O-N 3.38Å; V9-T13 PolarHBondContact O-OG1 3.45Å
10	D	80.8	Confident	76.2	Confident	42 Å²	42	88.7 Å²	88.7	23%	0.225	46%	0.456	C	S	.	.	H	α-helix	trans	-68.8	-37	174.4	-70.5	0.8	0	0	0	110.4	M6 A7 E8 T13 S14 R78 T145	M6-D10 WeakPolarHBondContact O-CB 3.47Å; M6-D10 PolarHBondContact O-N 3.48Å; A7-D10 PolarHBondContact O-N 3.26Å; E8-D10 VanDerWaalsContact C-N 3.34Å; D10-T13 PolarHBondContact O-N 3.34Å; D10-S14 WeakPolarHBondContact O-CB 3.42Å; D10-S14 PolarHBondContact O-N 2.93Å; D10-R78 IonicContact OD1-CZ 3.62Å; D10-R78 IonicContact OD1-NH2 2.84Å; D10-R78 PolarHBondContact OD1-NH2 2.91Å; D10-T145 WeakPolarHBondContact OD1-CG2 3.25Å; D10-T145 PolarHBondContact OD2-OG1 2.9Å
11	E	84.9	Confident	76.8	Confident	126 Å²	126	86.5 Å²	86.5	59%	0.589	45%	0.451	S	S	*	.	H	α-helix	trans	-61.6	-52.2	169.5	-178.6	179.5	-176	0	0	111.5	A7 E8 V9 T13 S14 I15	A7-E11 PolarHBondContact O-N 3.48Å; E8-E11 WeakPolarHBondContact O-CB 3.39Å; E8-E11 PolarHBondContact O-N 3.35Å; V9-E11 VanDerWaalsContact C-N 3.34Å; E11-T13 VanDerWaalsContact C-N 3.28Å; E11-T13 PolarHBondContact O-N 2.85Å; E11-S14 WeakPolarHBondContact O-CB 3.31Å; E11-S14 PolarHBondContact O-N 3.45Å; E11-I15 HydrophobicContact CG-CD1 3.93Å; E11-I15 WeakPolarHBondContact O-CG1 3.3Å; E11-I15 PolarHBondContact O-N 3.44Å
12	L	87.1	Confident	79.2	Confident	82 Å²	82	79.9 Å²	79.9	43%	0.429	42%	0.42	S	S	.	.	H	α-helix	trans	-59.7	-39.1	178	-70.8	171.2	0	0	0	112	E8 V9 S14 I15 I16	E8-L12 HydrophobicContact CG-CD1 4.2Å; E8-L12 VanDerWaalsContact O-CG 3.3Å; E8-L12 WeakPolarHBondContact O-CG 3.34Å; E8-L12 PolarHBondContact O-N 2.89Å; V9-L12 PolarHBondContact O-N 3.28Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 2.92Å; L12-I15 PolarHBondContact O-N 2.91Å; L12-I16 WeakPolarHBondContact O-CB 3.26Å; L12-I16 WeakPolarHBondContact O-CD1 3.33Å; L12-I16 VanDerWaalsContact O-CG1 3.23Å; L12-I16 WeakPolarHBondContact O-CG1 3.5Å; L12-I16 PolarHBondContact O-N 3.02Å
13	T	84.3	Confident	81.2	Confident	12 Å²	12	74.8 Å²	74.8	7%	0.074	40%	0.4	C	S	.	.	H	α-helix	trans	-62.5	-42.9	175.8	-62.2	0	0	0	0	110.5	V9 D10 E11 K17 F71 L75 T152	V9-T13 WeakPolarHBondContact O-CB 3.2Å; V9-T13 PolarHBondContact O-N 3.38Å; V9-T13 PolarHBondContact O-OG1 3.45Å; D10-T13 PolarHBondContact O-N 3.34Å; E11-T13 VanDerWaalsContact C-N 3.28Å; E11-T13 PolarHBondContact O-N 2.85Å; T13-K17 WeakPolarHBondContact O-CB 3.39Å; T13-K17 PolarHBondContact O-N 3.33Å; T13-F71 HydrophobicContact CG2-CZ 3.85Å; T13-L75 HydrophobicContact CG2-CD2 4Å; T13-T152 HydrophobicContact CG2-CG2 4.31Å
14	S	86.4	Confident	82.8	Confident	68 Å²	68	68.6 Å²	68.6	48%	0.476	37%	0.367	S	S	.	.	H	α-helix	trans	-65.5	-42.1	177	-171.7	0	0	0	0	112.3	D10 E11 L12 K17 Q18	D10-S14 WeakPolarHBondContact O-CB 3.42Å; D10-S14 PolarHBondContact O-N 2.93Å; E11-S14 WeakPolarHBondContact O-CB 3.31Å; E11-S14 PolarHBondContact O-N 3.45Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 2.92Å; S14-K17 PolarHBondContact O-N 2.92Å; S14-Q18 WeakPolarHBondContact O-CB 3.36Å; S14-Q18 PolarHBondContact O-N 2.99Å
15	I	90.3	Very high	84.4	Confident	73 Å²	73	67.1 Å²	67.1	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-62.8	-51.7	177.3	-67.2	167.1	0	0	0	110.1	E11 L12 K17 Q18 D19	E11-I15 HydrophobicContact CG-CD1 3.93Å; E11-I15 WeakPolarHBondContact O-CG1 3.3Å; E11-I15 PolarHBondContact O-N 3.44Å; L12-I15 PolarHBondContact O-N 2.91Å; I15-K17 VanDerWaalsContact C-N 3.29Å; I15-K17 PolarHBondContact O-N 3.35Å; I15-Q18 WeakPolarHBondContact O-CB 3.27Å; I15-Q18 PolarHBondContact O-N 2.93Å; I15-Q18 VanDerWaalsContact O-N 3.11Å; I15-D19 PolarHBondContact O-N 3.02Å
16	I	88.1	Confident	85.4	Confident	64 Å²	64	65.7 Å²	65.7	33%	0.328	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-40.8	-180	-66.3	166	0	0	0	110.7	L12 Q18 D19 I20 F71	L12-I16 WeakPolarHBondContact O-CB 3.26Å; L12-I16 WeakPolarHBondContact O-CD1 3.33Å; L12-I16 VanDerWaalsContact O-CG1 3.23Å; L12-I16 WeakPolarHBondContact O-CG1 3.5Å; L12-I16 PolarHBondContact O-N 3.02Å; I16-Q18 PolarHBondContact O-N 3.36Å; I16-D19 PolarHBondContact O-N 2.89Å; I16-I20 HydrophobicContact CG2-CD1 3.68Å; I16-I20 HydrophobicContact CG2-CG1 4.23Å; I16-I20 WeakPolarHBondContact O-CB 3.13Å; I16-I20 VanDerWaalsContact O-CG1 3.25Å; I16-I20 WeakPolarHBondContact O-CG1 3.34Å; I16-I20 PolarHBondContact O-N 3.37Å; I16-F71 HydrophobicContact CB-CD2 4.43Å; I16-F71 HydrophobicContact CB-CE1 4.43Å; I16-F71 HydrophobicContact CB-CE2 3.94Å; I16-F71 HydrophobicContact CB-CZ 3.92Å; I16-F71 HydrophobicContact CD1-CD2 4.25Å; I16-F71 HydrophobicContact CD1-CE2 3.92Å; I16-F71 HydrophobicContact CG2-CD1 3.89Å; I16-F71 HydrophobicContact CG2-CD2 3.7Å; I16-F71 HydrophobicContact CG2-CE1 3.87Å; I16-F71 HydrophobicContact CG2-CE2 3.67Å; I16-F71 HydrophobicContact CG2-CG 3.81Å; I16-F71 HydrophobicContact CG2-CZ 3.74Å
17	K	87.5	Confident	86.2	Confident	63 Å²	63	64.6 Å²	64.6	27%	0.274	35%	0.35	S	S	.	.	H	α-helix	trans	-57.9	-48.1	174	168.4	-180	154.2	161.2	0	111.5	T13 S14 I15 A21 T152 E155	T13-K17 WeakPolarHBondContact O-CB 3.39Å; T13-K17 PolarHBondContact O-N 3.33Å; S14-K17 PolarHBondContact O-N 2.92Å; I15-K17 VanDerWaalsContact C-N 3.29Å; I15-K17 PolarHBondContact O-N 3.35Å; K17-A21 WeakPolarHBondContact O-CB 3.38Å; K17-A21 PolarHBondContact O-N 3.49Å; K17-T152 HydrophobicContact CB-CG2 4.29Å; K17-T152 HydrophobicContact CD-CG2 4.16Å; K17-T152 HydrophobicContact CG-CG2 4.45Å; K17-E155 WeakPolarHBondContact CD-OE2 3.5Å; K17-E155 WeakPolarHBondContact CE-OE2 3.3Å; K17-E155 IonicContact NZ-OE1 2.87Å; K17-E155 PolarHBondContact NZ-OE1 3.41Å; K17-E155 IonicContact NZ-OE2 2.62Å; K17-E155 PolarHBondContact NZ-OE2 3Å
18	Q	89.9	Confident	86.7	Confident	118 Å²	118	61.8 Å²	61.8	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-61.9	-45.1	178.3	178.9	173.9	-15.3	0	0	111.3	S14 I15 I16 A21 L22	S14-Q18 WeakPolarHBondContact O-CB 3.36Å; S14-Q18 PolarHBondContact O-N 2.99Å; I15-Q18 WeakPolarHBondContact O-CB 3.27Å; I15-Q18 PolarHBondContact O-N 2.93Å; I15-Q18 VanDerWaalsContact O-N 3.11Å; I16-Q18 PolarHBondContact O-N 3.36Å; Q18-A21 WeakPolarHBondContact O-CB 3.32Å; Q18-A21 PolarHBondContact O-N 3.39Å; Q18-L22 HydrophobicContact CG-CD1 4.13Å; Q18-L22 HydrophobicContact CG-CG 4.4Å; Q18-L22 VanDerWaalsContact O-CG 3.3Å; Q18-L22 WeakPolarHBondContact O-CG 3.5Å; Q18-L22 PolarHBondContact O-N 3.48Å
19	D	91	Very high	87.1	Confident	80 Å²	80	59 Å²	59	43%	0.428	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-44	-179.3	-73.6	-13	0	0	0	112.3	I15 I16 A21 L22 L23	I15-D19 PolarHBondContact O-N 3.02Å; I16-D19 PolarHBondContact O-N 2.89Å; D19-A21 VanDerWaalsContact C-N 3.29Å; D19-A21 PolarHBondContact O-N 3.48Å; D19-L22 PolarHBondContact O-N 3.3Å; D19-L23 WeakPolarHBondContact O-CB 3.4Å; D19-L23 WeakPolarHBondContact O-CG 3.38Å; D19-L23 PolarHBondContact O-N 2.87Å
20	I	87.8	Confident	87.4	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-61.1	-40.8	175.2	-68.7	173.5	0	0	0	110.4	I16 L23 N24 L64 I67 F71 I159	I16-I20 HydrophobicContact CG2-CD1 3.68Å; I16-I20 HydrophobicContact CG2-CG1 4.23Å; I16-I20 WeakPolarHBondContact O-CB 3.13Å; I16-I20 VanDerWaalsContact O-CG1 3.25Å; I16-I20 WeakPolarHBondContact O-CG1 3.34Å; I16-I20 PolarHBondContact O-N 3.37Å; I20-L23 PolarHBondContact O-N 3.45Å; I20-N24 WeakPolarHBondContact O-CB 3.49Å; I20-N24 PolarHBondContact O-N 3.35Å; I20-L64 HydrophobicContact CB-CD1 4.46Å; I20-L64 HydrophobicContact CG1-CD1 4.47Å; I20-L64 HydrophobicContact CG2-CD1 3.99Å; I20-I67 HydrophobicContact CD1-CG2 4.47Å; I20-F71 HydrophobicContact CD1-CB 4.34Å; I20-F71 HydrophobicContact CD1-CD1 3.82Å; I20-F71 HydrophobicContact CD1-CE1 4.47Å; I20-F71 HydrophobicContact CD1-CG 4.31Å; I20-I159 HydrophobicContact CG2-CD1 3.66Å
21	A	88.3	Confident	87.4	Confident	43 Å²	43	59.5 Å²	59.5	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-44.4	175.9	0	0	0	0	0	111.8	K17 Q18 D19 N24 T25	K17-A21 WeakPolarHBondContact O-CB 3.38Å; K17-A21 PolarHBondContact O-N 3.49Å; Q18-A21 WeakPolarHBondContact O-CB 3.32Å; Q18-A21 PolarHBondContact O-N 3.39Å; D19-A21 VanDerWaalsContact C-N 3.29Å; D19-A21 PolarHBondContact O-N 3.48Å; A21-N24 PolarHBondContact O-N 2.89Å; A21-T25 WeakPolarHBondContact O-CG2 3.31Å; A21-T25 PolarHBondContact O-N 3.04Å
22	L	91.7	Very high	87.3	Confident	78 Å²	78	61.7 Å²	61.7	41%	0.408	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-48.1	175.5	-72.3	175.2	0	0	0	111.1	Q18 D19 N24 T25 Q26	Q18-L22 HydrophobicContact CG-CD1 4.13Å; Q18-L22 HydrophobicContact CG-CG 4.4Å; Q18-L22 VanDerWaalsContact O-CG 3.3Å; Q18-L22 WeakPolarHBondContact O-CG 3.5Å; Q18-L22 PolarHBondContact O-N 3.48Å; D19-L22 PolarHBondContact O-N 3.3Å; L22-N24 VanDerWaalsContact C-N 3.33Å; L22-N24 PolarHBondContact O-N 3.29Å; L22-T25 PolarHBondContact O-N 3.23Å; L22-T25 VanDerWaalsContact O-N 3.16Å; L22-T25 PolarHBondContact O-OG1 3.19Å; L22-Q26 WeakPolarHBondContact O-CG 3.48Å; L22-Q26 PolarHBondContact O-N 3.3Å
23	L	90.1	Very high	86.9	Confident	76 Å²	76	61.9 Å²	61.9	40%	0.398	33%	0.327	S	S	.	.	H	α-helix	trans	-59.1	-42.9	177.1	-71.2	174.8	0	0	0	111.9	D19 I20 T25 Q26 I27 L64	D19-L23 WeakPolarHBondContact O-CB 3.4Å; D19-L23 WeakPolarHBondContact O-CG 3.38Å; D19-L23 PolarHBondContact O-N 2.87Å; I20-L23 PolarHBondContact O-N 3.45Å; L23-T25 PolarHBondContact O-N 3.42Å; L23-Q26 PolarHBondContact O-N 3.31Å; L23-I27 WeakPolarHBondContact O-CB 3.5Å; L23-I27 VanDerWaalsContact O-CG1 3.26Å; L23-I27 WeakPolarHBondContact O-CG1 3.19Å; L23-I27 PolarHBondContact O-N 2.82Å; L23-L64 HydrophobicContact CB-CD1 3.86Å; L23-L64 HydrophobicContact CB-CD2 4.2Å; L23-L64 HydrophobicContact CD1-CD1 3.95Å
24	N	87.5	Confident	86.5	Confident	14 Å²	14	62.3 Å²	62.3	8%	0.075	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-41.9	176.3	-174.5	43.8	0	0	0	112.1	I20 A21 L22 A28 L64 I159 Q162	I20-N24 WeakPolarHBondContact O-CB 3.49Å; I20-N24 PolarHBondContact O-N 3.35Å; A21-N24 PolarHBondContact O-N 2.89Å; L22-N24 VanDerWaalsContact C-N 3.33Å; L22-N24 PolarHBondContact O-N 3.29Å; N24-A28 WeakPolarHBondContact O-CB 3.25Å; N24-A28 PolarHBondContact O-N 2.99Å; N24-L64 HydrophobicContact CB-CD2 4.04Å; N24-I159 HydrophobicContact CB-CG2 4.24Å; N24-Q162 PolarHBondContact ND2-OE1 3.27Å; N24-Q162 PolarHBondContact OD1-NE2 2.94Å
25	T	88.3	Confident	85.9	Confident	80 Å²	80	63.1 Å²	63.1	49%	0.491	32%	0.323	S	S	.	.	H	α-helix	trans	-67.1	-37.7	177.2	63.9	0	0	0	0	113	A21 L22 L23 A28 S29	A21-T25 WeakPolarHBondContact O-CG2 3.31Å; A21-T25 PolarHBondContact O-N 3.04Å; L22-T25 PolarHBondContact O-N 3.23Å; L22-T25 VanDerWaalsContact O-N 3.16Å; L22-T25 PolarHBondContact O-OG1 3.19Å; L23-T25 PolarHBondContact O-N 3.42Å; T25-A28 PolarHBondContact O-N 3.27Å; T25-S29 PolarHBondContact O-N 2.94Å
26	Q	89.4	Confident	85.2	Confident	109 Å²	109	62.7 Å²	62.7	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-41.9	177.4	-69.7	178.7	23.1	0	0	111.8	L22 L23 A28 S29 L30	L22-Q26 WeakPolarHBondContact O-CG 3.48Å; L22-Q26 PolarHBondContact O-N 3.3Å; L23-Q26 PolarHBondContact O-N 3.31Å; Q26-A28 VanDerWaalsContact C-N 3.28Å; Q26-A28 PolarHBondContact O-N 2.99Å; Q26-S29 PolarHBondContact O-N 3.19Å; Q26-S29 VanDerWaalsContact O-N 3.17Å; Q26-S29 PolarHBondContact O-OG 3.44Å; Q26-L30 WeakPolarHBondContact O-CG 3.41Å; Q26-L30 PolarHBondContact O-N 2.86Å
27	I	85.4	Confident	84.4	Confident	8 Å²	8	63.5 Å²	63.5	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-42.3	174.1	-69.6	170.3	0	0	0	110.1	L23 S29 L30 Q31 V57 F60 Q61 L64 M166	L23-I27 WeakPolarHBondContact O-CB 3.5Å; L23-I27 VanDerWaalsContact O-CG1 3.26Å; L23-I27 WeakPolarHBondContact O-CG1 3.19Å; L23-I27 PolarHBondContact O-N 2.82Å; I27-S29 PolarHBondContact O-N 3.44Å; I27-L30 PolarHBondContact O-N 3.01Å; I27-Q31 WeakPolarHBondContact O-CG 3.26Å; I27-Q31 PolarHBondContact O-N 2.89Å; I27-V57 HydrophobicContact CG2-CG1 4.28Å; I27-F60 HydrophobicContact CD1-CB 3.91Å; I27-F60 HydrophobicContact CG1-CB 4.15Å; I27-Q61 HydrophobicContact CD1-CG 4.46Å; I27-Q61 HydrophobicContact CG2-CG 3.64Å; I27-L64 HydrophobicContact CD1-CB 4.24Å; I27-L64 HydrophobicContact CD1-CD2 3.71Å; I27-M166 HydrophobicContact CG2-SD 3.74Å
28	A	85.7	Confident	83.4	Confident	11 Å²	11	64.5 Å²	64.5	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-37.5	175.8	0	0	0	0	0	112.6	N24 T25 Q26 Q31 R32	N24-A28 WeakPolarHBondContact O-CB 3.25Å; N24-A28 PolarHBondContact O-N 2.99Å; T25-A28 PolarHBondContact O-N 3.27Å; Q26-A28 VanDerWaalsContact C-N 3.28Å; Q26-A28 PolarHBondContact O-N 2.99Å; A28-Q31 PolarHBondContact O-N 3.39Å; A28-R32 WeakPolarHBondContact O-CG 3.28Å; A28-R32 PolarHBondContact O-N 3.28Å; A28-R32 VanDerWaalsContact O-N 3.12Å
29	S	87.4	Confident	82.4	Confident	50 Å²	50	66 Å²	66	35%	0.35	35%	0.349	S	S	.	.	H	α-helix	trans	-68.3	-41.4	176.5	74.1	0	0	0	0	112	T25 Q26 I27 Q31 R32 V33	T25-S29 PolarHBondContact O-N 2.94Å; Q26-S29 PolarHBondContact O-N 3.19Å; Q26-S29 VanDerWaalsContact O-N 3.17Å; Q26-S29 PolarHBondContact O-OG 3.44Å; I27-S29 PolarHBondContact O-N 3.44Å; S29-Q31 VanDerWaalsContact C-N 3.27Å; S29-Q31 PolarHBondContact O-N 3.39Å; S29-R32 WeakPolarHBondContact O-CB 3.49Å; S29-R32 PolarHBondContact O-N 3.33Å; S29-R32 VanDerWaalsContact O-N 3.12Å; S29-V33 WeakPolarHBondContact O-CG2 3.34Å; S29-V33 PolarHBondContact O-N 2.87Å
30	L	83	Confident	81.3	Confident	72 Å²	72	64.4 Å²	64.4	38%	0.377	34%	0.344	S	S	.	.	H	α-helix	trans	-58.8	-39.7	173.8	-70.8	177.3	0	0	0	111.9	Q26 I27 V33 R34 V57	Q26-L30 WeakPolarHBondContact O-CG 3.41Å; Q26-L30 PolarHBondContact O-N 2.86Å; I27-L30 PolarHBondContact O-N 3.01Å; L30-V33 PolarHBondContact O-N 3.12Å; L30-R34 PolarHBondContact O-N 3.47Å; L30-V57 HydrophobicContact CB-CG2 3.95Å; L30-V57 HydrophobicContact CD1-CG2 4.42Å
31	Q	80.7	Confident	79.8	Confident	18 Å²	18	71.7 Å²	71.7	8%	0.084	38%	0.383	C	S	.	.	H	α-helix	trans	-64.2	-42.3	174.5	-74.7	-170.5	-40.1	0	0	112.9	I27 A28 S29 V33 R34 F35 V57 Q61 M166	I27-Q31 WeakPolarHBondContact O-CG 3.26Å; I27-Q31 PolarHBondContact O-N 2.89Å; A28-Q31 PolarHBondContact O-N 3.39Å; S29-Q31 VanDerWaalsContact C-N 3.27Å; S29-Q31 PolarHBondContact O-N 3.39Å; Q31-V33 VanDerWaalsContact C-N 3.31Å; Q31-V33 PolarHBondContact O-N 3.45Å; Q31-R34 WeakPolarHBondContact O-CB 3.43Å; Q31-R34 PolarHBondContact O-N 3.27Å; Q31-F35 HydrophobicContact CB-CD2 4.47Å; Q31-F35 HydrophobicContact CB-CE2 4.4Å; Q31-F35 WeakPolarHBondContact O-CD2 3.48Å; Q31-F35 PolarHBondContact O-N 3.47Å; Q31-V57 HydrophobicContact CG-CG1 3.69Å; Q31-Q61 VanDerWaalsContact NE2-NE2 3.13Å; Q31-M166 PolarHBondContact NE2-SD 3.07Å; Q31-M166 PolarHBondContact OE1-SD 3.5Å
32	R	82.6	Confident	78.5	Confident	172 Å²	172	75.3 Å²	75.3	65%	0.649	39%	0.394	S	S	*	.	H	α-helix	trans	-59.9	-43.2	176.3	-69	-176.8	-160.9	112.7	1	111.5	A28 S29 R34 F35 A36	A28-R32 WeakPolarHBondContact O-CG 3.28Å; A28-R32 PolarHBondContact O-N 3.28Å; A28-R32 VanDerWaalsContact O-N 3.12Å; S29-R32 WeakPolarHBondContact O-CB 3.49Å; S29-R32 PolarHBondContact O-N 3.33Å; S29-R32 VanDerWaalsContact O-N 3.12Å; R32-R34 VanDerWaalsContact C-N 3.33Å; R32-R34 PolarHBondContact O-N 2.92Å; R32-F35 PolarHBondContact O-N 2.9Å; R32-A36 WeakPolarHBondContact O-CB 3.32Å; R32-A36 PolarHBondContact O-N 3.27Å
33	V	79.9	Confident	76.9	Confident	86 Å²	86	79.2 Å²	79.2	52%	0.521	41%	0.408	S	S	.	.	H	α-helix	trans	-59.6	-45.3	175.7	175.5	0	0	0	0	110.4	S29 L30 Q31 F35 A36 L37	S29-V33 WeakPolarHBondContact O-CG2 3.34Å; S29-V33 PolarHBondContact O-N 2.87Å; L30-V33 PolarHBondContact O-N 3.12Å; Q31-V33 VanDerWaalsContact C-N 3.31Å; Q31-V33 PolarHBondContact O-N 3.45Å; V33-F35 PolarHBondContact O-N 3.43Å; V33-A36 PolarHBondContact O-N 3.02Å; V33-L37 HydrophobicContact CG1-CD1 4.14Å; V33-L37 VanDerWaalsContact O-CG 3.31Å; V33-L37 WeakPolarHBondContact O-CG 3.46Å; V33-L37 PolarHBondContact O-N 3.38Å
34	R	75.8	Confident	75.2	Confident	22 Å²	22	84 Å²	84	8%	0.083	43%	0.425	C	S	.	.	H	α-helix	trans	-59.5	-46.7	175.3	-171.3	-164	71.8	-179.1	1.7	112.2	L30 Q31 R32 A36 L37 I38	L30-R34 PolarHBondContact O-N 3.47Å; Q31-R34 WeakPolarHBondContact O-CB 3.43Å; Q31-R34 PolarHBondContact O-N 3.27Å; R32-R34 VanDerWaalsContact C-N 3.33Å; R32-R34 PolarHBondContact O-N 2.92Å; R34-A36 VanDerWaalsContact C-N 3.34Å; R34-A36 PolarHBondContact O-N 3Å; R34-L37 PolarHBondContact O-N 3.49Å; R34-I38 HydrophobicContact CG-CD1 4.06Å; R34-I38 WeakPolarHBondContact O-CG1 3.4Å; R34-I38 PolarHBondContact O-N 3.06Å
35	F	72.9	Confident	73.8	Confident	85 Å²	85	87.8 Å²	87.8	37%	0.373	45%	0.449	S	S	.	.	H	α-helix	trans	-61.9	-43.1	177.8	-77.3	-67	0	0	0	111.2	Q31 R32 V33 L37 I38 H39	Q31-F35 HydrophobicContact CB-CD2 4.47Å; Q31-F35 HydrophobicContact CB-CE2 4.4Å; Q31-F35 WeakPolarHBondContact O-CD2 3.48Å; Q31-F35 PolarHBondContact O-N 3.47Å; R32-F35 PolarHBondContact O-N 2.9Å; V33-F35 PolarHBondContact O-N 3.43Å; F35-L37 VanDerWaalsContact C-N 3.31Å; F35-L37 PolarHBondContact O-N 2.72Å; F35-I38 PolarHBondContact O-N 2.87Å; F35-H39 PolarHBondContact O-N 3.48Å; F35-H39 VanDerWaalsContact O-N 3.11Å; F35-H39 PolarHBondContact O-ND1 3.38Å
36	A	76.6	Confident	72.4	Confident	63 Å²	63	84.9 Å²	84.9	52%	0.521	43%	0.434	S	S	.	.	H	α-helix	trans	-59.6	-40.8	175.6	0	0	0	0	0	112.3	R32 V33 R34 H39 S40	R32-A36 WeakPolarHBondContact O-CB 3.32Å; R32-A36 PolarHBondContact O-N 3.27Å; V33-A36 PolarHBondContact O-N 3.02Å; R34-A36 VanDerWaalsContact C-N 3.34Å; R34-A36 PolarHBondContact O-N 3Å; A36-H39 PolarHBondContact O-N 2.95Å; A36-S40 PolarHBondContact O-N 2.88Å
37	L	70.1	Confident	71.3	Confident	81 Å²	81	82 Å²	82	42%	0.424	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-42	176.8	-70.5	169.6	0	0	0	112.6	V33 R34 F35 H39 S40 T50	V33-L37 HydrophobicContact CG1-CD1 4.14Å; V33-L37 VanDerWaalsContact O-CG 3.31Å; V33-L37 WeakPolarHBondContact O-CG 3.46Å; V33-L37 PolarHBondContact O-N 3.38Å; R34-L37 PolarHBondContact O-N 3.49Å; F35-L37 VanDerWaalsContact C-N 3.31Å; F35-L37 PolarHBondContact O-N 2.72Å; L37-H39 VanDerWaalsContact C-N 3.32Å; L37-H39 PolarHBondContact O-N 2.82Å; L37-S40 PolarHBondContact O-N 3.46Å; L37-S40 PolarHBondContact O-OG 3.34Å; L37-T50 HydrophobicContact CB-CG2 4.34Å
38	I	67.9	Low	70.3	Confident	84 Å²	84	84.7 Å²	84.7	43%	0.431	44%	0.438	S	S	.	.	H	α-helix	trans	-65.9	-35	178.7	-67	166.8	0	0	0	111.6	R34 F35	R34-I38 HydrophobicContact CG-CD1 4.06Å; R34-I38 WeakPolarHBondContact O-CG1 3.4Å; R34-I38 PolarHBondContact O-N 3.06Å; F35-I38 PolarHBondContact O-N 2.87Å
39	H	68.2	Low	69.5	Low	150 Å²	150	91.4 Å²	91.4	69%	0.694	47%	0.467	S	S	*	.	H	α-helix	trans	-80.3	-24.6	179.1	-70.5	85.6	0	0	0	113.1	F35 A36 L37 N41	F35-H39 PolarHBondContact O-N 3.48Å; F35-H39 VanDerWaalsContact O-N 3.11Å; F35-H39 PolarHBondContact O-ND1 3.38Å; A36-H39 PolarHBondContact O-N 2.95Å; L37-H39 VanDerWaalsContact C-N 3.32Å; L37-H39 PolarHBondContact O-N 2.82Å; H39-N41 PolarHBondContact O-N 2.86Å
40	S	67.6	Low	68.7	Low	46 Å²	46	90.3 Å²	90.3	32%	0.322	46%	0.458	S	S	.	.	S	Bend	trans	-67.1	131.7	167.4	77.7	0	0	0	0	109	A36 L37 M42	A36-S40 PolarHBondContact O-N 2.88Å; L37-S40 PolarHBondContact O-N 3.46Å; L37-S40 PolarHBondContact O-OG 3.34Å; S40-M42 PolarHBondContact O-N 3.39Å
41	N	57.3	Low	68	Low	158 Å²	158	88.2 Å²	88.2	85%	0.845	45%	0.447	S	S	*	.	S	Bend	trans	-62.3	16.9	-175.3	-101.3	-29.1	0	0	0	115.4	H39 K43	H39-N41 PolarHBondContact O-N 2.86Å; N41-K43 PolarHBondContact O-N 3.48Å
42	M	60.2	Low	67.7	Low	119 Å²	119	93.6 Å²	93.6	59%	0.586	47%	0.472	S	S	*	.			trans	-80.4	39.2	174.6	-74.9	-175	77.8	0	0	113.3	S40 F44 T45	S40-M42 PolarHBondContact O-N 3.39Å; M42-F44 PolarHBondContact O-N 2.94Å; M42-T45 PolarHBondContact O-N 2.92Å
43	K	57.9	Low	67.5	Low	160 Å²	160	87.2 Å²	87.2	70%	0.696	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.8	-176.9	-75.8	-173.7	176.2	-179.1	0	114.8	N41	N41-K43 PolarHBondContact O-N 3.48Å
44	F	55.4	Low	67.3	Low	175 Å²	175	85.8 Å²	85.8	77%	0.768	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-20.9	-170.3	-157.6	-100.6	0	0	0	115.3	M42	M42-F44 PolarHBondContact O-N 2.94Å
45	T	57.4	Low	67.4	Low	94 Å²	94	87.6 Å²	87.6	58%	0.577	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-10	-176.8	56.5	0	0	0	0	113.5	M42	M42-T45 PolarHBondContact O-N 2.92Å
46	A	59.5	Low	67.9	Low	20 Å²	20	85.4 Å²	85.4	17%	0.165	45%	0.45	C	S	.	.	S	Bend	trans	-100.7	-3	-172.1	0	0	0	0	0	114	Q49 T50	A46-Q49 PolarHBondContact O-N 3.44Å; A46-T50 HydrophobicContact CB-CG2 4.12Å; A46-T50 VanDerWaalsContact O-CB 3.24Å; A46-T50 WeakPolarHBondContact O-CB 3.41Å; A46-T50 WeakPolarHBondContact O-CG2 3.48Å; A46-T50 PolarHBondContact O-N 3.35Å; A46-T50 PolarHBondContact O-OG1 3.11Å
47	T	65.7	Low	68.2	Low	47 Å²	47	82.4 Å²	82.4	29%	0.288	43%	0.425	S	S	.	.	H	α-helix	trans	-57.5	-60.1	-176.3	46.7	0	0	0	0	110.8	Q49 T50 Q51 E183	T47-Q49 PolarHBondContact O-N 2.86Å; T47-T50 PolarHBondContact O-N 2.72Å; T47-T50 PolarHBondContact O-OG1 3.46Å; T47-Q51 WeakPolarHBondContact O-CB 3.29Å; T47-Q51 WeakPolarHBondContact O-CG 3.3Å; T47-Q51 PolarHBondContact O-N 3.39Å; T47-E183 WeakPolarHBondContact CB-OE1 3.33Å; T47-E183 PolarHBondContact OG1-OE1 3.43Å
48	N	65	Low	68.7	Low	66 Å²	66	80.6 Å²	80.6	35%	0.353	42%	0.417	S	S	.	.	H	α-helix	trans	-57.3	-42.7	179.2	-77.4	-44.7	0	0	0	114.5	Q51 H52 E183 H187	N48-Q51 PolarHBondContact O-N 3.26Å; N48-H52 WeakPolarHBondContact O-CB 3.47Å; N48-H52 PolarHBondContact O-N 3.29Å; N48-E183 PolarHBondContact N-OE1 2.86Å; N48-E183 PolarHBondContact ND2-OE1 3.23Å; N48-E183 VanDerWaalsContact ND2-OE1 3.16Å; N48-E183 PolarHBondContact OD1-OE1 3.11Å; N48-E183 VanDerWaalsContact OD1-OE1 3.05Å; N48-E183 PolarHBondContact OD1-OE2 3.49Å; N48-H187 PolarHBondContact ND2-CE1 3.2Å; N48-H187 VanDerWaalsContact ND2-CE1 3.29Å; N48-H187 PolarHBondContact ND2-ND1 3.37Å
49	Q	68	Low	69.4	Low	152 Å²	152	79 Å²	79	71%	0.71	41%	0.413	S	S	*	.	H	α-helix	trans	-69	-40.2	179.9	-66.5	-172.7	17.8	0	0	111.9	A46 T47 Q51 S53	A46-Q49 PolarHBondContact O-N 3.44Å; T47-Q49 PolarHBondContact O-N 2.86Å; Q49-Q51 VanDerWaalsContact C-N 3.35Å; Q49-S53 VanDerWaalsContact O-CB 3.25Å; Q49-S53 WeakPolarHBondContact O-CB 3.11Å; Q49-S53 PolarHBondContact O-N 2.76Å
50	T	70.4	Confident	70.3	Confident	26 Å²	26	76.5 Å²	76.5	16%	0.16	40%	0.401	C	S	.	.	H	α-helix	trans	-70.2	-33.5	175.6	59.4	0	0	0	0	111.6	L37 A46 T47 K54	L37-T50 HydrophobicContact CB-CG2 4.34Å; A46-T50 HydrophobicContact CB-CG2 4.12Å; A46-T50 VanDerWaalsContact O-CB 3.24Å; A46-T50 WeakPolarHBondContact O-CB 3.41Å; A46-T50 WeakPolarHBondContact O-CG2 3.48Å; A46-T50 PolarHBondContact O-N 3.35Å; A46-T50 PolarHBondContact O-OG1 3.11Å; T47-T50 PolarHBondContact O-N 2.72Å; T47-T50 PolarHBondContact O-OG1 3.46Å; T50-K54 VanDerWaalsContact O-CB 3.29Å; T50-K54 WeakPolarHBondContact O-CB 3.12Å; T50-K54 PolarHBondContact O-N 3.39Å
51	Q	69	Low	71.1	Confident	28 Å²	28	74.3 Å²	74.3	13%	0.131	39%	0.385	C	S	.	.	H	α-helix	trans	-62.8	-49.5	174.9	-66	-131.8	21	0	0	111.2	T47 N48 Q49 K54 S55 R176 N180 E183	T47-Q51 WeakPolarHBondContact O-CB 3.29Å; T47-Q51 WeakPolarHBondContact O-CG 3.3Å; T47-Q51 PolarHBondContact O-N 3.39Å; N48-Q51 PolarHBondContact O-N 3.26Å; Q49-Q51 VanDerWaalsContact C-N 3.35Å; Q51-K54 WeakPolarHBondContact O-CB 3.34Å; Q51-K54 PolarHBondContact O-N 3.27Å; Q51-S55 PolarHBondContact O-N 3.16Å; Q51-S55 VanDerWaalsContact O-N 3.08Å; Q51-R176 VanDerWaalsContact CA-NH2 3.25Å; Q51-N180 PolarHBondContact OE1-OD1 3.49Å; Q51-E183 PolarHBondContact NE2-OE2 2.97Å
52	H	74	Confident	72.4	Confident	131 Å²	131	70.5 Å²	70.5	61%	0.606	37%	0.371	S	S	*	.	H	α-helix	trans	-64.3	-48.8	177	176	-95.3	0	0	0	111.4	N48 K54 S55 V56	N48-H52 WeakPolarHBondContact O-CB 3.47Å; N48-H52 PolarHBondContact O-N 3.29Å; H52-K54 VanDerWaalsContact C-N 3.28Å; H52-K54 PolarHBondContact O-N 2.86Å; H52-S55 WeakPolarHBondContact O-CA 3.24Å; H52-S55 WeakPolarHBondContact O-CB 3.36Å; H52-S55 PolarHBondContact O-N 2.88Å; H52-V56 VanDerWaalsContact CE1-CG2 3.48Å; H52-V56 WeakPolarHBondContact CE1-CG2 3.43Å; H52-V56 WeakPolarHBondContact O-CG2 3.22Å; H52-V56 PolarHBondContact O-N 3.27Å
53	S	79	Confident	73.7	Confident	38 Å²	38	73.1 Å²	73.1	27%	0.266	37%	0.374	S	S	.	.	H	α-helix	trans	-56.1	-42.3	176.3	176.1	0	0	0	0	111.9	Q49 S55 V56 V57	Q49-S53 VanDerWaalsContact O-CB 3.25Å; Q49-S53 WeakPolarHBondContact O-CB 3.11Å; Q49-S53 PolarHBondContact O-N 2.76Å; S53-S55 PolarHBondContact O-N 3.04Å; S53-V56 PolarHBondContact O-N 2.72Å; S53-V57 WeakPolarHBondContact O-CB 3.5Å; S53-V57 VanDerWaalsContact O-CG2 3.31Å; S53-V57 WeakPolarHBondContact O-CG2 3.4Å; S53-V57 PolarHBondContact O-N 2.86Å
54	K	76.1	Confident	75.2	Confident	56 Å²	56	65.7 Å²	65.7	24%	0.243	34%	0.342	C	S	.	.	H	α-helix	trans	-57.5	-49.5	172.3	-179.8	177.3	-172.1	-168.5	0	111.2	T50 Q51 H52 V56 V57 V58 L173	T50-K54 VanDerWaalsContact O-CB 3.29Å; T50-K54 WeakPolarHBondContact O-CB 3.12Å; T50-K54 PolarHBondContact O-N 3.39Å; Q51-K54 WeakPolarHBondContact O-CB 3.34Å; Q51-K54 PolarHBondContact O-N 3.27Å; H52-K54 VanDerWaalsContact C-N 3.28Å; H52-K54 PolarHBondContact O-N 2.86Å; K54-V56 VanDerWaalsContact C-N 3.32Å; K54-V56 PolarHBondContact O-N 3.45Å; K54-V57 PolarHBondContact O-N 3.48Å; K54-V58 VanDerWaalsContact O-CG2 3.27Å; K54-V58 WeakPolarHBondContact O-CG2 3.48Å; K54-V58 PolarHBondContact O-N 3.29Å; K54-L173 HydrophobicContact CD-CD1 3.87Å; K54-L173 HydrophobicContact CG-CD1 4.45Å; K54-L173 VanDerWaalsContact NZ-CD1 3.27Å
55	S	78.3	Confident	76.6	Confident	60 Å²	60	58.8 Å²	58.8	42%	0.42	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-40.1	-179.8	-165.2	0	0	0	0	112.8	Q51 H52 S53 V58 S59	Q51-S55 PolarHBondContact O-N 3.16Å; Q51-S55 VanDerWaalsContact O-N 3.08Å; H52-S55 WeakPolarHBondContact O-CA 3.24Å; H52-S55 WeakPolarHBondContact O-CB 3.36Å; H52-S55 PolarHBondContact O-N 2.88Å; S53-S55 PolarHBondContact O-N 3.04Å; S55-V58 PolarHBondContact O-N 3.21Å; S55-S59 PolarHBondContact O-N 2.92Å
56	V	83.6	Confident	78.1	Confident	39 Å²	39	57.9 Å²	57.9	24%	0.236	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-43.5	177	171.2	0	0	0	0	111	H52 S53 K54 V58 S59 F60	H52-V56 VanDerWaalsContact CE1-CG2 3.48Å; H52-V56 WeakPolarHBondContact CE1-CG2 3.43Å; H52-V56 WeakPolarHBondContact O-CG2 3.22Å; H52-V56 PolarHBondContact O-N 3.27Å; S53-V56 PolarHBondContact O-N 2.72Å; K54-V56 VanDerWaalsContact C-N 3.32Å; K54-V56 PolarHBondContact O-N 3.45Å; V56-V58 PolarHBondContact O-N 2.52Å; V56-S59 PolarHBondContact O-N 3.05Å; V56-S59 PolarHBondContact O-OG 3.39Å; V56-F60 HydrophobicContact CG1-CD2 3.59Å; V56-F60 HydrophobicContact CG1-CE2 3.14Å; V56-F60 HydrophobicContact CG1-CZ 3.87Å; V56-F60 VanDerWaalsContact O-CD2 3.23Å; V56-F60 WeakPolarHBondContact O-CD2 3.37Å; V56-F60 WeakPolarHBondContact O-CG 3.44Å; V56-F60 PolarHBondContact O-N 2.69Å
57	V	82.6	Confident	79.5	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-41.9	177.2	165.2	0	0	0	0	111.4	I27 L30 Q31 S53 K54 F60 Q61	I27-V57 HydrophobicContact CG2-CG1 4.28Å; L30-V57 HydrophobicContact CB-CG2 3.95Å; L30-V57 HydrophobicContact CD1-CG2 4.42Å; Q31-V57 HydrophobicContact CG-CG1 3.69Å; S53-V57 WeakPolarHBondContact O-CB 3.5Å; S53-V57 VanDerWaalsContact O-CG2 3.31Å; S53-V57 WeakPolarHBondContact O-CG2 3.4Å; S53-V57 PolarHBondContact O-N 2.86Å; K54-V57 PolarHBondContact O-N 3.48Å; V57-F60 PolarHBondContact O-N 3.5Å; V57-Q61 WeakPolarHBondContact O-CB 3.31Å; V57-Q61 WeakPolarHBondContact O-CG 3.09Å; V57-Q61 PolarHBondContact O-N 3.44Å
58	V	79.9	Confident	80.5	Confident	43 Å²	43	58.7 Å²	58.7	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-46.7	174.8	178.3	0	0	0	0	111.1	K54 S55 V56 F60 Q61 S62	K54-V58 VanDerWaalsContact O-CG2 3.27Å; K54-V58 WeakPolarHBondContact O-CG2 3.48Å; K54-V58 PolarHBondContact O-N 3.29Å; S55-V58 PolarHBondContact O-N 3.21Å; V56-V58 PolarHBondContact O-N 2.52Å; V58-F60 VanDerWaalsContact C-N 3.32Å; V58-F60 PolarHBondContact O-N 2.85Å; V58-Q61 PolarHBondContact O-N 3.34Å; V58-S62 WeakPolarHBondContact O-CB 3.44Å; V58-S62 PolarHBondContact O-N 2.93Å
59	S	83.3	Confident	81.5	Confident	49 Å²	49	58.9 Å²	58.9	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-65.4	-38.7	-177.2	73.3	0	0	0	0	111.3	S55 V56 R63	S55-S59 PolarHBondContact O-N 2.92Å; V56-S59 PolarHBondContact O-N 3.05Å; V56-S59 PolarHBondContact O-OG 3.39Å; S59-R63 WeakPolarHBondContact O-CB 3.25Å; S59-R63 VanDerWaalsContact O-CG 3.3Å; S59-R63 WeakPolarHBondContact O-CG 3.47Å; S59-R63 PolarHBondContact O-N 2.87Å
60	F	86.8	Confident	82.6	Confident	98 Å²	98	57.7 Å²	57.7	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-66	-40.9	173.1	-69.9	-39.6	0	0	0	112.9	I27 V56 V57 V58 R63 L64	I27-F60 HydrophobicContact CD1-CB 3.91Å; I27-F60 HydrophobicContact CG1-CB 4.15Å; V56-F60 HydrophobicContact CG1-CD2 3.59Å; V56-F60 HydrophobicContact CG1-CE2 3.14Å; V56-F60 HydrophobicContact CG1-CZ 3.87Å; V56-F60 VanDerWaalsContact O-CD2 3.23Å; V56-F60 WeakPolarHBondContact O-CD2 3.37Å; V56-F60 WeakPolarHBondContact O-CG 3.44Å; V56-F60 PolarHBondContact O-N 2.69Å; V57-F60 PolarHBondContact O-N 3.5Å; V58-F60 VanDerWaalsContact C-N 3.32Å; V58-F60 PolarHBondContact O-N 2.85Å; F60-R63 PolarHBondContact O-N 3.21Å; F60-L64 VanDerWaalsContact O-CB 3.29Å; F60-L64 WeakPolarHBondContact O-CB 2.96Å; F60-L64 PolarHBondContact O-N 3.49Å
61	Q	84.1	Confident	83.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-63	-44.6	175.7	-73	161.1	2.8	0	0	112.2	I27 Q31 V57 V58 L64 A65 L163 M166 V167 Q170	I27-Q61 HydrophobicContact CD1-CG 4.46Å; I27-Q61 HydrophobicContact CG2-CG 3.64Å; Q31-Q61 VanDerWaalsContact NE2-NE2 3.13Å; V57-Q61 WeakPolarHBondContact O-CB 3.31Å; V57-Q61 WeakPolarHBondContact O-CG 3.09Å; V57-Q61 PolarHBondContact O-N 3.44Å; V58-Q61 PolarHBondContact O-N 3.34Å; Q61-L64 PolarHBondContact O-N 3.03Å; Q61-A65 VanDerWaalsContact O-CB 3.29Å; Q61-A65 WeakPolarHBondContact O-CB 3.42Å; Q61-A65 PolarHBondContact O-N 3.47Å; Q61-L163 HydrophobicContact CB-CD2 4.05Å; Q61-L163 HydrophobicContact CG-CD2 3.99Å; Q61-M166 VanDerWaalsContact CD-SD 3.57Å; Q61-M166 HydrophobicContact CG-SD 3.88Å; Q61-M166 PolarHBondContact NE2-SD 2.89Å; Q61-V167 HydrophobicContact CB-CG2 4.38Å; Q61-Q170 VanDerWaalsContact NE2-NE2 3.17Å
62	S	84.5	Confident	84.5	Confident	78 Å²	78	60.4 Å²	60.4	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-45.4	177	178.5	0	0	0	0	111.2	V58 A65 S66	V58-S62 WeakPolarHBondContact O-CB 3.44Å; V58-S62 PolarHBondContact O-N 2.93Å; S62-A65 PolarHBondContact O-N 3.25Å; S62-S66 WeakPolarHBondContact O-CB 3.29Å; S62-S66 PolarHBondContact O-N 2.88Å
63	R	87.8	Confident	85.3	Confident	173 Å²	173	57.2 Å²	57.2	65%	0.653	31%	0.314	S	S	*	.	H	α-helix	trans	-61.7	-44.5	174.3	-72.9	177.4	-177.9	-86.2	1	112.1	S59 F60 S66 I67	S59-R63 WeakPolarHBondContact O-CB 3.25Å; S59-R63 VanDerWaalsContact O-CG 3.3Å; S59-R63 WeakPolarHBondContact O-CG 3.47Å; S59-R63 PolarHBondContact O-N 2.87Å; F60-R63 PolarHBondContact O-N 3.21Å; R63-S66 PolarHBondContact O-N 3.36Å; R63-I67 WeakPolarHBondContact O-CB 3.34Å; R63-I67 VanDerWaalsContact O-CG1 3.29Å; R63-I67 WeakPolarHBondContact O-CG1 3.41Å; R63-I67 PolarHBondContact O-N 3.18Å
64	L	88.5	Confident	85.8	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-40.6	178.4	-173.9	62.7	0	0	0	111.5	I20 L23 N24 I27 F60 Q61 I67 S68 L163	I20-L64 HydrophobicContact CB-CD1 4.46Å; I20-L64 HydrophobicContact CG1-CD1 4.47Å; I20-L64 HydrophobicContact CG2-CD1 3.99Å; L23-L64 HydrophobicContact CB-CD1 3.86Å; L23-L64 HydrophobicContact CB-CD2 4.2Å; L23-L64 HydrophobicContact CD1-CD1 3.95Å; N24-L64 HydrophobicContact CB-CD2 4.04Å; I27-L64 HydrophobicContact CD1-CB 4.24Å; I27-L64 HydrophobicContact CD1-CD2 3.71Å; F60-L64 VanDerWaalsContact O-CB 3.29Å; F60-L64 WeakPolarHBondContact O-CB 2.96Å; F60-L64 PolarHBondContact O-N 3.49Å; Q61-L64 PolarHBondContact O-N 3.03Å; L64-I67 PolarHBondContact O-N 3.04Å; L64-S68 VanDerWaalsContact O-CB 3.32Å; L64-S68 WeakPolarHBondContact O-CB 3.49Å; L64-S68 PolarHBondContact O-N 2.9Å; L64-S68 PolarHBondContact O-OG 2.78Å; L64-L163 HydrophobicContact CB-CD1 4.49Å; L64-L163 HydrophobicContact CD2-CD1 4.28Å; L64-L163 HydrophobicContact CD2-CD2 4.28Å; L64-L163 HydrophobicContact CG-CD1 4.17Å
65	A	86.1	Confident	86.4	Confident	31 Å²	31	56.7 Å²	56.7	26%	0.256	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-42.6	174.2	0	0	0	0	0	111.6	Q61 S62 S68 S69 L163	Q61-A65 VanDerWaalsContact O-CB 3.29Å; Q61-A65 WeakPolarHBondContact O-CB 3.42Å; Q61-A65 PolarHBondContact O-N 3.47Å; S62-A65 PolarHBondContact O-N 3.25Å; A65-S68 WeakPolarHBondContact CA-OG 3.36Å; A65-S68 PolarHBondContact O-OG 3.21Å; A65-S68 VanDerWaalsContact O-OG 3.09Å; A65-S69 VanDerWaalsContact O-CB 3.28Å; A65-S69 WeakPolarHBondContact O-CB 3.44Å; A65-S69 PolarHBondContact O-N 2.92Å; A65-L163 HydrophobicContact CB-CD1 4.15Å
66	S	88	Confident	86.9	Confident	75 Å²	75	57.8 Å²	57.8	52%	0.524	31%	0.312	S	S	.	.	H	α-helix	trans	-62.9	-50.2	175.7	-169.7	0	0	0	0	111.8	S62 R63 S68 S69 E70	S62-S66 WeakPolarHBondContact O-CB 3.29Å; S62-S66 PolarHBondContact O-N 2.88Å; R63-S66 PolarHBondContact O-N 3.36Å; S66-S68 PolarHBondContact O-N 2.99Å; S66-S69 WeakPolarHBondContact O-CB 3.31Å; S66-S69 PolarHBondContact O-N 3.28Å; S66-E70 PolarHBondContact O-N 3.46Å
67	I	88.1	Confident	87.1	Confident	83 Å²	83	61.1 Å²	61.1	43%	0.426	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-44	-179.2	-69.5	165.4	0	0	0	111	I20 R63 L64 S69 E70 F71	I20-I67 HydrophobicContact CD1-CG2 4.47Å; R63-I67 WeakPolarHBondContact O-CB 3.34Å; R63-I67 VanDerWaalsContact O-CG1 3.29Å; R63-I67 WeakPolarHBondContact O-CG1 3.41Å; R63-I67 PolarHBondContact O-N 3.18Å; L64-I67 PolarHBondContact O-N 3.04Å; I67-S69 VanDerWaalsContact C-N 3.31Å; I67-S69 PolarHBondContact O-N 3.44Å; I67-E70 PolarHBondContact O-N 3.41Å; I67-F71 WeakPolarHBondContact O-CB 3.37Å; I67-F71 PolarHBondContact O-N 3.05Å
68	S	86.6	Confident	87.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-34.7	176.8	50.4	0	0	0	0	112	L64 A65 S66 R72 L156 F160	L64-S68 VanDerWaalsContact O-CB 3.32Å; L64-S68 WeakPolarHBondContact O-CB 3.49Å; L64-S68 PolarHBondContact O-N 2.9Å; L64-S68 PolarHBondContact O-OG 2.78Å; A65-S68 WeakPolarHBondContact CA-OG 3.36Å; A65-S68 PolarHBondContact O-OG 3.21Å; A65-S68 VanDerWaalsContact O-OG 3.09Å; S66-S68 PolarHBondContact O-N 2.99Å; S68-R72 VanDerWaalsContact O-CB 3.3Å; S68-R72 WeakPolarHBondContact O-CB 3.48Å; S68-R72 PolarHBondContact O-N 3.39Å; S68-L156 VanDerWaalsContact O-CD2 3.29Å; S68-L156 WeakPolarHBondContact O-CD2 3.47Å; S68-F160 VanDerWaalsContact C-CZ 3.46Å; S68-F160 WeakPolarHBondContact OG-CE1 3.44Å; S68-F160 WeakPolarHBondContact OG-CZ 3.47Å
69	S	87.6	Confident	87.5	Confident	70 Å²	70	61.8 Å²	61.8	49%	0.49	33%	0.325	S	S	.	.	H	α-helix	trans	-67	-42.5	175.1	-173.8	0	0	0	0	111.7	A65 S66 I67 R72 S73	A65-S69 VanDerWaalsContact O-CB 3.28Å; A65-S69 WeakPolarHBondContact O-CB 3.44Å; A65-S69 PolarHBondContact O-N 2.92Å; S66-S69 WeakPolarHBondContact O-CB 3.31Å; S66-S69 PolarHBondContact O-N 3.28Å; I67-S69 VanDerWaalsContact C-N 3.31Å; I67-S69 PolarHBondContact O-N 3.44Å; S69-R72 PolarHBondContact O-N 2.89Å; S69-S73 PolarHBondContact O-N 2.95Å
70	E	90.7	Very high	87.7	Confident	128 Å²	128	64.6 Å²	64.6	60%	0.598	33%	0.333	S	S	*	.	H	α-helix	trans	-64.4	-47.4	175.7	-174.3	176.2	-177	0	0	111.1	S66 I67 R72 S73 V74	S66-E70 PolarHBondContact O-N 3.46Å; I67-E70 PolarHBondContact O-N 3.41Å; E70-R72 VanDerWaalsContact C-N 3.33Å; E70-R72 PolarHBondContact O-N 3.07Å; E70-S73 WeakPolarHBondContact O-CB 3.4Å; E70-S73 PolarHBondContact O-N 3.48Å; E70-S73 VanDerWaalsContact O-N 3.1Å; E70-V74 WeakPolarHBondContact O-CG2 3.45Å; E70-V74 PolarHBondContact O-N 2.96Å
71	F	89.9	Confident	87.6	Confident	18 Å²	18	64 Å²	64	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-59.2	-44.2	176.7	-177.6	-127.6	0	0	0	111.8	T13 I16 I20 I67 S73 V74 L75 T152 L156	T13-F71 HydrophobicContact CG2-CZ 3.85Å; I16-F71 HydrophobicContact CB-CD2 4.43Å; I16-F71 HydrophobicContact CB-CE1 4.43Å; I16-F71 HydrophobicContact CB-CE2 3.94Å; I16-F71 HydrophobicContact CB-CZ 3.92Å; I16-F71 HydrophobicContact CD1-CD2 4.25Å; I16-F71 HydrophobicContact CD1-CE2 3.92Å; I16-F71 HydrophobicContact CG2-CD1 3.89Å; I16-F71 HydrophobicContact CG2-CD2 3.7Å; I16-F71 HydrophobicContact CG2-CE1 3.87Å; I16-F71 HydrophobicContact CG2-CE2 3.67Å; I16-F71 HydrophobicContact CG2-CG 3.81Å; I16-F71 HydrophobicContact CG2-CZ 3.74Å; I20-F71 HydrophobicContact CD1-CB 4.34Å; I20-F71 HydrophobicContact CD1-CD1 3.82Å; I20-F71 HydrophobicContact CD1-CE1 4.47Å; I20-F71 HydrophobicContact CD1-CG 4.31Å; I67-F71 WeakPolarHBondContact O-CB 3.37Å; I67-F71 PolarHBondContact O-N 3.05Å; F71-S73 VanDerWaalsContact C-N 3.35Å; F71-S73 PolarHBondContact O-N 2.71Å; F71-V74 PolarHBondContact O-N 3.16Å; F71-L75 HydrophobicContact CD1-CD1 4.05Å; F71-L75 HydrophobicContact CD2-CG 4.34Å; F71-L75 HydrophobicContact CE1-CD1 3.67Å; F71-L75 HydrophobicContact CE1-CG 4.43Å; F71-L75 HydrophobicContact CE2-CD1 4.21Å; F71-L75 HydrophobicContact CE2-CD2 4.17Å; F71-L75 HydrophobicContact CE2-CG 4.1Å; F71-L75 HydrophobicContact CG-CD1 4.49Å; F71-L75 HydrophobicContact CZ-CD1 3.78Å; F71-L75 HydrophobicContact CZ-CD2 4.27Å; F71-L75 HydrophobicContact CZ-CG 4.17Å; F71-L75 WeakPolarHBondContact O-CG 3.5Å; F71-L75 PolarHBondContact O-N 2.96Å; F71-T152 HydrophobicContact CE1-CG2 3.88Å; F71-T152 HydrophobicContact CZ-CG2 4.39Å; F71-L156 HydrophobicContact CD1-CD1 4.02Å; F71-L156 HydrophobicContact CD1-CD2 3.7Å; F71-L156 HydrophobicContact CD1-CG 4.49Å; F71-L156 HydrophobicContact CE1-CD1 4.06Å; F71-L156 HydrophobicContact CE1-CD2 4.5Å
72	R	89.2	Confident	87.5	Confident	93 Å²	93	64.4 Å²	64.4	35%	0.351	34%	0.337	S	S	.	.	H	α-helix	trans	-58.2	-45.7	173.4	178.9	178.2	170.9	174.3	0.8	111.8	S68 S69 E70 V74 L75 E76 L156	S68-R72 VanDerWaalsContact O-CB 3.3Å; S68-R72 WeakPolarHBondContact O-CB 3.48Å; S68-R72 PolarHBondContact O-N 3.39Å; S69-R72 PolarHBondContact O-N 2.89Å; E70-R72 VanDerWaalsContact C-N 3.33Å; E70-R72 PolarHBondContact O-N 3.07Å; R72-V74 VanDerWaalsContact C-N 3.33Å; R72-V74 PolarHBondContact O-N 3.46Å; R72-L75 PolarHBondContact O-N 3.49Å; R72-E76 HydrophobicContact CG-CG 4.35Å; R72-E76 IonicContact CZ-OE1 3.37Å; R72-E76 IonicContact NE-OE1 2.78Å; R72-E76 PolarHBondContact NE-OE1 3.12Å; R72-E76 IonicContact NH2-OE1 3.06Å; R72-E76 PolarHBondContact NH2-OE1 3.12Å; R72-E76 WeakPolarHBondContact O-CB 3.44Å; R72-E76 WeakPolarHBondContact O-CG 3.3Å; R72-E76 PolarHBondContact O-N 3.35Å; R72-L156 HydrophobicContact CB-CD2 4.05Å
73	S	90.6	Very high	87.5	Confident	63 Å²	63	65.9 Å²	65.9	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-40.7	178.5	-175.7	0	0	0	0	112.1	S69 E70 F71 E76 M77	S69-S73 PolarHBondContact O-N 2.95Å; E70-S73 WeakPolarHBondContact O-CB 3.4Å; E70-S73 PolarHBondContact O-N 3.48Å; E70-S73 VanDerWaalsContact O-N 3.1Å; F71-S73 VanDerWaalsContact C-N 3.35Å; F71-S73 PolarHBondContact O-N 2.71Å; S73-E76 PolarHBondContact O-N 3.17Å; S73-M77 WeakPolarHBondContact O-CB 3.41Å; S73-M77 PolarHBondContact O-N 3.42Å
74	V	90	Very high	87.4	Confident	82 Å²	82	62.3 Å²	62.3	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-42.6	174.7	171.9	0	0	0	0	111.2	E70 F71 R72 M77 R78	E70-V74 WeakPolarHBondContact O-CG2 3.45Å; E70-V74 PolarHBondContact O-N 2.96Å; F71-V74 PolarHBondContact O-N 3.16Å; R72-V74 VanDerWaalsContact C-N 3.33Å; R72-V74 PolarHBondContact O-N 3.46Å; V74-M77 PolarHBondContact O-N 3.36Å; V74-R78 WeakPolarHBondContact O-CB 3.43Å; V74-R78 PolarHBondContact O-N 2.95Å
75	L	87.4	Confident	87.1	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-65.9	-40.2	176.5	-72.1	-176.4	0	0	0	112.6	T13 F71 R72 R78 T79 I149 T152 I153	T13-L75 HydrophobicContact CG2-CD2 4Å; F71-L75 HydrophobicContact CD1-CD1 4.05Å; F71-L75 HydrophobicContact CD2-CG 4.34Å; F71-L75 HydrophobicContact CE1-CD1 3.67Å; F71-L75 HydrophobicContact CE1-CG 4.43Å; F71-L75 HydrophobicContact CE2-CD1 4.21Å; F71-L75 HydrophobicContact CE2-CD2 4.17Å; F71-L75 HydrophobicContact CE2-CG 4.1Å; F71-L75 HydrophobicContact CG-CD1 4.49Å; F71-L75 HydrophobicContact CZ-CD1 3.78Å; F71-L75 HydrophobicContact CZ-CD2 4.27Å; F71-L75 HydrophobicContact CZ-CG 4.17Å; F71-L75 WeakPolarHBondContact O-CG 3.5Å; F71-L75 PolarHBondContact O-N 2.96Å; R72-L75 PolarHBondContact O-N 3.49Å; L75-R78 PolarHBondContact O-N 3.4Å; L75-T79 WeakPolarHBondContact O-CB 3.27Å; L75-T79 PolarHBondContact O-N 3.45Å; L75-T79 PolarHBondContact O-OG1 2.96Å; L75-I149 HydrophobicContact CB-CG2 3.83Å; L75-I149 HydrophobicContact CD1-CG2 4.42Å; L75-I149 HydrophobicContact CD2-CG1 4.23Å; L75-I149 HydrophobicContact CD2-CG2 4.12Å; L75-I149 HydrophobicContact CG-CG2 4.35Å; L75-T152 HydrophobicContact CD1-CG2 3.78Å; L75-I153 HydrophobicContact CB-CD1 4.26Å; L75-I153 HydrophobicContact CB-CG1 4.24Å; L75-I153 HydrophobicContact CD1-CG1 4.23Å
76	E	89.4	Confident	86.7	Confident	83 Å²	83	71.8 Å²	71.8	39%	0.388	36%	0.357	S	S	.	.	H	α-helix	trans	-64.4	-45.2	174.2	-75.4	176.8	176	0	0	110.7	R72 S73 R78 T79 E80 I153	R72-E76 HydrophobicContact CG-CG 4.35Å; R72-E76 IonicContact CZ-OE1 3.37Å; R72-E76 IonicContact NE-OE1 2.78Å; R72-E76 PolarHBondContact NE-OE1 3.12Å; R72-E76 IonicContact NH2-OE1 3.06Å; R72-E76 PolarHBondContact NH2-OE1 3.12Å; R72-E76 WeakPolarHBondContact O-CB 3.44Å; R72-E76 WeakPolarHBondContact O-CG 3.3Å; R72-E76 PolarHBondContact O-N 3.35Å; S73-E76 PolarHBondContact O-N 3.17Å; E76-R78 PolarHBondContact O-N 3.15Å; E76-T79 WeakPolarHBondContact O-CB 3.19Å; E76-T79 PolarHBondContact O-N 3.31Å; E76-E80 WeakPolarHBondContact O-CB 3.21Å; E76-E80 PolarHBondContact O-N 3.36Å; E76-I153 HydrophobicContact CG-CD1 4.18Å
77	M	88.9	Confident	86.4	Confident	109 Å²	109	72.5 Å²	72.5	54%	0.537	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-42.5	175.5	-174.1	-170.2	-64.2	0	0	111.7	S73 V74 E80 N81	S73-M77 WeakPolarHBondContact O-CB 3.41Å; S73-M77 PolarHBondContact O-N 3.42Å; V74-M77 PolarHBondContact O-N 3.36Å; M77-E80 PolarHBondContact O-N 3.5Å; M77-N81 VanDerWaalsContact O-CB 3.25Å; M77-N81 WeakPolarHBondContact O-CB 3.4Å; M77-N81 PolarHBondContact O-N 3.06Å; M77-N81 PolarHBondContact O-ND2 3.45Å
78	R	84.2	Confident	86.2	Confident	46 Å²	46	76.8 Å²	76.8	17%	0.174	37%	0.365	C	S	.	.	H	α-helix	trans	-62.7	-44.4	174.9	178.8	177.5	166.2	112.3	-19.7	110.8	D10 V74 L75 E76 E80 N81 M82 I149	D10-R78 IonicContact OD1-CZ 3.62Å; D10-R78 IonicContact OD1-NH2 2.84Å; D10-R78 PolarHBondContact OD1-NH2 2.91Å; V74-R78 WeakPolarHBondContact O-CB 3.43Å; V74-R78 PolarHBondContact O-N 2.95Å; L75-R78 PolarHBondContact O-N 3.4Å; E76-R78 PolarHBondContact O-N 3.15Å; R78-E80 VanDerWaalsContact C-N 3.34Å; R78-E80 PolarHBondContact O-N 2.91Å; R78-N81 PolarHBondContact O-N 3.49Å; R78-M82 HydrophobicContact CG-CE 3.98Å; R78-M82 VanDerWaalsContact O-CB 3.28Å; R78-M82 WeakPolarHBondContact O-CB 3.44Å; R78-M82 VanDerWaalsContact O-CG 3.3Å; R78-M82 WeakPolarHBondContact O-CG 3.38Å; R78-M82 PolarHBondContact O-N 3.16Å; R78-I149 HydrophobicContact CG-CD1 4.17Å
79	T	85.2	Confident	85.6	Confident	11 Å²	11	81 Å²	81	7%	0.067	38%	0.381	C	S	.	.	H	α-helix	trans	-59.4	-45.7	175.8	-60.7	0	0	0	0	111	L75 E76 M82 K83 M146 I149	L75-T79 WeakPolarHBondContact O-CB 3.27Å; L75-T79 PolarHBondContact O-N 3.45Å; L75-T79 PolarHBondContact O-OG1 2.96Å; E76-T79 WeakPolarHBondContact O-CB 3.19Å; E76-T79 PolarHBondContact O-N 3.31Å; T79-M82 PolarHBondContact O-N 3.45Å; T79-K83 HydrophobicContact CG2-CD 4.21Å; T79-K83 WeakPolarHBondContact O-CB 3.44Å; T79-K83 VanDerWaalsContact O-CG 3.29Å; T79-K83 WeakPolarHBondContact O-CG 3.23Å; T79-K83 PolarHBondContact O-N 3.4Å; T79-M146 HydrophobicContact CG2-SD 3.83Å; T79-I149 WeakPolarHBondContact OG1-CG2 3.44Å
80	E	87.8	Confident	85	Confident	108 Å²	108	81.9 Å²	81.9	51%	0.505	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-49.9	178.3	-159.6	-162.6	154	0	0	111.7	E76 M77 R78 M82 K83 H84	E76-E80 WeakPolarHBondContact O-CB 3.21Å; E76-E80 PolarHBondContact O-N 3.36Å; M77-E80 PolarHBondContact O-N 3.5Å; R78-E80 VanDerWaalsContact C-N 3.34Å; R78-E80 PolarHBondContact O-N 2.91Å; E80-M82 PolarHBondContact O-N 3.35Å; E80-K83 CarbonylContact O-C 3.6Å; E80-K83 WeakPolarHBondContact O-CA 3.48Å; E80-K83 WeakPolarHBondContact O-CB 3.26Å; E80-K83 PolarHBondContact O-N 2.99Å; E80-H84 PolarHBondContact O-CD2 3.42Å; E80-H84 PolarHBondContact O-N 2.85Å; E80-H84 IonicContact OE1-CD2 3.81Å; E80-H84 IonicContact OE1-CE1 2.89Å; E80-H84 IonicContact OE1-NE2 3.83Å; E80-H84 PolarHBondContact OE1-NE2 3Å
81	N	85.8	Confident	84.3	Confident	85 Å²	85	83.1 Å²	83.1	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-55.3	-41.6	175.5	-84.2	-29.8	0	0	0	111.1	M77 R78 H84 Q85	M77-N81 VanDerWaalsContact O-CB 3.25Å; M77-N81 WeakPolarHBondContact O-CB 3.4Å; M77-N81 PolarHBondContact O-N 3.06Å; M77-N81 PolarHBondContact O-ND2 3.45Å; R78-N81 PolarHBondContact O-N 3.49Å; N81-H84 PolarHBondContact O-N 3.26Å; N81-Q85 WeakPolarHBondContact O-CB 3.34Å; N81-Q85 WeakPolarHBondContact O-CG 3.24Å; N81-Q85 PolarHBondContact O-N 2.93Å
82	M	81.6	Confident	83.3	Confident	11 Å²	11	89.8 Å²	89.8	5%	0.054	41%	0.41	C	S	.	.	H	α-helix	trans	-72.6	-33.4	179.2	-76.8	-161.5	-72.5	0	0	113	M6 R78 T79 E80 R86 R142 T145 M146 I149	M6-M82 HydrophobicContact CE-SD 3.78Å; R78-M82 HydrophobicContact CG-CE 3.98Å; R78-M82 VanDerWaalsContact O-CB 3.28Å; R78-M82 WeakPolarHBondContact O-CB 3.44Å; R78-M82 VanDerWaalsContact O-CG 3.3Å; R78-M82 WeakPolarHBondContact O-CG 3.38Å; R78-M82 PolarHBondContact O-N 3.16Å; T79-M82 PolarHBondContact O-N 3.45Å; E80-M82 PolarHBondContact O-N 3.35Å; M82-R86 PolarHBondContact O-N 2.81Å; M82-R142 PolarHBondContact O-NH2 3.08Å; M82-R142 HydrophobicContact SD-CG 4.14Å; M82-T145 HydrophobicContact CE-CG2 4.05Å; M82-M146 HydrophobicContact CB-CE 3.05Å; M82-M146 HydrophobicContact CB-SD 4.37Å; M82-M146 HydrophobicContact CE-CE 3.45Å; M82-M146 VanDerWaalsContact CE-CE 3.45Å; M82-M146 HydrophobicContact CE-CG 3.98Å; M82-M146 HydrophobicContact CE-SD 3.29Å; M82-M146 WeakPolarHBondContact CE-SD 3.29Å; M82-M146 HydrophobicContact CG-CE 4.03Å; M82-M146 HydrophobicContact SD-CE 3.85Å; M82-M146 HydrophobicContact SD-SD 4.39Å; M82-I149 HydrophobicContact CE-CD1 3.56Å
83	K	84.5	Confident	82.3	Confident	109 Å²	109	88.9 Å²	88.9	47%	0.474	42%	0.418	S	S	.	.	H	α-helix	trans	-64.6	-45.4	170.6	-76.6	173	-179.5	175.3	0	111.2	T79 E80 Q85 R86 L87 M146	T79-K83 HydrophobicContact CG2-CD 4.21Å; T79-K83 WeakPolarHBondContact O-CB 3.44Å; T79-K83 VanDerWaalsContact O-CG 3.29Å; T79-K83 WeakPolarHBondContact O-CG 3.23Å; T79-K83 PolarHBondContact O-N 3.4Å; E80-K83 CarbonylContact O-C 3.6Å; E80-K83 WeakPolarHBondContact O-CA 3.48Å; E80-K83 WeakPolarHBondContact O-CB 3.26Å; E80-K83 PolarHBondContact O-N 2.99Å; K83-Q85 PolarHBondContact O-N 3.32Å; K83-R86 WeakPolarHBondContact O-CA 3.36Å; K83-R86 WeakPolarHBondContact O-CB 3.18Å; K83-R86 PolarHBondContact O-N 3.05Å; K83-R86 VanDerWaalsContact O-N 3.08Å; K83-L87 WeakPolarHBondContact O-CG 3.47Å; K83-L87 PolarHBondContact O-N 3.41Å; K83-M146 HydrophobicContact CG-CE 4.37Å
84	H	85.1	Confident	80.8	Confident	98 Å²	98	90.2 Å²	90.2	45%	0.454	43%	0.427	S	S	.	.	H	α-helix	trans	-59.3	-45.1	175.6	-78.7	-61.3	0	0	0	112.3	E80 N81 R86 L87 R88	E80-H84 PolarHBondContact O-CD2 3.42Å; E80-H84 PolarHBondContact O-N 2.85Å; E80-H84 IonicContact OE1-CD2 3.81Å; E80-H84 IonicContact OE1-CE1 2.89Å; E80-H84 IonicContact OE1-NE2 3.83Å; E80-H84 PolarHBondContact OE1-NE2 3Å; N81-H84 PolarHBondContact O-N 3.26Å; H84-R86 VanDerWaalsContact C-N 3.28Å; H84-R86 PolarHBondContact O-N 3.4Å; H84-L87 PolarHBondContact O-N 3.16Å; H84-R88 WeakPolarHBondContact O-CB 3.39Å; H84-R88 PolarHBondContact O-N 2.85Å
85	Q	82.2	Confident	79	Confident	100 Å²	100	91.4 Å²	91.4	47%	0.467	44%	0.435	S	S	.	.	H	α-helix	trans	-62.9	-34.3	174.9	-77.5	178.8	11.5	0	0	112.6	N81 K83 R89	N81-Q85 WeakPolarHBondContact O-CB 3.34Å; N81-Q85 WeakPolarHBondContact O-CG 3.24Å; N81-Q85 PolarHBondContact O-N 2.93Å; K83-Q85 PolarHBondContact O-N 3.32Å; Q85-R89 VanDerWaalsContact O-CB 3.27Å; Q85-R89 WeakPolarHBondContact O-CB 3.38Å; Q85-R89 PolarHBondContact O-N 3.41Å
86	R	78.6	Confident	77.3	Confident	134 Å²	134	98.9 Å²	98.9	51%	0.506	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-51.1	174.6	-178.4	177.9	-178	151.2	2.7	111.1	M82 K83 H84 R88 R89 E90	M82-R86 PolarHBondContact O-N 2.81Å; K83-R86 WeakPolarHBondContact O-CA 3.36Å; K83-R86 WeakPolarHBondContact O-CB 3.18Å; K83-R86 PolarHBondContact O-N 3.05Å; K83-R86 VanDerWaalsContact O-N 3.08Å; H84-R86 VanDerWaalsContact C-N 3.28Å; H84-R86 PolarHBondContact O-N 3.4Å; R86-R88 VanDerWaalsContact C-N 3.3Å; R86-R88 PolarHBondContact O-N 2.88Å; R86-R89 CarbonylContact O-C 3.44Å; R86-R89 WeakPolarHBondContact O-CB 3.38Å; R86-R89 PolarHBondContact O-N 2.92Å; R86-R89 VanDerWaalsContact O-N 3.11Å; R86-E90 HydrophobicContact CG-CG 4.43Å; R86-E90 VanDerWaalsContact CG-OE1 3.31Å; R86-E90 WeakPolarHBondContact CG-OE1 3.33Å; R86-E90 IonicContact CZ-OE1 3.93Å; R86-E90 IonicContact NE-OE1 3.91Å; R86-E90 PolarHBondContact NE-OE1 3.32Å; R86-E90 IonicContact NH2-OE1 2.82Å; R86-E90 WeakPolarHBondContact O-CG 3.36Å; R86-E90 PolarHBondContact O-N 2.98Å
87	L	82	Confident	75.3	Confident	89 Å²	89	100.7 Å²	100.7	47%	0.466	49%	0.489	S	S	.	.	H	α-helix	trans	-58.5	-42.7	177.2	-69.9	172.4	0	0	0	111.8	K83 H84 E90 K91	K83-L87 WeakPolarHBondContact O-CG 3.47Å; K83-L87 PolarHBondContact O-N 3.41Å; H84-L87 PolarHBondContact O-N 3.16Å; L87-E90 PolarHBondContact O-N 3.45Å; L87-K91 WeakPolarHBondContact O-CB 3.49Å; L87-K91 VanDerWaalsContact O-CG 3.3Å; L87-K91 WeakPolarHBondContact O-CG 3.49Å; L87-K91 PolarHBondContact O-N 3.02Å
88	R	82	Confident	73.4	Confident	174 Å²	174	101.2 Å²	101.2	66%	0.657	50%	0.498	S	S	*	.	H	α-helix	trans	-62	-45.3	175.8	-177.2	176.4	142.9	171.2	-7	111.1	H84 R86 K91 F92	H84-R88 WeakPolarHBondContact O-CB 3.39Å; H84-R88 PolarHBondContact O-N 2.85Å; R86-R88 VanDerWaalsContact C-N 3.3Å; R86-R88 PolarHBondContact O-N 2.88Å; R88-K91 PolarHBondContact O-N 3.36Å; R88-F92 HydrophobicContact CG-CD2 3.58Å; R88-F92 HydrophobicContact CG-CE2 3.53Å; R88-F92 WeakPolarHBondContact O-CD2 3.15Å; R88-F92 PolarHBondContact O-N 2.99Å
89	R	74.5	Confident	71.5	Confident	89 Å²	89	103.6 Å²	103.6	34%	0.336	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-44.5	176.7	-173.7	179.1	-56.4	-177.8	3.1	111.2	Q85 R86 K91 F92 S93 Y138	Q85-R89 VanDerWaalsContact O-CB 3.27Å; Q85-R89 WeakPolarHBondContact O-CB 3.38Å; Q85-R89 PolarHBondContact O-N 3.41Å; R86-R89 CarbonylContact O-C 3.44Å; R86-R89 WeakPolarHBondContact O-CB 3.38Å; R86-R89 PolarHBondContact O-N 2.92Å; R86-R89 VanDerWaalsContact O-N 3.11Å; R89-K91 VanDerWaalsContact C-N 3.34Å; R89-K91 PolarHBondContact O-N 3.25Å; R89-F92 CarbonylContact O-C 3.54Å; R89-F92 PolarHBondContact O-N 2.92Å; R89-S93 WeakPolarHBondContact O-CA 3.45Å; R89-S93 WeakPolarHBondContact O-CB 3.49Å; R89-S93 PolarHBondContact O-N 3.48Å; R89-Y138 VanDerWaalsContact CZ-CE1 3.47Å; R89-Y138 PolarHBondContact NH2-OH 2.98Å
90	E	76.2	Confident	69.7	Low	87 Å²	87	109.2 Å²	109.2	41%	0.407	56%	0.559	S	S	.	*	H	α-helix	trans	-58.1	-48.1	176	-73.7	169.1	-176.4	0	0	109.7	R86 L87 F92 S93 S94	R86-E90 HydrophobicContact CG-CG 4.43Å; R86-E90 VanDerWaalsContact CG-OE1 3.31Å; R86-E90 WeakPolarHBondContact CG-OE1 3.33Å; R86-E90 IonicContact CZ-OE1 3.93Å; R86-E90 IonicContact NE-OE1 3.91Å; R86-E90 PolarHBondContact NE-OE1 3.32Å; R86-E90 IonicContact NH2-OE1 2.82Å; R86-E90 WeakPolarHBondContact O-CG 3.36Å; R86-E90 PolarHBondContact O-N 2.98Å; L87-E90 PolarHBondContact O-N 3.45Å; E90-F92 VanDerWaalsContact C-N 3.34Å; E90-F92 PolarHBondContact O-N 3.3Å; E90-S93 PolarHBondContact O-N 3.27Å; E90-S94 WeakPolarHBondContact O-CB 3.29Å; E90-S94 PolarHBondContact O-N 2.95Å; E90-S94 PolarHBondContact O-OG 2.96Å
91	K	74.4	Confident	67.6	Low	154 Å²	154	108.3 Å²	108.3	67%	0.67	57%	0.565	S	S	*	*	H	α-helix	trans	-59.7	-34.4	176.5	-73.7	177	-178.3	-175.6	0	115.1	L87 R88 R89	L87-K91 WeakPolarHBondContact O-CB 3.49Å; L87-K91 VanDerWaalsContact O-CG 3.3Å; L87-K91 WeakPolarHBondContact O-CG 3.49Å; L87-K91 PolarHBondContact O-N 3.02Å; R88-K91 PolarHBondContact O-N 3.36Å; R89-K91 VanDerWaalsContact C-N 3.34Å; R89-K91 PolarHBondContact O-N 3.25Å
92	F	70.7	Confident	65.9	Low	158 Å²	158	112 Å²	112	69%	0.693	58%	0.583	S	S	*	*	H	α-helix	trans	-101.8	-11.3	-177.6	-64.1	-58.3	0	0	0	114.4	R88 R89 E90	R88-F92 HydrophobicContact CG-CD2 3.58Å; R88-F92 HydrophobicContact CG-CE2 3.53Å; R88-F92 WeakPolarHBondContact O-CD2 3.15Å; R88-F92 PolarHBondContact O-N 2.99Å; R89-F92 CarbonylContact O-C 3.54Å; R89-F92 PolarHBondContact O-N 2.92Å; E90-F92 VanDerWaalsContact C-N 3.34Å; E90-F92 PolarHBondContact O-N 3.3Å
93	S	66.8	Low	64.2	Low	75 Å²	75	116.7 Å²	116.7	52%	0.524	62%	0.615	S	S	.	*	H	α-helix	trans	-106	-13	179.3	-175.1	0	0	0	0	112.6	R89 E90 T95	R89-S93 WeakPolarHBondContact O-CA 3.45Å; R89-S93 WeakPolarHBondContact O-CB 3.49Å; R89-S93 PolarHBondContact O-N 3.48Å; E90-S93 PolarHBondContact O-N 3.27Å; S93-T95 VanDerWaalsContact C-N 3.35Å
94	S	58.9	Low	62.3	Low	90 Å²	90	116.5 Å²	116.5	63%	0.629	63%	0.633	S	S	*	*			trans	-90.2	4.5	176.2	57.6	0	0	0	0	113.8	E90 E96	E90-S94 WeakPolarHBondContact O-CB 3.29Å; E90-S94 PolarHBondContact O-N 2.95Å; E90-S94 PolarHBondContact O-OG 2.96Å; S94-E96 PolarHBondContact O-N 3.46Å
95	T	52.8	Low	60.3	Low	107 Å²	107	117.2 Å²	117.2	66%	0.656	65%	0.65	S	S	*	*	S	Bend	trans	-78	95	166.6	-26.9	0	0	0	0	108.9	S93	S93-T95 VanDerWaalsContact C-N 3.35Å
96	E	51.1	Low	58.4	Low	159 Å²	159	117.2 Å²	117.2	74%	0.743	67%	0.666	S	S	*	*			trans	20.9	141.6	155.2	-68.7	178.3	124.3	0	0	119.8	S94 V98	S94-E96 PolarHBondContact O-N 3.46Å; E96-V98 PolarHBondContact O-N 2.78Å
97	P	48.6	Very low	57	Low	121 Å²	121	116.3 Å²	116.3	79%	0.786	68%	0.681	S	S	*	*			trans	-54.9	120.8	161.2	26.9	-30	0	0	0	106.7
98	V	49.5	Very low	55	Low	120 Å²	120	122.1 Å²	122.1	73%	0.727	71%	0.706	S	S	*	*			trans	-38.6	118.9	169.9	177.3	0	0	0	0	107.1	E96 S100	E96-V98 PolarHBondContact O-N 2.78Å; V98-S100 VanDerWaalsContact C-N 3.3Å; V98-S100 PolarHBondContact O-N 3.41Å
99	P	42.9	Very low	53.2	Low	97 Å²	97	117.2 Å²	117.2	63%	0.63	71%	0.709	S	S	*	*			trans	-61.7	104.4	178.2	23.4	-29.3	0	0	0	105.3	S101	P99-S101 PolarHBondContact O-N 3.22Å
100	S	47.6	Very low	51.6	Low	128 Å²	128	122.3 Å²	122.3	90%	0.895	73%	0.728	S	S	*	*			trans	-77.1	54.5	169.4	15.6	0	0	0	0	107.3	V98	V98-S100 VanDerWaalsContact C-N 3.3Å; V98-S100 PolarHBondContact O-N 3.41Å
101	S	44.8	Very low	49.9	Very low	90 Å²	90	127 Å²	127	63%	0.629	74%	0.742	S	S	*	*			trans	-125.5	64.2	165.5	63.3	0	0	0	0	106.1	P99	P99-S101 PolarHBondContact O-N 3.22Å
102	L	49.6	Very low	48.2	Very low	161 Å²	161	125.5 Å²	125.5	84%	0.843	75%	0.746	S	S	*	*			trans	-55.6	130.1	150	-81.2	147.7	0	0	0	106.2	A104	L102-A104 PolarHBondContact O-N 3.45Å
103	P	44.7	Very low	46.9	Very low	110 Å²	110	126.2 Å²	126.2	71%	0.714	75%	0.75	S	S	*	*			trans	-62.1	115.6	-178.8	24.2	-31.2	0	0	0	108.6	S105	P103-S105 PolarHBondContact O-N 3.17Å
104	A	44.9	Very low	45.6	Very low	105 Å²	105	130.7 Å²	130.7	87%	0.868	76%	0.762	S	S	*	*			trans	-72.8	62	166.7	0	0	0	0	0	109.5	L102	L102-A104 PolarHBondContact O-N 3.45Å
105	S	42.6	Very low	44.6	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	77%	0.77	S	S	*	*			trans	-136.1	62.8	173	-79.1	0	0	0	0	108.9	P103	P103-S105 PolarHBondContact O-N 3.17Å
106	A	43.9	Very low	43.9	Very low	99 Å²	99	130.9 Å²	130.9	82%	0.818	77%	0.773	S	S	*	*			trans	-160.9	59.2	166.9	0	0	0	0	0	110.7
107	S	48	Very low	43.3	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	78%	0.779	S	S	*	*			trans	-158.6	53.7	166.7	53.8	0	0	0	0	113.3	G109	S107-G109 VanDerWaalsContact C-N 3.34Å; S107-G109 PolarHBondContact O-N 2.76Å
108	E	41.4	Very low	42.5	Very low	212 Å²	212	132.1 Å²	132.1	99%	0.991	78%	0.781	S	S	*	*			trans	-69.7	96.7	146.4	-83.4	-175.6	141.4	0	0	107.4
109	G	42.8	Very low	41.8	Very low	71 Å²	71	132.5 Å²	132.5	73%	0.732	79%	0.788	S	S	*	*			trans	-163	57.5	-168.8	0	0	0	0	0	113.5	S107	S107-G109 VanDerWaalsContact C-N 3.34Å; S107-G109 PolarHBondContact O-N 2.76Å
110	R	40.9	Very low	41.5	Very low	196 Å²	196	131.8 Å²	131.8	74%	0.74	79%	0.786	S	S	*	*			trans	-32.6	124.2	170.1	-173.6	173.2	173.9	153	-5.8	115.3
111	R	41.5	Very low	41.1	Very low	184 Å²	184	132.1 Å²	132.1	69%	0.694	78%	0.782	S	S	*	*			trans	81	121.5	135.4	-75.3	179.8	-157.9	-161.4	1.1	121.9
112	T	37.7	Very low	41.1	Very low	123 Å²	123	136.3 Å²	136.3	76%	0.755	79%	0.789	S	S	*	*			trans	93.6	140.8	136.2	-7.4	0	0	0	0	120.3
113	F	44.9	Very low	41.1	Very low	174 Å²	174	136.2 Å²	136.2	76%	0.763	79%	0.787	S	S	*	*			trans	97.5	94.5	154.1	-100.3	-91	0	0	0	119.5
114	Q	38.3	Very low	41	Very low	168 Å²	168	134.9 Å²	134.9	79%	0.785	78%	0.781	S	S	*	*			trans	23.4	108.7	130.8	-72.9	172.1	-17.3	0	0	117.6
115	S	37.2	Very low	41.1	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	77%	0.77	S	S	*	*			trans	-167.3	124.1	137.1	173.7	0	0	0	0	109.2
116	A	38.7	Very low	41.1	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	77%	0.769	S	S	*	*			trans	29.9	135.5	148.6	0	0	0	0	0	120.7
117	Q	39.3	Very low	41.2	Very low	187 Å²	187	135 Å²	135	87%	0.874	76%	0.763	S	S	*	*			trans	98.8	83.6	145.3	-141.5	152.9	22.9	0	0	116	C119	Q117-C119 PolarHBondContact O-N 2.91Å; Q117-C119 VanDerWaalsContact O-N 3.1Å
118	S	32.1	Very low	41.3	Very low	119 Å²	119	133.5 Å²	133.5	83%	0.832	75%	0.75	S	S	*	*			trans	-12.1	102	141	-170.1	0	0	0	0	113.8
119	C	34.2	Very low	41.5	Very low	129 Å²	129	130.6 Å²	130.6	87%	0.872	73%	0.73	S	S	*	*			trans	-143.3	104.4	141	-135.8	0	0	0	0	109.6	Q117	Q117-C119 PolarHBondContact O-N 2.91Å; Q117-C119 VanDerWaalsContact O-N 3.1Å
120	S	36.6	Very low	42	Very low	82 Å²	82	136 Å²	136	57%	0.573	73%	0.733	S	S	*	*			trans	-36.3	124.6	174.2	178.2	0	0	0	0	114.2	K122	S120-K122 PolarHBondContact O-N 3.25Å
121	V	38.3	Very low	42.6	Very low	135 Å²	135	130.5 Å²	130.5	82%	0.818	72%	0.722	S	S	*	*			trans	-50	99.3	150.5	178	0	0	0	0	108.3
122	K	45.1	Very low	43.2	Very low	177 Å²	177	125.7 Å²	125.7	77%	0.77	71%	0.709	S	S	*	*			trans	-120	72.4	160.6	-77	-169.4	-179	-174.1	0	109.2	S120 S124	S120-K122 PolarHBondContact O-N 3.25Å; K122-S124 VanDerWaalsContact C-N 3.26Å; K122-S124 PolarHBondContact O-N 2.94Å
123	I	50	Low	44.1	Very low	159 Å²	159	124.2 Å²	124.2	82%	0.815	70%	0.7	S	S	*	*			trans	-64.4	98.3	136.6	-89.7	166.1	0	0	0	105
124	S	42.9	Very low	45	Very low	83 Å²	83	117.8 Å²	117.8	58%	0.58	68%	0.682	S	S	*	*			trans	-175.2	97.3	164.2	-85.5	0	0	0	0	111.7	K122 C126	K122-S124 VanDerWaalsContact C-N 3.26Å; K122-S124 PolarHBondContact O-N 2.94Å; S124-C126 PolarHBondContact O-N 3.44Å
125	T	46.8	Very low	46.4	Very low	104 Å²	104	114.7 Å²	114.7	64%	0.638	67%	0.667	S	S	*	*	S	Bend		60.3	26.1	118.7	-30.7	0	0	0	0	119.3	W129	T125-W129 HydrophobicContact CG2-CZ2 3.8Å; T125-W129 PolarHBondContact O-NE1 2.73Å
126	C	42.7	Very low	48.1	Very low	114 Å²	114	114 Å²	114	77%	0.77	65%	0.654	S	S	*	*	S	Bend	trans	-138	11.1	-177.1	-159.2	0	0	0	0	117.6	S124	S124-C126 PolarHBondContact O-N 3.44Å
127	S	45.7	Very low	49.7	Very low	101 Å²	101	113.4 Å²	113.4	71%	0.706	65%	0.645	S	S	*	*	S	Bend	trans	-121.9	-6.6	170.6	50	0	0	0	0	114.1
128	T	50.6	Low	51.4	Low	85 Å²	85	107.3 Å²	107.3	52%	0.521	61%	0.614	S	S	.	*	S	Bend	trans	-84.7	-24.8	-178.8	-49.2	0	0	0	0	113.5	T131 L132	T128-T131 PolarHBondContact O-N 3.46Å; T128-L132 HydrophobicContact CG2-CD1 4.26Å; T128-L132 PolarHBondContact O-N 3.44Å
129	W	45.5	Very low	53.5	Low	151 Å²	151	105.1 Å²	105.1	57%	0.572	59%	0.592	S	S	*	*	H	α-helix	trans	-71.8	-33.9	-174.8	-52.7	113.3	0	0	0	113.6	T125 T131 L132 T133	T125-W129 HydrophobicContact CG2-CZ2 3.8Å; T125-W129 PolarHBondContact O-NE1 2.73Å; W129-T131 VanDerWaalsContact C-N 3.26Å; W129-T131 PolarHBondContact O-N 3.03Å; W129-L132 PolarHBondContact O-N 2.73Å; W129-T133 WeakPolarHBondContact O-CG2 3.49Å; W129-T133 PolarHBondContact O-N 3.29Å; W129-T133 PolarHBondContact O-OG1 2.86Å
130	K	52.1	Low	55.7	Low	184 Å²	184	108 Å²	108	80%	0.8	59%	0.585	S	S	*	*	H	α-helix	trans	-65.6	-29.3	178	-78.3	-172.4	171.3	-175.2	0	113.1	T133 G134	K130-T133 PolarHBondContact O-OG1 3.48Å; K130-G134 PolarHBondContact O-N 3.39Å
131	T	53.9	Low	57.8	Low	81 Å²	81	106.3 Å²	106.3	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-82.8	-26.5	179	-42.9	0	0	0	0	112.1	T128 W129 K135	T128-T131 PolarHBondContact O-N 3.46Å; W129-T131 VanDerWaalsContact C-N 3.26Å; W129-T131 PolarHBondContact O-N 3.03Å; T131-K135 WeakPolarHBondContact O-CD 3.45Å; T131-K135 VanDerWaalsContact O-CG 3.24Å; T131-K135 WeakPolarHBondContact O-CG 3.29Å
132	L	53.6	Low	59.7	Low	83 Å²	83	100.7 Å²	100.7	44%	0.435	54%	0.54	S	S	.	.	H	α-helix	trans	-75	-47	171.5	-104	88	0	0	0	111.4	T128 W129 G134 K135 D136	T128-L132 HydrophobicContact CG2-CD1 4.26Å; T128-L132 PolarHBondContact O-N 3.44Å; W129-L132 PolarHBondContact O-N 2.73Å; L132-G134 VanDerWaalsContact C-N 3.28Å; L132-G134 PolarHBondContact O-N 3.24Å; L132-K135 WeakPolarHBondContact O-CB 3.3Å; L132-K135 PolarHBondContact O-N 2.85Å; L132-D136 PolarHBondContact O-N 3Å; L132-D136 VanDerWaalsContact O-N 3.08Å
133	T	58.1	Low	61.4	Low	92 Å²	92	94.8 Å²	94.8	56%	0.564	52%	0.524	S	S	*	.	H	α-helix	trans	-60.8	-36	-177.1	53.4	0	0	0	0	113	W129 K130 S137	W129-T133 WeakPolarHBondContact O-CG2 3.49Å; W129-T133 PolarHBondContact O-N 3.29Å; W129-T133 PolarHBondContact O-OG1 2.86Å; K130-T133 PolarHBondContact O-OG1 3.48Å; T133-S137 PolarHBondContact O-N 3.11Å
134	G	63.6	Low	63	Low	38 Å²	38	92.9 Å²	92.9	39%	0.392	51%	0.512	S	S	.	.	H	α-helix	trans	-75.6	-24.8	176	0	0	0	0	0	114.3	K130 L132 S137 Y138	K130-G134 PolarHBondContact O-N 3.39Å; L132-G134 VanDerWaalsContact C-N 3.28Å; L132-G134 PolarHBondContact O-N 3.24Å; G134-S137 PolarHBondContact O-OG 3.13Å; G134-S137 VanDerWaalsContact O-OG 3.07Å; G134-Y138 WeakPolarHBondContact O-CB 3.48Å; G134-Y138 PolarHBondContact O-N 3.17Å
135	K	67.7	Low	64.8	Low	104 Å²	104	89.2 Å²	89.2	45%	0.452	49%	0.486	S	S	.	.	H	α-helix	trans	-73	-42.5	174.4	-78.1	171.6	-178.3	164.9	0	110.6	T131 L132 Y138 L139	T131-K135 WeakPolarHBondContact O-CD 3.45Å; T131-K135 VanDerWaalsContact O-CG 3.24Å; T131-K135 WeakPolarHBondContact O-CG 3.29Å; L132-K135 WeakPolarHBondContact O-CB 3.3Å; L132-K135 PolarHBondContact O-N 2.85Å; K135-Y138 PolarHBondContact O-N 3.37Å; K135-L139 WeakPolarHBondContact O-CB 3.3Å; K135-L139 VanDerWaalsContact O-CG 3.23Å; K135-L139 WeakPolarHBondContact O-CG 2.82Å; K135-L139 PolarHBondContact O-N 3.43Å
136	D	71.6	Confident	66.4	Low	99 Å²	99	85.5 Å²	85.5	53%	0.529	46%	0.462	S	S	.	.	H	α-helix	trans	-66.3	-40.4	-179.5	-65.5	-28.2	0	0	0	111.9	L132 L139 R140	L132-D136 PolarHBondContact O-N 3Å; L132-D136 VanDerWaalsContact O-N 3.08Å; D136-L139 PolarHBondContact O-N 3.2Å; D136-R140 WeakPolarHBondContact O-CB 3.32Å; D136-R140 PolarHBondContact O-N 3.3Å
137	S	73.8	Confident	68.5	Low	75 Å²	75	81.3 Å²	81.3	52%	0.524	44%	0.437	S	S	.	.	H	α-helix	trans	-63.3	-44.5	176	63.5	0	0	0	0	112.2	T133 G134 R140 A141	T133-S137 PolarHBondContact O-N 3.11Å; G134-S137 PolarHBondContact O-OG 3.13Å; G134-S137 VanDerWaalsContact O-OG 3.07Å; S137-R140 PolarHBondContact O-N 2.92Å; S137-A141 WeakPolarHBondContact O-CB 3.49Å; S137-A141 PolarHBondContact O-N 2.82Å
138	Y	74.1	Confident	70.4	Confident	59 Å²	59	80.2 Å²	80.2	23%	0.231	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-42.5	177.2	179.8	-84.6	0	0	0	112.2	R89 G134 K135 R140 R142	R89-Y138 VanDerWaalsContact CZ-CE1 3.47Å; R89-Y138 PolarHBondContact NH2-OH 2.98Å; G134-Y138 WeakPolarHBondContact O-CB 3.48Å; G134-Y138 PolarHBondContact O-N 3.17Å; K135-Y138 PolarHBondContact O-N 3.37Å; Y138-R140 VanDerWaalsContact C-N 3.32Å; Y138-R142 VanDerWaalsContact O-CB 3.27Å; Y138-R142 WeakPolarHBondContact O-CB 3.42Å; Y138-R142 PolarHBondContact O-N 2.81Å; Y138-R142 PolarHBondContact OH-NH1 3Å
139	L	76.2	Confident	72	Confident	72 Å²	72	76.2 Å²	76.2	38%	0.377	40%	0.399	S	S	.	.	H	α-helix	trans	-64.9	-38.6	178.2	-71.7	173.4	0	0	0	111.5	K135 D136 A143	K135-L139 WeakPolarHBondContact O-CB 3.3Å; K135-L139 VanDerWaalsContact O-CG 3.23Å; K135-L139 WeakPolarHBondContact O-CG 2.82Å; K135-L139 PolarHBondContact O-N 3.43Å; D136-L139 PolarHBondContact O-N 3.2Å; L139-A143 WeakPolarHBondContact O-CB 3.41Å; L139-A143 PolarHBondContact O-N 2.91Å
140	R	81.5	Confident	74	Confident	191 Å²	191	74 Å²	74	72%	0.721	40%	0.395	S	S	*	.	H	α-helix	trans	-66.1	-51.8	176.5	-171.4	-177.8	-176.8	93.8	2.4	112	D136 S137 Y138 R142 A143 E144	D136-R140 WeakPolarHBondContact O-CB 3.32Å; D136-R140 PolarHBondContact O-N 3.3Å; S137-R140 PolarHBondContact O-N 2.92Å; Y138-R140 VanDerWaalsContact C-N 3.32Å; R140-R142 PolarHBondContact O-N 3.4Å; R140-A143 PolarHBondContact O-N 2.88Å; R140-A143 VanDerWaalsContact O-N 3.1Å; R140-E144 PolarHBondContact O-N 2.87Å
141	A	79.6	Confident	75.7	Confident	46 Å²	46	68.7 Å²	68.7	38%	0.38	38%	0.378	S	S	.	.	H	α-helix	trans	-56	-39.8	177.7	0	0	0	0	0	111.3	S137 E144 T145	S137-A141 WeakPolarHBondContact O-CB 3.49Å; S137-A141 PolarHBondContact O-N 2.82Å; A141-E144 WeakPolarHBondContact O-CB 3.32Å; A141-E144 PolarHBondContact O-N 3.25Å; A141-T145 PolarHBondContact O-N 3.38Å; A141-T145 PolarHBondContact O-OG1 3.31Å
142	R	77.8	Confident	77.2	Confident	17 Å²	17	65.2 Å²	65.2	6%	0.064	36%	0.357	C	S	.	.	H	α-helix	trans	-69.5	-38.3	177.5	-168.7	178.5	-175.4	101.9	-9.8	113.7	M6 M82 Y138 R140 E144 M146	M6-R142 HydrophobicContact CE-CG 4.43Å; M82-R142 PolarHBondContact O-NH2 3.08Å; M82-R142 HydrophobicContact SD-CG 4.14Å; Y138-R142 VanDerWaalsContact O-CB 3.27Å; Y138-R142 WeakPolarHBondContact O-CB 3.42Å; Y138-R142 PolarHBondContact O-N 2.81Å; Y138-R142 PolarHBondContact OH-NH1 3Å; R140-R142 PolarHBondContact O-N 3.4Å; R142-E144 VanDerWaalsContact C-N 3.3Å; R142-M146 VanDerWaalsContact O-CG 3.25Å; R142-M146 WeakPolarHBondContact O-CG 3.25Å; R142-M146 PolarHBondContact O-N 3.35Å; R142-M146 VanDerWaalsContact O-N 3.11Å
143	A	81.5	Confident	78.8	Confident	53 Å²	53	62.7 Å²	62.7	44%	0.438	34%	0.343	S	S	.	.	H	α-helix	trans	-66	-36.4	174.7	0	0	0	0	0	111.3	L139 R140 M146 G147	L139-A143 WeakPolarHBondContact O-CB 3.41Å; L139-A143 PolarHBondContact O-N 2.91Å; R140-A143 PolarHBondContact O-N 2.88Å; R140-A143 VanDerWaalsContact O-N 3.1Å; A143-M146 WeakPolarHBondContact O-CB 3.47Å; A143-M146 PolarHBondContact O-N 2.62Å; A143-G147 PolarHBondContact O-N 3.01Å
144	E	84.1	Confident	80.3	Confident	119 Å²	119	63 Å²	63	56%	0.556	35%	0.345	S	S	*	.	H	α-helix	trans	-63.8	-50.4	173.5	-178.7	176.7	-179.8	0	0	111.9	R140 A141 R142 M146 G147 N148	R140-E144 PolarHBondContact O-N 2.87Å; A141-E144 WeakPolarHBondContact O-CB 3.32Å; A141-E144 PolarHBondContact O-N 3.25Å; R142-E144 VanDerWaalsContact C-N 3.3Å; E144-M146 PolarHBondContact O-N 3.11Å; E144-G147 PolarHBondContact O-N 2.96Å; E144-N148 VanDerWaalsContact O-CG 3.27Å; E144-N148 PolarHBondContact O-N 3.5Å; E144-N148 PolarHBondContact O-OD1 3.05Å
145	T	79.7	Confident	81.4	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.037	34%	0.34	C	S	.	.	H	α-helix	trans	-56	-40.4	175.1	-61	0	0	0	0	111.8	M6 D10 M82 A141 N148 I149	M6-T145 HydrophobicContact CE-CG2 3.73Å; M6-T145 WeakPolarHBondContact CE-OG1 3.36Å; D10-T145 WeakPolarHBondContact OD1-CG2 3.25Å; D10-T145 PolarHBondContact OD2-OG1 2.9Å; M82-T145 HydrophobicContact CE-CG2 4.05Å; A141-T145 PolarHBondContact O-N 3.38Å; A141-T145 PolarHBondContact O-OG1 3.31Å; T145-N148 PolarHBondContact O-N 2.93Å; T145-I149 HydrophobicContact CG2-CD1 3.87Å; T145-I149 HydrophobicContact CG2-CG1 4.44Å; T145-I149 VanDerWaalsContact O-CG1 3.24Å; T145-I149 WeakPolarHBondContact O-CG1 3.44Å; T145-I149 PolarHBondContact O-N 3.41Å
146	M	81.7	Confident	82.4	Confident	26 Å²	26	59.2 Å²	59.2	13%	0.128	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-46.4	175	-71.8	-71	-163.1	0	0	112.7	T79 M82 K83 R142 A143 E144 N148 I149 E150	T79-M146 HydrophobicContact CG2-SD 3.83Å; M82-M146 HydrophobicContact CB-CE 3.05Å; M82-M146 HydrophobicContact CB-SD 4.37Å; M82-M146 HydrophobicContact CE-CE 3.45Å; M82-M146 VanDerWaalsContact CE-CE 3.45Å; M82-M146 HydrophobicContact CE-CG 3.98Å; M82-M146 HydrophobicContact CE-SD 3.29Å; M82-M146 WeakPolarHBondContact CE-SD 3.29Å; M82-M146 HydrophobicContact CG-CE 4.03Å; M82-M146 HydrophobicContact SD-CE 3.85Å; M82-M146 HydrophobicContact SD-SD 4.39Å; K83-M146 HydrophobicContact CG-CE 4.37Å; R142-M146 VanDerWaalsContact O-CG 3.25Å; R142-M146 WeakPolarHBondContact O-CG 3.25Å; R142-M146 PolarHBondContact O-N 3.35Å; R142-M146 VanDerWaalsContact O-N 3.11Å; A143-M146 WeakPolarHBondContact O-CB 3.47Å; A143-M146 PolarHBondContact O-N 2.62Å; E144-M146 PolarHBondContact O-N 3.11Å; M146-N148 VanDerWaalsContact C-N 3.27Å; M146-N148 PolarHBondContact O-N 3.43Å; M146-I149 PolarHBondContact O-N 3.29Å; M146-E150 WeakPolarHBondContact O-CG 2.99Å; M146-E150 PolarHBondContact O-N 3.39Å
147	G	85.5	Confident	83.1	Confident	25 Å²	25	55.9 Å²	55.9	26%	0.258	31%	0.308	S	S	.	.	H	α-helix	trans	-61.6	-37.3	176.6	0	0	0	0	0	112.3	A143 E144 E150 T151	A143-G147 PolarHBondContact O-N 3.01Å; E144-G147 PolarHBondContact O-N 2.96Å; G147-E150 PolarHBondContact O-N 3.24Å; G147-T151 WeakPolarHBondContact O-CB 3.35Å; G147-T151 PolarHBondContact O-N 3.46Å; G147-T151 PolarHBondContact O-OG1 3.49Å
148	N	85.3	Confident	83.8	Confident	78 Å²	78	58.7 Å²	58.7	42%	0.417	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-42.1	175.6	-67	-13.4	0	0	0	111.6	E144 T145 M146 T152	E144-N148 VanDerWaalsContact O-CG 3.27Å; E144-N148 PolarHBondContact O-N 3.5Å; E144-N148 PolarHBondContact O-OD1 3.05Å; T145-N148 PolarHBondContact O-N 2.93Å; M146-N148 VanDerWaalsContact C-N 3.27Å; M146-N148 PolarHBondContact O-N 3.43Å; N148-T152 WeakPolarHBondContact O-CB 3.32Å; N148-T152 PolarHBondContact O-N 2.86Å; N148-T152 PolarHBondContact O-OG1 3.01Å
149	I	85.4	Confident	84.4	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-45.2	175.5	-67.2	166.7	0	0	0	110.8	L75 R78 T79 M82 T145 M146 T151 T152 I153	L75-I149 HydrophobicContact CB-CG2 3.83Å; L75-I149 HydrophobicContact CD1-CG2 4.42Å; L75-I149 HydrophobicContact CD2-CG1 4.23Å; L75-I149 HydrophobicContact CD2-CG2 4.12Å; L75-I149 HydrophobicContact CG-CG2 4.35Å; R78-I149 HydrophobicContact CG-CD1 4.17Å; T79-I149 WeakPolarHBondContact OG1-CG2 3.44Å; M82-I149 HydrophobicContact CE-CD1 3.56Å; T145-I149 HydrophobicContact CG2-CD1 3.87Å; T145-I149 HydrophobicContact CG2-CG1 4.44Å; T145-I149 VanDerWaalsContact O-CG1 3.24Å; T145-I149 WeakPolarHBondContact O-CG1 3.44Å; T145-I149 PolarHBondContact O-N 3.41Å; M146-I149 PolarHBondContact O-N 3.29Å; I149-T151 VanDerWaalsContact C-N 3.34Å; I149-T151 PolarHBondContact O-N 2.85Å; I149-T152 WeakPolarHBondContact O-CB 3.49Å; I149-T152 PolarHBondContact O-N 3.37Å; I149-T152 VanDerWaalsContact O-N 3.16Å; I149-I153 HydrophobicContact CG2-CD1 3.79Å; I149-I153 HydrophobicContact CG2-CG1 4.31Å; I149-I153 WeakPolarHBondContact O-CG1 3.39Å; I149-I153 PolarHBondContact O-N 3.49Å
150	E	86.5	Confident	84.8	Confident	105 Å²	105	55.7 Å²	55.7	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-44.2	177.6	-75.1	177.9	176	0	0	111.5	M146 G147 T152 I153 V154	M146-E150 WeakPolarHBondContact O-CG 2.99Å; M146-E150 PolarHBondContact O-N 3.39Å; G147-E150 PolarHBondContact O-N 3.24Å; E150-T152 VanDerWaalsContact C-N 3.33Å; E150-T152 PolarHBondContact O-N 3.46Å; E150-I153 PolarHBondContact O-N 2.91Å; E150-V154 WeakPolarHBondContact O-CG2 3.49Å; E150-V154 PolarHBondContact O-N 2.9Å
151	T	87.7	Confident	85	Confident	73 Å²	73	48.9 Å²	48.9	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-59.9	-44.7	174.4	-56.2	0	0	0	0	111.1	G147 I149 I153 V154 E155	G147-T151 WeakPolarHBondContact O-CB 3.35Å; G147-T151 PolarHBondContact O-N 3.46Å; G147-T151 PolarHBondContact O-OG1 3.49Å; I149-T151 VanDerWaalsContact C-N 3.34Å; I149-T151 PolarHBondContact O-N 2.85Å; T151-I153 PolarHBondContact O-N 2.65Å; T151-V154 PolarHBondContact O-N 3.09Å; T151-E155 WeakPolarHBondContact O-CG 3.28Å; T151-E155 PolarHBondContact O-N 2.89Å
152	T	86.7	Confident	85.3	Confident	8 Å²	8	49.3 Å²	49.3	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-40.3	178.4	-57.5	0	0	0	0	111.7	T13 K17 F71 L75 N148 I149 E150 E155 L156	T13-T152 HydrophobicContact CG2-CG2 4.31Å; K17-T152 HydrophobicContact CB-CG2 4.29Å; K17-T152 HydrophobicContact CD-CG2 4.16Å; K17-T152 HydrophobicContact CG-CG2 4.45Å; F71-T152 HydrophobicContact CE1-CG2 3.88Å; F71-T152 HydrophobicContact CZ-CG2 4.39Å; L75-T152 HydrophobicContact CD1-CG2 3.78Å; N148-T152 WeakPolarHBondContact O-CB 3.32Å; N148-T152 PolarHBondContact O-N 2.86Å; N148-T152 PolarHBondContact O-OG1 3.01Å; I149-T152 WeakPolarHBondContact O-CB 3.49Å; I149-T152 PolarHBondContact O-N 3.37Å; I149-T152 VanDerWaalsContact O-N 3.16Å; E150-T152 VanDerWaalsContact C-N 3.33Å; E150-T152 PolarHBondContact O-N 3.46Å; T152-E155 PolarHBondContact O-N 2.78Å; T152-L156 HydrophobicContact CG2-CD1 3.9Å; T152-L156 WeakPolarHBondContact O-CB 3.47Å; T152-L156 VanDerWaalsContact O-CD1 3.25Å; T152-L156 WeakPolarHBondContact O-CD1 3.29Å; T152-L156 PolarHBondContact O-N 2.92Å
153	I	86.9	Confident	85.5	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.149	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-41.8	175.6	-69.2	167.5	0	0	0	111	L75 E76 I149 E150 T151 L156 G157	L75-I153 HydrophobicContact CB-CD1 4.26Å; L75-I153 HydrophobicContact CB-CG1 4.24Å; L75-I153 HydrophobicContact CD1-CG1 4.23Å; E76-I153 HydrophobicContact CG-CD1 4.18Å; I149-I153 HydrophobicContact CG2-CD1 3.79Å; I149-I153 HydrophobicContact CG2-CG1 4.31Å; I149-I153 WeakPolarHBondContact O-CG1 3.39Å; I149-I153 PolarHBondContact O-N 3.49Å; E150-I153 PolarHBondContact O-N 2.91Å; T151-I153 PolarHBondContact O-N 2.65Å; I153-L156 PolarHBondContact O-N 3.2Å; I153-G157 PolarHBondContact O-N 2.93Å
154	V	89.8	Confident	85.5	Confident	98 Å²	98	48 Å²	48	59%	0.594	27%	0.272	S	S	*	.	H	α-helix	trans	-63.8	-44.2	178	171.4	0	0	0	0	111.3	E150 T151 G157 Q158	E150-V154 WeakPolarHBondContact O-CG2 3.49Å; E150-V154 PolarHBondContact O-N 2.9Å; T151-V154 PolarHBondContact O-N 3.09Å; V154-G157 WeakPolarHBondContact O-CA 3.3Å; V154-G157 PolarHBondContact O-N 3.28Å; V154-G157 VanDerWaalsContact O-N 3.11Å; V154-Q158 PolarHBondContact O-N 3.06Å
155	E	86.7	Confident	85.4	Confident	62 Å²	62	49 Å²	49	29%	0.29	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-42.4	175.4	-70.2	171.5	174.4	0	0	112.2	K17 T151 T152 G157 Q158 I159	K17-E155 WeakPolarHBondContact CD-OE2 3.5Å; K17-E155 WeakPolarHBondContact CE-OE2 3.3Å; K17-E155 IonicContact NZ-OE1 2.87Å; K17-E155 PolarHBondContact NZ-OE1 3.41Å; K17-E155 IonicContact NZ-OE2 2.62Å; K17-E155 PolarHBondContact NZ-OE2 3Å; T151-E155 WeakPolarHBondContact O-CG 3.28Å; T151-E155 PolarHBondContact O-N 2.89Å; T152-E155 PolarHBondContact O-N 2.78Å; E155-G157 PolarHBondContact O-N 2.92Å; E155-Q158 WeakPolarHBondContact O-CB 3.18Å; E155-Q158 PolarHBondContact O-N 2.9Å; E155-I159 PolarHBondContact O-N 2.98Å; E155-I159 VanDerWaalsContact O-N 3.17Å
156	L	87.5	Confident	85.1	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-57.2	-37.5	170.8	-102	78.3	0	0	0	111.3	S68 F71 R72 T152 I153 Q158 I159 F160	S68-L156 VanDerWaalsContact O-CD2 3.29Å; S68-L156 WeakPolarHBondContact O-CD2 3.47Å; F71-L156 HydrophobicContact CD1-CD1 4.02Å; F71-L156 HydrophobicContact CD1-CD2 3.7Å; F71-L156 HydrophobicContact CD1-CG 4.49Å; F71-L156 HydrophobicContact CE1-CD1 4.06Å; F71-L156 HydrophobicContact CE1-CD2 4.5Å; R72-L156 HydrophobicContact CB-CD2 4.05Å; T152-L156 HydrophobicContact CG2-CD1 3.9Å; T152-L156 WeakPolarHBondContact O-CB 3.47Å; T152-L156 VanDerWaalsContact O-CD1 3.25Å; T152-L156 WeakPolarHBondContact O-CD1 3.29Å; T152-L156 PolarHBondContact O-N 2.92Å; I153-L156 PolarHBondContact O-N 3.2Å; L156-Q158 VanDerWaalsContact C-N 3.28Å; L156-Q158 PolarHBondContact O-N 3.37Å; L156-I159 WeakPolarHBondContact O-CB 3.43Å; L156-I159 PolarHBondContact O-N 3.16Å; L156-I159 VanDerWaalsContact O-N 3.13Å; L156-F160 HydrophobicContact CB-CE2 4.31Å; L156-F160 WeakPolarHBondContact O-CD2 3.41Å; L156-F160 PolarHBondContact O-N 2.96Å
157	G	88.2	Confident	84.6	Confident	29 Å²	29	51.6 Å²	51.6	30%	0.299	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-40	171.8	0	0	0	0	0	113.3	I153 V154 E155 F160 A161	I153-G157 PolarHBondContact O-N 2.93Å; V154-G157 WeakPolarHBondContact O-CA 3.3Å; V154-G157 PolarHBondContact O-N 3.28Å; V154-G157 VanDerWaalsContact O-N 3.11Å; E155-G157 PolarHBondContact O-N 2.92Å; G157-F160 PolarHBondContact O-N 3.35Å; G157-A161 PolarHBondContact O-N 3.45Å
158	Q	88	Confident	83.9	Confident	133 Å²	133	58 Å²	58	62%	0.621	31%	0.311	S	S	*	.	H	α-helix	trans	-67.8	-39.2	175.8	-60.5	178.3	-22.3	0	0	111.7	V154 E155 L156 A161 Q162	V154-Q158 PolarHBondContact O-N 3.06Å; E155-Q158 WeakPolarHBondContact O-CB 3.18Å; E155-Q158 PolarHBondContact O-N 2.9Å; L156-Q158 VanDerWaalsContact C-N 3.28Å; L156-Q158 PolarHBondContact O-N 3.37Å; Q158-A161 PolarHBondContact O-N 2.81Å; Q158-Q162 PolarHBondContact O-N 3.46Å
159	I	85.6	Confident	83	Confident	18 Å²	18	61 Å²	61	9%	0.092	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-43.2	175.6	-59.4	178.4	0	0	0	110.1	I20 N24 E155 L156 A161 Q162 L163	I20-I159 HydrophobicContact CG2-CD1 3.66Å; N24-I159 HydrophobicContact CB-CG2 4.24Å; E155-I159 PolarHBondContact O-N 2.98Å; E155-I159 VanDerWaalsContact O-N 3.17Å; L156-I159 WeakPolarHBondContact O-CB 3.43Å; L156-I159 PolarHBondContact O-N 3.16Å; L156-I159 VanDerWaalsContact O-N 3.13Å; I159-A161 VanDerWaalsContact C-N 3.34Å; I159-A161 PolarHBondContact O-N 2.77Å; I159-Q162 PolarHBondContact O-N 3.44Å; I159-L163 HydrophobicContact CG2-CD1 3.8Å; I159-L163 HydrophobicContact CG2-CG 4.21Å; I159-L163 WeakPolarHBondContact O-CB 3.43Å; I159-L163 WeakPolarHBondContact O-CG 3.23Å; I159-L163 PolarHBondContact O-N 3.44Å
160	F	84.9	Confident	81.8	Confident	51 Å²	51	61.8 Å²	61.8	22%	0.224	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-40.5	173.3	-70.8	-52.9	0	0	0	112.7	S68 L156 G157 Q162 L163 G164	S68-F160 VanDerWaalsContact C-CZ 3.46Å; S68-F160 WeakPolarHBondContact OG-CE1 3.44Å; S68-F160 WeakPolarHBondContact OG-CZ 3.47Å; L156-F160 HydrophobicContact CB-CE2 4.31Å; L156-F160 WeakPolarHBondContact O-CD2 3.41Å; L156-F160 PolarHBondContact O-N 2.96Å; G157-F160 PolarHBondContact O-N 3.35Å; F160-Q162 VanDerWaalsContact C-N 3.3Å; F160-Q162 PolarHBondContact O-N 2.94Å; F160-L163 PolarHBondContact O-N 2.84Å; F160-G164 WeakPolarHBondContact O-CA 3.39Å; F160-G164 PolarHBondContact O-N 3.45Å
161	A	86.9	Confident	80.5	Confident	47 Å²	47	59.5 Å²	59.5	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-39.6	176.3	0	0	0	0	0	111.3	G157 Q158 I159 R165	G157-A161 PolarHBondContact O-N 3.45Å; Q158-A161 PolarHBondContact O-N 2.81Å; I159-A161 VanDerWaalsContact C-N 3.34Å; I159-A161 PolarHBondContact O-N 2.77Å; A161-R165 WeakPolarHBondContact O-CG 3.47Å; A161-R165 PolarHBondContact O-N 2.94Å; A161-R165 PolarHBondContact O-NH1 2.94Å
162	Q	84.6	Confident	78.9	Confident	56 Å²	56	63.2 Å²	63.2	26%	0.262	34%	0.343	S	S	.	.	H	α-helix	trans	-67	-49.1	174.6	-178.3	178.5	-16.3	0	0	111.7	N24 Q158 I159 F160 G164 R165 M166	N24-Q162 PolarHBondContact ND2-OE1 3.27Å; N24-Q162 PolarHBondContact OD1-NE2 2.94Å; Q158-Q162 PolarHBondContact O-N 3.46Å; I159-Q162 PolarHBondContact O-N 3.44Å; F160-Q162 VanDerWaalsContact C-N 3.3Å; F160-Q162 PolarHBondContact O-N 2.94Å; Q162-G164 VanDerWaalsContact C-N 3.32Å; Q162-G164 PolarHBondContact O-N 3.44Å; Q162-R165 PolarHBondContact O-N 2.87Å; Q162-M166 HydrophobicContact CG-CE 4.04Å; Q162-M166 WeakPolarHBondContact O-CB 3.38Å; Q162-M166 PolarHBondContact O-N 2.92Å
163	L	82.3	Confident	77.2	Confident	4 Å²	4	65 Å²	65	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-60.7	-40.7	177.1	-74.7	171.2	0	0	0	111.5	Q61 L64 A65 I159 F160 M166 V167	Q61-L163 HydrophobicContact CB-CD2 4.05Å; Q61-L163 HydrophobicContact CG-CD2 3.99Å; L64-L163 HydrophobicContact CB-CD1 4.49Å; L64-L163 HydrophobicContact CD2-CD1 4.28Å; L64-L163 HydrophobicContact CD2-CD2 4.28Å; L64-L163 HydrophobicContact CG-CD1 4.17Å; A65-L163 HydrophobicContact CB-CD1 4.15Å; I159-L163 HydrophobicContact CG2-CD1 3.8Å; I159-L163 HydrophobicContact CG2-CG 4.21Å; I159-L163 WeakPolarHBondContact O-CB 3.43Å; I159-L163 WeakPolarHBondContact O-CG 3.23Å; I159-L163 PolarHBondContact O-N 3.44Å; F160-L163 PolarHBondContact O-N 2.84Å; L163-M166 CarbonylContact O-C 3.58Å; L163-M166 WeakPolarHBondContact O-CB 3.45Å; L163-M166 PolarHBondContact O-N 3.35Å; L163-M166 VanDerWaalsContact O-N 3.16Å; L163-V167 WeakPolarHBondContact O-CB 3.32Å; L163-V167 VanDerWaalsContact O-CG2 3.24Å; L163-V167 WeakPolarHBondContact O-CG2 3.33Å; L163-V167 PolarHBondContact O-N 3.22Å
164	G	80.7	Confident	75.4	Confident	37 Å²	37	70.7 Å²	70.7	38%	0.381	39%	0.388	S	S	.	.	H	α-helix	trans	-59.9	-48.2	177.1	0	0	0	0	0	111.7	F160 Q162 M166 V167 Q168	F160-G164 WeakPolarHBondContact O-CA 3.39Å; F160-G164 PolarHBondContact O-N 3.45Å; Q162-G164 VanDerWaalsContact C-N 3.32Å; Q162-G164 PolarHBondContact O-N 3.44Å; G164-M166 VanDerWaalsContact C-N 3.31Å; G164-M166 PolarHBondContact O-N 3.48Å; G164-V167 PolarHBondContact O-N 3.1Å; G164-Q168 WeakPolarHBondContact O-CB 3.42Å; G164-Q168 PolarHBondContact O-N 2.99Å
165	R	81.9	Confident	73.6	Confident	141 Å²	141	72.4 Å²	72.4	53%	0.532	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-44.2	172.6	-71.1	-170.8	-59.5	-87.4	3.4	111.5	A161 Q162 V167 Q168 E169	A161-R165 WeakPolarHBondContact O-CG 3.47Å; A161-R165 PolarHBondContact O-N 2.94Å; A161-R165 PolarHBondContact O-NH1 2.94Å; Q162-R165 PolarHBondContact O-N 2.87Å; R165-V167 VanDerWaalsContact C-N 3.32Å; R165-V167 PolarHBondContact O-N 3.39Å; R165-Q168 PolarHBondContact O-N 3.5Å; R165-E169 WeakPolarHBondContact O-CB 3.38Å; R165-E169 WeakPolarHBondContact O-CG 3.24Å; R165-E169 PolarHBondContact O-N 3.32Å
166	M	74.8	Confident	72.1	Confident	12 Å²	12	72 Å²	72	6%	0.059	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-33.3	-176.6	-161.3	179.1	-75.5	0	0	113	I27 Q31 Q61 Q162 L163 G164 Q170	I27-M166 HydrophobicContact CG2-SD 3.74Å; Q31-M166 PolarHBondContact NE2-SD 3.07Å; Q31-M166 PolarHBondContact OE1-SD 3.5Å; Q61-M166 VanDerWaalsContact CD-SD 3.57Å; Q61-M166 HydrophobicContact CG-SD 3.88Å; Q61-M166 PolarHBondContact NE2-SD 2.89Å; Q162-M166 HydrophobicContact CG-CE 4.04Å; Q162-M166 WeakPolarHBondContact O-CB 3.38Å; Q162-M166 PolarHBondContact O-N 2.92Å; L163-M166 CarbonylContact O-C 3.58Å; L163-M166 WeakPolarHBondContact O-CB 3.45Å; L163-M166 PolarHBondContact O-N 3.35Å; L163-M166 VanDerWaalsContact O-N 3.16Å; G164-M166 VanDerWaalsContact C-N 3.31Å; G164-M166 PolarHBondContact O-N 3.48Å; M166-Q170 VanDerWaalsContact O-CG 3.3Å; M166-Q170 WeakPolarHBondContact O-CG 3.43Å; M166-Q170 PolarHBondContact O-NE2 2.99Å
167	V	70.3	Confident	70.6	Confident	75 Å²	75	78.6 Å²	78.6	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-81.6	-38.7	175.4	171.8	0	0	0	0	110.6	Q61 L163 G164 R165 Q170 G171	Q61-V167 HydrophobicContact CB-CG2 4.38Å; L163-V167 WeakPolarHBondContact O-CB 3.32Å; L163-V167 VanDerWaalsContact O-CG2 3.24Å; L163-V167 WeakPolarHBondContact O-CG2 3.33Å; L163-V167 PolarHBondContact O-N 3.22Å; G164-V167 PolarHBondContact O-N 3.1Å; R165-V167 VanDerWaalsContact C-N 3.32Å; R165-V167 PolarHBondContact O-N 3.39Å; V167-Q170 CarbonylContact O-C 3.58Å; V167-Q170 WeakPolarHBondContact O-CA 3.2Å; V167-Q170 WeakPolarHBondContact O-CB 3.49Å; V167-Q170 PolarHBondContact O-N 3.07Å; V167-G171 PolarHBondContact O-N 3.5Å
168	Q	71.8	Confident	69.3	Low	158 Å²	158	82.9 Å²	82.9	74%	0.738	44%	0.435	S	S	*	.	H	α-helix	trans	-64.8	-40.1	177.1	-173.7	177.5	0.7	0	0	111.9	G164 R165 Q170 G171	G164-Q168 WeakPolarHBondContact O-CB 3.42Å; G164-Q168 PolarHBondContact O-N 2.99Å; R165-Q168 PolarHBondContact O-N 3.5Å; Q168-Q170 PolarHBondContact O-N 3.25Å; Q168-Q170 VanDerWaalsContact O-N 3.16Å; Q168-G171 PolarHBondContact O-N 3.46Å; Q168-G171 VanDerWaalsContact O-N 3.07Å
169	E	66.9	Low	68.1	Low	142 Å²	142	79 Å²	79	66%	0.664	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.9	170.7	-77.5	179.4	-173.5	0	0	113	R165	R165-E169 WeakPolarHBondContact O-CB 3.38Å; R165-E169 WeakPolarHBondContact O-CG 3.24Å; R165-E169 PolarHBondContact O-N 3.32Å
170	Q	58.4	Low	67.1	Low	18 Å²	18	81.5 Å²	81.5	8%	0.084	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	16.3	176.9	-67	-177.7	84	0	0	113.1	Q61 M166 V167 Q168	Q61-Q170 VanDerWaalsContact NE2-NE2 3.17Å; M166-Q170 VanDerWaalsContact O-CG 3.3Å; M166-Q170 WeakPolarHBondContact O-CG 3.43Å; M166-Q170 PolarHBondContact O-NE2 2.99Å; V167-Q170 CarbonylContact O-C 3.58Å; V167-Q170 WeakPolarHBondContact O-CA 3.2Å; V167-Q170 WeakPolarHBondContact O-CB 3.49Å; V167-Q170 PolarHBondContact O-N 3.07Å; Q168-Q170 PolarHBondContact O-N 3.25Å; Q168-Q170 VanDerWaalsContact O-N 3.16Å
171	G	60	Low	66.4	Low	57 Å²	57	83.8 Å²	83.8	59%	0.588	45%	0.454	S	S	*	.			trans	-46.9	137	171.4	0	0	0	0	0	112.9	V167 Q168	V167-G171 PolarHBondContact O-N 3.5Å; Q168-G171 PolarHBondContact O-N 3.46Å; Q168-G171 VanDerWaalsContact O-N 3.07Å
172	E	54.7	Low	65.8	Low	150 Å²	150	87.6 Å²	87.6	70%	0.701	46%	0.464	S	S	*	.			trans	65.3	70.8	-176.5	-155.8	175.2	-160.4	0	0	115.4	Q175	E172-Q175 PolarHBondContact OE1-OE1 2.89Å
173	L	50.7	Low	65.1	Low	47 Å²	47	86 Å²	86	25%	0.246	46%	0.456	C	S	.	.			trans	-115.5	18.6	164.4	-145.1	109	0	0	0	113.9	K54 Q175 R176	K54-L173 HydrophobicContact CD-CD1 3.87Å; K54-L173 HydrophobicContact CG-CD1 4.45Å; K54-L173 VanDerWaalsContact NZ-CD1 3.27Å; L173-Q175 VanDerWaalsContact C-N 3.32Å; L173-R176 VanDerWaalsContact CD1-CD 3.43Å; L173-R176 HydrophobicContact CG-CG 4.2Å
174	V	48.6	Very low	64.7	Low	147 Å²	147	89.4 Å²	89.4	89%	0.891	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.3	178	177.1	0	0	0	0	112.2
175	Q	53	Low	64.8	Low	134 Å²	134	90.3 Å²	90.3	63%	0.626	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	0.7	179.6	-89.3	-178.5	-22.1	0	0	116.1	E172 L173 I177	E172-Q175 PolarHBondContact OE1-OE1 2.89Å; L173-Q175 VanDerWaalsContact C-N 3.32Å; Q175-I177 PolarHBondContact O-N 3.34Å
176	R	54.4	Low	64.8	Low	53 Å²	53	87.9 Å²	87.9	20%	0.2	48%	0.478	C	S	.	.	H	α-helix	trans	-90.2	12.8	-163.7	-73.2	178.7	89.8	-156.2	20.5	117.3	Q51 L173	Q51-R176 VanDerWaalsContact CA-NH2 3.25Å; L173-R176 VanDerWaalsContact CD1-CD 3.43Å; L173-R176 HydrophobicContact CG-CG 4.2Å
177	I	56.4	Low	65.1	Low	142 Å²	142	91 Å²	91	73%	0.728	49%	0.493	S	S	*	.	H	α-helix	trans	-69.9	-44.3	163.2	-59.4	178	0	0	0	108.7	Q175 V181	Q175-I177 PolarHBondContact O-N 3.34Å; I177-V181 WeakPolarHBondContact O-CG2 3.49Å; I177-V181 PolarHBondContact O-N 2.66Å
178	D	59.3	Low	65.8	Low	119 Å²	119	92 Å²	92	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-72	-39.2	-175.5	-62.3	-18.4	0	0	0	112.2	N180 V181 E182	D178-N180 PolarHBondContact O-N 3.41Å; D178-V181 PolarHBondContact O-N 2.95Å; D178-E182 WeakPolarHBondContact O-CB 3.49Å; D178-E182 PolarHBondContact O-N 2.81Å
179	S	63.5	Low	66.5	Low	51 Å²	51	90 Å²	90	36%	0.357	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-36.4	-177.8	177.2	0	0	0	0	113.5	E183	S179-E183 WeakPolarHBondContact O-CB 3.29Å; S179-E183 PolarHBondContact O-N 3.03Å
180	N	65.2	Low	67.2	Low	71 Å²	71	86.4 Å²	86.4	38%	0.38	48%	0.479	S	S	.	.	H	α-helix	trans	-72.8	-35.1	177.9	-71.6	20.6	0	0	0	111.3	Q51 D178 T184	Q51-N180 PolarHBondContact OE1-OD1 3.49Å; D178-N180 PolarHBondContact O-N 3.41Å; N180-T184 WeakPolarHBondContact O-CB 3.25Å; N180-T184 PolarHBondContact O-N 3.36Å; N180-T184 PolarHBondContact O-OG1 2.89Å
181	V	69.5	Low	68.5	Low	99 Å²	99	88.5 Å²	88.5	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-67.3	-43.7	174.8	175.3	0	0	0	0	110.1	I177 D178 T184 A185	I177-V181 WeakPolarHBondContact O-CG2 3.49Å; I177-V181 PolarHBondContact O-N 2.66Å; D178-V181 PolarHBondContact O-N 2.95Å; V181-T184 PolarHBondContact O-N 2.8Å; V181-A185 WeakPolarHBondContact O-CB 3.35Å; V181-A185 PolarHBondContact O-N 3.45Å
182	E	74.6	Confident	69.9	Low	127 Å²	127	91.7 Å²	91.7	59%	0.593	50%	0.499	S	S	*	.	H	α-helix	trans	-67.7	-41.8	178.5	-174.1	149.1	-156.8	0	0	112.5	D178 T184 A185 L186	D178-E182 WeakPolarHBondContact O-CB 3.49Å; D178-E182 PolarHBondContact O-N 2.81Å; E182-T184 VanDerWaalsContact C-N 3.32Å; E182-T184 PolarHBondContact O-N 2.77Å; E182-A185 WeakPolarHBondContact O-CB 3.39Å; E182-A185 PolarHBondContact O-N 3.43Å; E182-L186 HydrophobicContact CG-CD1 4.33Å; E182-L186 WeakPolarHBondContact O-CB 3.36Å; E182-L186 VanDerWaalsContact O-CG 3.3Å; E182-L186 WeakPolarHBondContact O-CG 3.48Å; E182-L186 PolarHBondContact O-N 3.37Å
183	E	69.8	Low	71.4	Confident	21 Å²	21	90 Å²	90	10%	0.098	49%	0.493	C	S	.	.	H	α-helix	trans	-61.5	-41.9	173.1	-176	174.8	168.3	0	0	111.4	T47 N48 Q51 S179 A185 L186 H187	T47-E183 WeakPolarHBondContact CB-OE1 3.33Å; T47-E183 PolarHBondContact OG1-OE1 3.43Å; N48-E183 PolarHBondContact N-OE1 2.86Å; N48-E183 PolarHBondContact ND2-OE1 3.23Å; N48-E183 VanDerWaalsContact ND2-OE1 3.16Å; N48-E183 PolarHBondContact OD1-OE1 3.11Å; N48-E183 VanDerWaalsContact OD1-OE1 3.05Å; N48-E183 PolarHBondContact OD1-OE2 3.49Å; Q51-E183 PolarHBondContact NE2-OE2 2.97Å; S179-E183 WeakPolarHBondContact O-CB 3.29Å; S179-E183 PolarHBondContact O-N 3.03Å; E183-A185 VanDerWaalsContact C-N 3.35Å; E183-A185 PolarHBondContact O-N 2.87Å; E183-L186 PolarHBondContact O-N 2.84Å; E183-H187 PolarHBondContact O-N 3.37Å; E183-H187 IonicContact OE1-CE1 3.51Å
184	T	74.6	Confident	73.1	Confident	77 Å²	77	93.1 Å²	93.1	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-42.8	175.3	-56.9	0	0	0	0	110.9	N180 V181 E182 H187 V188	N180-T184 WeakPolarHBondContact O-CB 3.25Å; N180-T184 PolarHBondContact O-N 3.36Å; N180-T184 PolarHBondContact O-OG1 2.89Å; V181-T184 PolarHBondContact O-N 2.8Å; E182-T184 VanDerWaalsContact C-N 3.32Å; E182-T184 PolarHBondContact O-N 2.77Å; T184-H187 PolarHBondContact O-N 2.95Å; T184-V188 HydrophobicContact CG2-CG2 4.43Å; T184-V188 WeakPolarHBondContact O-CB 3.36Å; T184-V188 VanDerWaalsContact O-CG2 3.22Å; T184-V188 WeakPolarHBondContact O-CG2 3.39Å; T184-V188 PolarHBondContact O-N 3.21Å
185	A	83.3	Confident	74.8	Confident	55 Å²	55	91.8 Å²	91.8	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-43.4	176.3	0	0	0	0	0	112	V181 E182 E183 V188 Q189	V181-A185 WeakPolarHBondContact O-CB 3.35Å; V181-A185 PolarHBondContact O-N 3.45Å; E182-A185 WeakPolarHBondContact O-CB 3.39Å; E182-A185 PolarHBondContact O-N 3.43Å; E183-A185 VanDerWaalsContact C-N 3.35Å; E183-A185 PolarHBondContact O-N 2.87Å; A185-V188 PolarHBondContact O-N 3.42Å; A185-Q189 WeakPolarHBondContact O-CB 3.42Å; A185-Q189 PolarHBondContact O-N 2.85Å
186	L	80.8	Confident	76.5	Confident	91 Å²	91	87.4 Å²	87.4	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-64.4	-40.7	176.9	-71.9	172.2	0	0	0	112.5	E182 E183 Q189 S190	E182-L186 HydrophobicContact CG-CD1 4.33Å; E182-L186 WeakPolarHBondContact O-CB 3.36Å; E182-L186 VanDerWaalsContact O-CG 3.3Å; E182-L186 WeakPolarHBondContact O-CG 3.48Å; E182-L186 PolarHBondContact O-N 3.37Å; E183-L186 PolarHBondContact O-N 2.84Å; L186-Q189 PolarHBondContact O-N 3.24Å; L186-S190 WeakPolarHBondContact O-CB 3.39Å; L186-S190 PolarHBondContact O-N 3.44Å; L186-S190 PolarHBondContact O-OG 2.97Å
187	H	81.4	Confident	77.8	Confident	78 Å²	78	90.9 Å²	90.9	36%	0.361	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-43.1	174.7	-76.5	176.2	0	0	0	112.1	N48 E183 T184 Q189 S190 A191	N48-H187 PolarHBondContact ND2-CE1 3.2Å; N48-H187 VanDerWaalsContact ND2-CE1 3.29Å; N48-H187 PolarHBondContact ND2-ND1 3.37Å; E183-H187 PolarHBondContact O-N 3.37Å; E183-H187 IonicContact OE1-CE1 3.51Å; T184-H187 PolarHBondContact O-N 2.95Å; H187-Q189 VanDerWaalsContact C-N 3.33Å; H187-Q189 PolarHBondContact O-N 3.25Å; H187-S190 PolarHBondContact O-N 3.06Å; H187-A191 VanDerWaalsContact O-CB 3.32Å; H187-A191 WeakPolarHBondContact O-CB 3.44Å; H187-A191 PolarHBondContact O-N 3.1Å
188	V	84.9	Confident	79	Confident	94 Å²	94	92.2 Å²	92.2	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-62.3	-41.7	175.3	170.6	0	0	0	0	110.7	T184 A185 A191 H192	T184-V188 HydrophobicContact CG2-CG2 4.43Å; T184-V188 WeakPolarHBondContact O-CB 3.36Å; T184-V188 VanDerWaalsContact O-CG2 3.22Å; T184-V188 WeakPolarHBondContact O-CG2 3.39Å; T184-V188 PolarHBondContact O-N 3.21Å; A185-V188 PolarHBondContact O-N 3.42Å; V188-A191 PolarHBondContact O-N 2.82Å; V188-H192 VanDerWaalsContact O-CB 3.29Å; V188-H192 WeakPolarHBondContact O-CB 3.3Å; V188-H192 PolarHBondContact O-N 2.82Å
189	Q	86.3	Confident	80.2	Confident	118 Å²	118	93 Å²	93	55%	0.551	49%	0.488	S	S	*	.	H	α-helix	trans	-65.7	-40.6	177	-174.5	176.5	-10.2	0	0	112.3	A185 L186 H187 H192 M193	A185-Q189 WeakPolarHBondContact O-CB 3.42Å; A185-Q189 PolarHBondContact O-N 2.85Å; L186-Q189 PolarHBondContact O-N 3.24Å; H187-Q189 VanDerWaalsContact C-N 3.33Å; H187-Q189 PolarHBondContact O-N 3.25Å; Q189-H192 PolarHBondContact O-N 2.97Å; Q189-M193 WeakPolarHBondContact O-CB 3.47Å; Q189-M193 PolarHBondContact O-N 3.45Å
190	S	82.9	Confident	81	Confident	65 Å²	65	99.2 Å²	99.2	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-44	176.4	-59	0	0	0	0	111.6	L186 H187 H192 M193 E194	L186-S190 WeakPolarHBondContact O-CB 3.39Å; L186-S190 PolarHBondContact O-N 3.44Å; L186-S190 PolarHBondContact O-OG 2.97Å; H187-S190 PolarHBondContact O-N 3.06Å; S190-H192 VanDerWaalsContact C-N 3.32Å; S190-H192 PolarHBondContact O-N 2.95Å; S190-M193 WeakPolarHBondContact O-CB 3.16Å; S190-M193 PolarHBondContact O-N 3.18Å; S190-E194 PolarHBondContact O-N 3Å; S190-E194 VanDerWaalsContact O-N 3.12Å
191	A	85	Confident	81.6	Confident	63 Å²	63	98.4 Å²	98.4	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-61.5	-41.6	174.2	0	0	0	0	0	111.4	H187 V188 E194 L195	H187-A191 VanDerWaalsContact O-CB 3.32Å; H187-A191 WeakPolarHBondContact O-CB 3.44Å; H187-A191 PolarHBondContact O-N 3.1Å; V188-A191 PolarHBondContact O-N 2.82Å; A191-E194 PolarHBondContact O-N 2.89Å; A191-L195 WeakPolarHBondContact O-CB 3.39Å; A191-L195 PolarHBondContact O-N 2.85Å
192	H	89.3	Confident	81.8	Confident	123 Å²	123	98.4 Å²	98.4	57%	0.569	50%	0.499	S	S	*	.	H	α-helix	trans	-62.6	-43	175.4	-174.1	69.6	0	0	0	112	V188 Q189 S190 E194 L195 V196	V188-H192 VanDerWaalsContact O-CB 3.29Å; V188-H192 WeakPolarHBondContact O-CB 3.3Å; V188-H192 PolarHBondContact O-N 2.82Å; Q189-H192 PolarHBondContact O-N 2.97Å; S190-H192 VanDerWaalsContact C-N 3.32Å; S190-H192 PolarHBondContact O-N 2.95Å; H192-E194 PolarHBondContact O-N 2.89Å; H192-L195 PolarHBondContact O-N 3.07Å; H192-V196 WeakPolarHBondContact O-CB 3.39Å; H192-V196 VanDerWaalsContact O-CG2 3.28Å; H192-V196 WeakPolarHBondContact O-CG2 3.46Å; H192-V196 PolarHBondContact O-N 3.38Å
193	M	86.6	Confident	81.8	Confident	116 Å²	116	95 Å²	95	57%	0.571	49%	0.489	S	S	*	.	H	α-helix	trans	-59.9	-45.2	178.1	-167.8	76.8	72.5	0	0	112.1	Q189 S190 V196 K197	Q189-M193 WeakPolarHBondContact O-CB 3.47Å; Q189-M193 PolarHBondContact O-N 3.45Å; S190-M193 WeakPolarHBondContact O-CB 3.16Å; S190-M193 PolarHBondContact O-N 3.18Å; M193-V196 PolarHBondContact O-N 3.25Å; M193-K197 VanDerWaalsContact O-CB 3.31Å; M193-K197 WeakPolarHBondContact O-CB 3.29Å; M193-K197 PolarHBondContact O-N 2.87Å
194	E	85.3	Confident	81.7	Confident	111 Å²	111	103.2 Å²	103.2	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-38.4	177.1	-75.9	-63.1	153.9	0	0	112	S190 A191 H192 K197 Y198	S190-E194 PolarHBondContact O-N 3Å; S190-E194 VanDerWaalsContact O-N 3.12Å; A191-E194 PolarHBondContact O-N 2.89Å; H192-E194 PolarHBondContact O-N 2.89Å; E194-K197 WeakPolarHBondContact O-CB 3.3Å; E194-K197 PolarHBondContact O-N 3.04Å; E194-K197 IonicContact OE1-NZ 3.27Å; E194-K197 PolarHBondContact OE1-NZ 2.81Å; E194-K197 IonicContact OE2-NZ 3.52Å; E194-Y198 PolarHBondContact O-N 2.89Å
195	L	85.7	Confident	81.8	Confident	120 Å²	120	103.7 Å²	103.7	63%	0.628	52%	0.519	S	S	*	.	H	α-helix	trans	-64.2	-42.6	175.7	-143.3	159.8	0	0	0	111.1	A191 H192 Y198 F199	A191-L195 WeakPolarHBondContact O-CB 3.39Å; A191-L195 PolarHBondContact O-N 2.85Å; H192-L195 PolarHBondContact O-N 3.07Å; L195-Y198 PolarHBondContact O-N 3.44Å; L195-F199 WeakPolarHBondContact O-CB 3.14Å; L195-F199 PolarHBondContact O-N 3.18Å
196	V	87	Confident	81.8	Confident	42 Å²	42	109 Å²	109	26%	0.255	53%	0.527	S	S	.	.	H	α-helix	trans	-64.9	-40.2	174.7	170.2	0	0	0	0	111.4	H192 M193 F199 R200	H192-V196 WeakPolarHBondContact O-CB 3.39Å; H192-V196 VanDerWaalsContact O-CG2 3.28Å; H192-V196 WeakPolarHBondContact O-CG2 3.46Å; H192-V196 PolarHBondContact O-N 3.38Å; M193-V196 PolarHBondContact O-N 3.25Å; V196-F199 PolarHBondContact O-N 2.82Å; V196-R200 WeakPolarHBondContact O-CG 3.44Å; V196-R200 PolarHBondContact O-N 3.35Å
197	K	82.4	Confident	81.8	Confident	126 Å²	126	113 Å²	113	55%	0.548	54%	0.536	S	S	.	.	H	α-helix	trans	-63.1	-44.4	176.2	-177	-178.5	170	-165	0	111.4	M193 E194 R200 S201	M193-K197 VanDerWaalsContact O-CB 3.31Å; M193-K197 WeakPolarHBondContact O-CB 3.29Å; M193-K197 PolarHBondContact O-N 2.87Å; E194-K197 WeakPolarHBondContact O-CB 3.3Å; E194-K197 PolarHBondContact O-N 3.04Å; E194-K197 IonicContact OE1-NZ 3.27Å; E194-K197 PolarHBondContact OE1-NZ 2.81Å; E194-K197 IonicContact OE2-NZ 3.52Å; K197-R200 PolarHBondContact O-N 3.36Å; K197-S201 WeakPolarHBondContact O-CB 3.28Å; K197-S201 PolarHBondContact O-N 3.47Å
198	Y	81.6	Confident	81.8	Confident	169 Å²	169	114.6 Å²	114.6	66%	0.663	55%	0.547	S	S	*	.	H	α-helix	trans	-63.6	-42.8	174.2	-168.3	-97.1	0	0	0	111.6	E194 L195 R200 S201 I202	E194-Y198 PolarHBondContact O-N 2.89Å; L195-Y198 PolarHBondContact O-N 3.44Å; Y198-R200 PolarHBondContact O-N 3.31Å; Y198-S201 WeakPolarHBondContact O-CB 3.42Å; Y198-S201 PolarHBondContact O-N 2.96Å; Y198-I202 PolarHBondContact O-N 3.35Å
199	F	84.6	Confident	81.8	Confident	137 Å²	137	112.8 Å²	112.8	60%	0.601	54%	0.542	S	S	*	.	H	α-helix	trans	-62.6	-38.7	176.6	-168.7	-96.1	0	0	0	112.9	L195 V196 I202 S203	L195-F199 WeakPolarHBondContact O-CB 3.14Å; L195-F199 PolarHBondContact O-N 3.18Å; V196-F199 PolarHBondContact O-N 2.82Å; F199-I202 VanDerWaalsContact O-CG2 3.26Å; F199-I202 WeakPolarHBondContact O-CG2 3.47Å; F199-S203 WeakPolarHBondContact O-CB 3.25Å; F199-S203 PolarHBondContact O-N 2.98Å
200	R	80.3	Confident	81.8	Confident	181 Å²	181	112 Å²	112	68%	0.683	54%	0.54	S	S	*	.	H	α-helix	trans	-69	-38.2	173.5	-74.2	-176.6	-167.1	170.1	5.5	112.2	V196 K197 Y198 S203 R204	V196-R200 WeakPolarHBondContact O-CG 3.44Å; V196-R200 PolarHBondContact O-N 3.35Å; K197-R200 PolarHBondContact O-N 3.36Å; Y198-R200 PolarHBondContact O-N 3.31Å; R200-S203 PolarHBondContact O-N 3.42Å; R200-R204 WeakPolarHBondContact O-CB 3.27Å; R200-R204 PolarHBondContact O-N 3.41Å
201	S	77.3	Confident	82.1	Confident	54 Å²	54	113.8 Å²	113.8	38%	0.378	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-46.3	177.8	-168.7	0	0	0	0	111.8	K197 Y198	K197-S201 WeakPolarHBondContact O-CB 3.28Å; K197-S201 PolarHBondContact O-N 3.47Å; Y198-S201 WeakPolarHBondContact O-CB 3.42Å; Y198-S201 PolarHBondContact O-N 2.96Å
202	I	74.3	Confident	82.3	Confident	99 Å²	99	114.7 Å²	114.7	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-68.4	-36.1	177.6	-160.2	169.5	0	0	0	111.7	Y198 F199	Y198-I202 PolarHBondContact O-N 3.35Å; F199-I202 VanDerWaalsContact O-CG2 3.26Å; F199-I202 WeakPolarHBondContact O-CG2 3.47Å
203	S	73.9	Confident	82.4	Confident	56 Å²	56	115.3 Å²	115.3	39%	0.392	54%	0.54	S	S	.	.	H	α-helix	trans	-69.5	-39.9	179.2	-172.2	0	0	0	0	112.9	F199 R200 N205 R206	F199-S203 WeakPolarHBondContact O-CB 3.25Å; F199-S203 PolarHBondContact O-N 2.98Å; R200-S203 PolarHBondContact O-N 3.42Å; S203-N205 VanDerWaalsContact C-N 3.28Å; S203-N205 PolarHBondContact O-N 3.33Å; S203-R206 WeakPolarHBondContact O-CB 3.49Å; S203-R206 VanDerWaalsContact O-CG 3.25Å; S203-R206 WeakPolarHBondContact O-CG 3.5Å; S203-R206 PolarHBondContact O-N 3.08Å
204	R	67.9	Low	82.6	Confident	192 Å²	192	112.3 Å²	112.3	73%	0.725	53%	0.533	S	S	*	.	H	α-helix	trans	-63.7	-31.7	-179.5	-176.9	170.4	56.6	-169.4	-3.7	113.1	R200 R206	R200-R204 WeakPolarHBondContact O-CB 3.27Å; R200-R204 PolarHBondContact O-N 3.41Å; R204-R206 VanDerWaalsContact C-N 3.29Å; R204-R206 PolarHBondContact O-N 3.4Å
205	N	78.1	Confident	83	Confident	88 Å²	88	111.8 Å²	111.8	47%	0.471	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	0.5	-178.3	-71.4	0.3	0	0	0	113.8	S203 W207 L208 A209	S203-N205 VanDerWaalsContact C-N 3.28Å; S203-N205 PolarHBondContact O-N 3.33Å; N205-W207 VanDerWaalsContact C-N 3.29Å; N205-W207 PolarHBondContact O-N 2.98Å; N205-L208 PolarHBondContact O-N 3.32Å; N205-A209 WeakPolarHBondContact O-CB 3.27Å; N205-A209 PolarHBondContact O-N 3.48Å
206	R	81.7	Confident	83.3	Confident	167 Å²	167	111.5 Å²	111.5	63%	0.63	54%	0.536	S	S	*	.	H	α-helix	trans	-58.5	-39.6	-179.6	-70.3	-179.3	75.7	168.8	5	112.5	S203 R204 A209 I210	S203-R206 WeakPolarHBondContact O-CB 3.49Å; S203-R206 VanDerWaalsContact O-CG 3.25Å; S203-R206 WeakPolarHBondContact O-CG 3.5Å; S203-R206 PolarHBondContact O-N 3.08Å; R204-R206 VanDerWaalsContact C-N 3.29Å; R204-R206 PolarHBondContact O-N 3.4Å; R206-A209 PolarHBondContact O-N 3.37Å; R206-I210 WeakPolarHBondContact O-CB 3.31Å; R206-I210 WeakPolarHBondContact O-CD1 3.5Å; R206-I210 WeakPolarHBondContact O-CG1 3.38Å; R206-I210 PolarHBondContact O-N 3.4Å
207	W	80.9	Confident	83.6	Confident	173 Å²	173	113.2 Å²	113.2	66%	0.655	54%	0.543	S	S	*	.	H	α-helix	trans	-69.3	-36.7	-179.6	-166.8	78.6	0	0	0	112.5	N205 K211	N205-W207 VanDerWaalsContact C-N 3.29Å; N205-W207 PolarHBondContact O-N 2.98Å; W207-K211 HydrophobicContact CD2-CD 4.17Å; W207-K211 HydrophobicContact CE3-CD 3.84Å; W207-K211 HydrophobicContact CH2-CD 4.19Å; W207-K211 HydrophobicContact CZ2-CD 4.36Å; W207-K211 HydrophobicContact CZ3-CD 3.86Å; W207-K211 WeakPolarHBondContact O-CG 3.47Å; W207-K211 PolarHBondContact O-N 3.39Å
208	L	82.9	Confident	84.1	Confident	113 Å²	113	110 Å²	110	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-66.5	-45	173.3	-173.7	138.3	0	0	0	110.9	N205 I210 K211 V212	N205-L208 PolarHBondContact O-N 3.32Å; L208-I210 PolarHBondContact O-N 2.96Å; L208-K211 PolarHBondContact O-N 3Å; L208-V212 HydrophobicContact CD2-CG2 4.41Å; L208-V212 WeakPolarHBondContact O-CG2 3.39Å; L208-V212 PolarHBondContact O-N 3.11Å
209	A	84	Confident	84.6	Confident	56 Å²	56	108.2 Å²	108.2	46%	0.463	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-43	175.8	0	0	0	0	0	112.3	N205 R206 K211 V212 F213	N205-A209 WeakPolarHBondContact O-CB 3.27Å; N205-A209 PolarHBondContact O-N 3.48Å; R206-A209 PolarHBondContact O-N 3.37Å; A209-K211 PolarHBondContact O-N 2.86Å; A209-V212 PolarHBondContact O-N 2.78Å; A209-F213 VanDerWaalsContact O-CB 3.27Å; A209-F213 WeakPolarHBondContact O-CB 3.35Å; A209-F213 PolarHBondContact O-N 2.9Å
210	I	86.7	Confident	85	Confident	102 Å²	102	108.7 Å²	108.7	52%	0.523	54%	0.538	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.5	-72.8	163.3	0	0	0	110.9	R206 L208 F213 A214	R206-I210 WeakPolarHBondContact O-CB 3.31Å; R206-I210 WeakPolarHBondContact O-CD1 3.5Å; R206-I210 WeakPolarHBondContact O-CG1 3.38Å; R206-I210 PolarHBondContact O-N 3.4Å; L208-I210 PolarHBondContact O-N 2.96Å; I210-F213 PolarHBondContact O-N 3.08Å; I210-A214 WeakPolarHBondContact O-CB 3.3Å; I210-A214 PolarHBondContact O-N 3.48Å
211	K	88.6	Confident	85.6	Confident	102 Å²	102	104.3 Å²	104.3	44%	0.443	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-46.6	177.3	-78.7	-176.7	165.6	-167	0	112.6	W207 L208 A209 F213 A214 V215	W207-K211 HydrophobicContact CD2-CD 4.17Å; W207-K211 HydrophobicContact CE3-CD 3.84Å; W207-K211 HydrophobicContact CH2-CD 4.19Å; W207-K211 HydrophobicContact CZ2-CD 4.36Å; W207-K211 HydrophobicContact CZ3-CD 3.86Å; W207-K211 WeakPolarHBondContact O-CG 3.47Å; W207-K211 PolarHBondContact O-N 3.39Å; L208-K211 PolarHBondContact O-N 3Å; A209-K211 PolarHBondContact O-N 2.86Å; K211-F213 VanDerWaalsContact C-N 3.29Å; K211-F213 PolarHBondContact O-N 3.01Å; K211-A214 PolarHBondContact O-N 3.07Å; K211-V215 WeakPolarHBondContact O-CG2 3.2Å; K211-V215 PolarHBondContact O-N 2.98Å
212	V	88.9	Confident	86.4	Confident	82 Å²	82	107.9 Å²	107.9	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-61.8	-41.2	177.3	173	0	0	0	0	110.5	L208 A209 V215 L216	L208-V212 HydrophobicContact CD2-CG2 4.41Å; L208-V212 WeakPolarHBondContact O-CG2 3.39Å; L208-V212 PolarHBondContact O-N 3.11Å; A209-V212 PolarHBondContact O-N 2.78Å; V212-V215 PolarHBondContact O-N 3.06Å; V212-L216 PolarHBondContact O-N 3.44Å
213	F	91.3	Very high	87.3	Confident	135 Å²	135	109.1 Å²	109.1	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-64.6	-41.1	176.4	-166.1	-106.9	0	0	0	112.5	A209 I210 K211 L216 I217	A209-F213 VanDerWaalsContact O-CB 3.27Å; A209-F213 WeakPolarHBondContact O-CB 3.35Å; A209-F213 PolarHBondContact O-N 2.9Å; I210-F213 PolarHBondContact O-N 3.08Å; K211-F213 VanDerWaalsContact C-N 3.29Å; K211-F213 PolarHBondContact O-N 3.01Å; F213-L216 PolarHBondContact O-N 2.7Å; F213-I217 HydrophobicContact CD1-CD1 3.61Å; F213-I217 HydrophobicContact CD1-CG1 4.47Å; F213-I217 HydrophobicContact CE1-CD1 3.39Å; F213-I217 HydrophobicContact CE1-CG1 4.32Å; F213-I217 HydrophobicContact CG-CD1 4.5Å; F213-I217 HydrophobicContact CZ-CD1 4.1Å; F213-I217 WeakPolarHBondContact O-CG1 3.45Å; F213-I217 PolarHBondContact O-N 3.24Å
214	A	92.3	Very high	88.2	Confident	53 Å²	53	109.9 Å²	109.9	44%	0.438	54%	0.541	S	S	.	.	H	α-helix	trans	-65.1	-39.9	176.3	0	0	0	0	0	112.6	I210 K211 I217 A218	I210-A214 WeakPolarHBondContact O-CB 3.3Å; I210-A214 PolarHBondContact O-N 3.48Å; K211-A214 PolarHBondContact O-N 3.07Å; A214-I217 PolarHBondContact O-N 3.29Å; A214-A218 WeakPolarHBondContact O-CB 3.48Å; A214-A218 PolarHBondContact O-N 3.25Å
215	V	92	Very high	89.5	Confident	101 Å²	101	106.1 Å²	106.1	61%	0.612	53%	0.534	S	S	*	.	H	α-helix	trans	-64.8	-42.2	175	172.1	0	0	0	0	110.9	K211 V212 I217 A218 F219	K211-V215 WeakPolarHBondContact O-CG2 3.2Å; K211-V215 PolarHBondContact O-N 2.98Å; V212-V215 PolarHBondContact O-N 3.06Å; V215-I217 PolarHBondContact O-N 2.52Å; V215-A218 PolarHBondContact O-N 2.97Å; V215-F219 WeakPolarHBondContact O-CB 3.49Å; V215-F219 PolarHBondContact O-N 3.39Å
216	L	93	Very high	90.2	Very high	113 Å²	113	106.7 Å²	106.7	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-60.7	-43	174.4	-87.4	174.5	0	0	0	112.4	V212 F213 F219 F220	V212-L216 PolarHBondContact O-N 3.44Å; F213-L216 PolarHBondContact O-N 2.7Å; L216-F219 PolarHBondContact O-N 3.2Å; L216-F220 VanDerWaalsContact O-CB 3.31Å; L216-F220 WeakPolarHBondContact O-CB 3.23Å; L216-F220 PolarHBondContact O-N 3.28Å
217	I	92.6	Very high	90.7	Very high	79 Å²	79	106 Å²	106	41%	0.405	55%	0.546	S	S	.	.	H	α-helix	trans	-63.1	-46	176	-71.4	169.5	0	0	0	111	F213 A214 V215 F219 F220 I221	F213-I217 HydrophobicContact CD1-CD1 3.61Å; F213-I217 HydrophobicContact CD1-CG1 4.47Å; F213-I217 HydrophobicContact CE1-CD1 3.39Å; F213-I217 HydrophobicContact CE1-CG1 4.32Å; F213-I217 HydrophobicContact CG-CD1 4.5Å; F213-I217 HydrophobicContact CZ-CD1 4.1Å; F213-I217 WeakPolarHBondContact O-CG1 3.45Å; F213-I217 PolarHBondContact O-N 3.24Å; A214-I217 PolarHBondContact O-N 3.29Å; V215-I217 PolarHBondContact O-N 2.52Å; I217-F219 VanDerWaalsContact C-N 3.33Å; I217-F219 PolarHBondContact O-N 3.19Å; I217-F220 PolarHBondContact O-N 3.33Å; I217-I221 HydrophobicContact CG2-CD1 3.73Å; I217-I221 HydrophobicContact CG2-CG1 4.39Å; I217-I221 VanDerWaalsContact O-CG1 3.3Å; I217-I221 WeakPolarHBondContact O-CG1 3.45Å; I217-I221 PolarHBondContact O-N 3.41Å
218	A	92.4	Very high	90.9	Very high	59 Å²	59	107.3 Å²	107.3	49%	0.488	56%	0.564	S	S	.	*	H	α-helix	trans	-62.2	-41.8	179.1	0	0	0	0	0	111.9	A214 V215 I221 F222	A214-A218 WeakPolarHBondContact O-CB 3.48Å; A214-A218 PolarHBondContact O-N 3.25Å; V215-A218 PolarHBondContact O-N 2.97Å; A218-I221 PolarHBondContact O-N 3.05Å; A218-F222 WeakPolarHBondContact O-CB 3.35Å; A218-F222 PolarHBondContact O-N 3.46Å
219	F	92.7	Very high	91.3	Very high	131 Å²	131	107 Å²	107	58%	0.575	56%	0.563	S	S	*	*	H	α-helix	trans	-66.3	-40.7	176.4	-156.9	-90.8	0	0	0	111.7	V215 L216 I217 F222 F223	V215-F219 WeakPolarHBondContact O-CB 3.49Å; V215-F219 PolarHBondContact O-N 3.39Å; L216-F219 PolarHBondContact O-N 3.2Å; I217-F219 VanDerWaalsContact C-N 3.33Å; I217-F219 PolarHBondContact O-N 3.19Å; F219-F222 PolarHBondContact O-N 3.03Å; F219-F223 HydrophobicContact CE1-CD2 4.09Å; F219-F223 WeakPolarHBondContact O-CB 3.05Å; F219-F223 PolarHBondContact O-N 3.43Å
220	F	93	Very high	91.7	Very high	147 Å²	147	109.7 Å²	109.7	65%	0.645	57%	0.568	S	S	*	*	H	α-helix	trans	-60.7	-46.8	174.8	-176.8	-95.6	0	0	0	111.6	L216 I217 F223 V224	L216-F220 VanDerWaalsContact O-CB 3.31Å; L216-F220 WeakPolarHBondContact O-CB 3.23Å; L216-F220 PolarHBondContact O-N 3.28Å; I217-F220 PolarHBondContact O-N 3.33Å; F220-F223 PolarHBondContact O-N 2.83Å; F220-V224 HydrophobicContact CD1-CG2 4.24Å; F220-V224 HydrophobicContact CE1-CG2 3.93Å; F220-V224 HydrophobicContact CZ-CG2 4.1Å; F220-V224 WeakPolarHBondContact O-CB 2.91Å; F220-V224 VanDerWaalsContact O-CG2 3.26Å; F220-V224 WeakPolarHBondContact O-CG2 3.48Å; F220-V224 PolarHBondContact O-N 2.97Å
221	I	93.2	Very high	92	Very high	89 Å²	89	110.1 Å²	110.1	46%	0.456	57%	0.571	S	S	.	*	H	α-helix	trans	-62.1	-45.9	176.7	-67.5	167.5	0	0	0	110.9	I217 A218 F223 V224 I225	I217-I221 HydrophobicContact CG2-CD1 3.73Å; I217-I221 HydrophobicContact CG2-CG1 4.39Å; I217-I221 VanDerWaalsContact O-CG1 3.3Å; I217-I221 WeakPolarHBondContact O-CG1 3.45Å; I217-I221 PolarHBondContact O-N 3.41Å; A218-I221 PolarHBondContact O-N 3.05Å; I221-F223 PolarHBondContact O-N 3.01Å; I221-V224 PolarHBondContact O-N 3.22Å; I221-I225 HydrophobicContact CG2-CD1 3.7Å; I221-I225 HydrophobicContact CG2-CG1 4.44Å; I221-I225 VanDerWaalsContact O-CG1 3.3Å; I221-I225 WeakPolarHBondContact O-CG1 3.18Å; I221-I225 PolarHBondContact O-N 2.76Å
222	F	93.7	Very high	92.2	Very high	128 Å²	128	110.6 Å²	110.6	56%	0.561	58%	0.578	S	S	*	*	H	α-helix	trans	-60	-45.5	176.9	178	-96.3	0	0	0	111.8	A218 F219 V224 I225 V226	A218-F222 WeakPolarHBondContact O-CB 3.35Å; A218-F222 PolarHBondContact O-N 3.46Å; F219-F222 PolarHBondContact O-N 3.03Å; F222-V224 PolarHBondContact O-N 2.84Å; F222-I225 PolarHBondContact O-N 2.94Å; F222-V226 HydrophobicContact CD1-CG2 4.25Å; F222-V226 HydrophobicContact CD2-CG2 4.29Å; F222-V226 HydrophobicContact CE1-CG2 3.85Å; F222-V226 HydrophobicContact CE2-CG2 3.9Å; F222-V226 HydrophobicContact CG-CG2 4.46Å; F222-V226 HydrophobicContact CZ-CG2 3.67Å; F222-V226 WeakPolarHBondContact O-CG2 3.33Å; F222-V226 PolarHBondContact O-N 3.04Å
223	F	93.3	Very high	92.4	Very high	126 Å²	126	112.4 Å²	112.4	55%	0.553	58%	0.583	S	S	*	*	H	α-helix	trans	-63.5	-42.2	179.1	-150.4	-88.2	0	0	0	111.2	F219 F220 I221 V226 M227	F219-F223 HydrophobicContact CE1-CD2 4.09Å; F219-F223 WeakPolarHBondContact O-CB 3.05Å; F219-F223 PolarHBondContact O-N 3.43Å; F220-F223 PolarHBondContact O-N 2.83Å; I221-F223 PolarHBondContact O-N 3.01Å; F223-V226 PolarHBondContact O-N 2.83Å; F223-M227 HydrophobicContact CE1-CG 4.43Å; F223-M227 VanDerWaalsContact O-CB 3.32Å; F223-M227 WeakPolarHBondContact O-CB 3.24Å; F223-M227 PolarHBondContact O-N 3.1Å
224	V	93.9	Very high	92.5	Very high	72 Å²	72	110.9 Å²	110.9	44%	0.436	58%	0.583	S	S	.	*	H	α-helix	trans	-61.8	-42.7	175	170.5	0	0	0	0	111.5	F220 I221 F222 L228	F220-V224 HydrophobicContact CD1-CG2 4.24Å; F220-V224 HydrophobicContact CE1-CG2 3.93Å; F220-V224 HydrophobicContact CZ-CG2 4.1Å; F220-V224 WeakPolarHBondContact O-CB 2.91Å; F220-V224 VanDerWaalsContact O-CG2 3.26Å; F220-V224 WeakPolarHBondContact O-CG2 3.48Å; F220-V224 PolarHBondContact O-N 2.97Å; I221-V224 PolarHBondContact O-N 3.22Å; F222-V224 PolarHBondContact O-N 2.84Å; V224-L228 WeakPolarHBondContact O-CB 3.39Å; V224-L228 PolarHBondContact O-N 3.18Å; V224-L228 VanDerWaalsContact O-N 3.1Å
225	I	94.1	Very high	92.5	Very high	113 Å²	113	115 Å²	115	58%	0.579	59%	0.593	S	S	*	*	H	α-helix	trans	-68.6	-35.5	179.4	-69.1	167.9	0	0	0	112.3	I221 F222	I221-I225 HydrophobicContact CG2-CD1 3.7Å; I221-I225 HydrophobicContact CG2-CG1 4.44Å; I221-I225 VanDerWaalsContact O-CG1 3.3Å; I221-I225 WeakPolarHBondContact O-CG1 3.18Å; I221-I225 PolarHBondContact O-N 2.76Å; F222-I225 PolarHBondContact O-N 2.94Å
226	V	93.2	Very high	92.5	Very high	99 Å²	99	116.1 Å²	116.1	60%	0.6	59%	0.592	S	S	*	*	H	α-helix	trans	-80.1	-28.8	-179	171.9	0	0	0	0	112.2	F222 F223	F222-V226 HydrophobicContact CD1-CG2 4.25Å; F222-V226 HydrophobicContact CD2-CG2 4.29Å; F222-V226 HydrophobicContact CE1-CG2 3.85Å; F222-V226 HydrophobicContact CE2-CG2 3.9Å; F222-V226 HydrophobicContact CG-CG2 4.46Å; F222-V226 HydrophobicContact CZ-CG2 3.67Å; F222-V226 WeakPolarHBondContact O-CG2 3.33Å; F222-V226 PolarHBondContact O-N 3.04Å; F223-V226 PolarHBondContact O-N 2.83Å
227	M	92.2	Very high	92.5	Very high	153 Å²	153	116.3 Å²	116.3	75%	0.754	59%	0.592	S	S	*	*	H	α-helix	trans	-86.1	-21.8	179.1	-127.3	-76.4	145.2	0	0	113.4	F223	F223-M227 HydrophobicContact CE1-CG 4.43Å; F223-M227 VanDerWaalsContact O-CB 3.32Å; F223-M227 WeakPolarHBondContact O-CB 3.24Å; F223-M227 PolarHBondContact O-N 3.1Å
228	L	85.3	Confident	92.4	Very high	200 Å²	200	119.7 Å²	119.7	100%	1.047	61%	0.609	S	S	*	*			trans	-85.4	0	174.7	-165.7	105.6	0	0	0	111.1	V224	V224-L228 WeakPolarHBondContact O-CB 3.39Å; V224-L228 PolarHBondContact O-N 3.18Å; V224-L228 VanDerWaalsContact O-N 3.1Å

Retrieved 228 of 228 residues in 183.9 ms (Link to these results)

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