A0A077Z842_TRITR Loading...

Peptidase family M48 containing protein

AlphaFold DB , UniProt , Accession A0A077Z842, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 229 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	44.9	Very low	71.9	Confident	237 Å²	237	110.3 Å²	110.3	100%	1.167	61%	0.605	S	S	*	*				0	125.7	0	-82.9	171.7	115.7	0	0	107.2
2	L	66.1	Low	72.2	Confident	122 Å²	122	110.6 Å²	110.6	64%	0.639	60%	0.597	S	S	*	*			trans	-64.5	133.3	169.6	-115.8	88.1	0	0	0	108.2	Q6 I7	L2-Q6 HydrophobicContact CD2-CB 4.09Å; L2-Q6 HydrophobicContact CG-CB 4.22Å; L2-I7 HydrophobicContact CB-CD1 4.47Å; L2-I7 HydrophobicContact CB-CG1 4.29Å; L2-I7 HydrophobicContact CD2-CG1 3.71Å
3	T	81	Confident	72.3	Confident	70 Å²	70	106.5 Å²	106.5	43%	0.429	57%	0.568	S	S	.	*			trans	-76.2	153.8	174.6	60.4	0	0	0	0	110	E5 Q6 I7	T3-E5 PolarHBondContact O-N 2.86Å; T3-Q6 PolarHBondContact O-N 3.28Å; T3-Q6 VanDerWaalsContact O-N 3.07Å; T3-Q6 WeakPolarHBondContact OG1-CG 3.48Å; T3-Q6 PolarHBondContact OG1-N 2.65Å; T3-I7 PolarHBondContact O-N 2.76Å
4	A	75.4	Confident	72.7	Confident	82 Å²	82	106.5 Å²	106.5	68%	0.678	57%	0.567	S	S	*	*	H	α-helix	trans	-56.6	-32.6	177.1	0	0	0	0	0	112.2	I7 F8	A4-I7 PolarHBondContact O-N 3.03Å; A4-F8 WeakPolarHBondContact O-CB 3.35Å; A4-F8 PolarHBondContact O-N 2.9Å
5	E	73.7	Confident	73	Confident	150 Å²	150	103.1 Å²	103.1	70%	0.701	56%	0.556	S	S	*	*	H	α-helix	trans	-62.7	-45.5	174.7	-64.4	-179	164.9	0	0	112.2	T3 I7 F8 T9	T3-E5 PolarHBondContact O-N 2.86Å; E5-I7 VanDerWaalsContact C-N 3.28Å; E5-I7 PolarHBondContact O-N 2.86Å; E5-F8 PolarHBondContact O-N 2.9Å; E5-T9 PolarHBondContact O-N 3.09Å; E5-T9 PolarHBondContact O-OG1 3.36Å; E5-T9 VanDerWaalsContact O-OG1 3.09Å
6	Q	75.2	Confident	73	Confident	105 Å²	105	100.9 Å²	100.9	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-61.8	-38.5	177.6	-73.3	173.1	-20.9	0	0	111.9	L2 T3 A10	L2-Q6 HydrophobicContact CD2-CB 4.09Å; L2-Q6 HydrophobicContact CG-CB 4.22Å; T3-Q6 PolarHBondContact O-N 3.28Å; T3-Q6 VanDerWaalsContact O-N 3.07Å; T3-Q6 WeakPolarHBondContact OG1-CG 3.48Å; T3-Q6 PolarHBondContact OG1-N 2.65Å; Q6-A10 WeakPolarHBondContact O-CB 3.42Å; Q6-A10 PolarHBondContact O-N 3.02Å
7	I	76.2	Confident	73.3	Confident	89 Å²	89	97.6 Å²	97.6	46%	0.456	53%	0.527	S	S	.	.	H	α-helix	trans	-66.4	-45.6	175.7	-60.7	173.4	0	0	0	110	L2 T3 A4 E5 A10 C11	L2-I7 HydrophobicContact CB-CD1 4.47Å; L2-I7 HydrophobicContact CB-CG1 4.29Å; L2-I7 HydrophobicContact CD2-CG1 3.71Å; T3-I7 PolarHBondContact O-N 2.76Å; A4-I7 PolarHBondContact O-N 3.03Å; E5-I7 VanDerWaalsContact C-N 3.28Å; E5-I7 PolarHBondContact O-N 2.86Å; I7-A10 PolarHBondContact O-N 3.25Å; I7-C11 WeakPolarHBondContact O-CB 3.46Å; I7-C11 PolarHBondContact O-N 3.42Å; I7-C11 PolarHBondContact O-SG 3.32Å; I7-C11 VanDerWaalsContact O-SG 3.32Å
8	F	74.7	Confident	73.6	Confident	146 Å²	146	99.9 Å²	99.9	64%	0.64	53%	0.534	S	S	*	.	H	α-helix	trans	-62.6	-44.9	179.2	-173.5	-96.3	0	0	0	112.2	A4 E5 A10 C11 F12	A4-F8 WeakPolarHBondContact O-CB 3.35Å; A4-F8 PolarHBondContact O-N 2.9Å; E5-F8 PolarHBondContact O-N 2.9Å; F8-A10 PolarHBondContact O-N 3Å; F8-C11 PolarHBondContact O-N 2.95Å; F8-F12 WeakPolarHBondContact O-CB 3.45Å; F8-F12 PolarHBondContact O-N 3.5Å
9	T	72.6	Confident	73.7	Confident	86 Å²	86	100.2 Å²	100.2	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-42	177	-59	0	0	0	0	111.6	E5 F12 Y13	E5-T9 PolarHBondContact O-N 3.09Å; E5-T9 PolarHBondContact O-OG1 3.36Å; E5-T9 VanDerWaalsContact O-OG1 3.09Å; T9-F12 PolarHBondContact O-N 3.14Å; T9-Y13 WeakPolarHBondContact O-CB 3.37Å; T9-Y13 PolarHBondContact O-N 3.48Å
10	A	74.3	Confident	73.6	Confident	52 Å²	52	97.6 Å²	97.6	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-44.7	175.9	0	0	0	0	0	112.1	Q6 I7 F8 Y13 L14	Q6-A10 WeakPolarHBondContact O-CB 3.42Å; Q6-A10 PolarHBondContact O-N 3.02Å; I7-A10 PolarHBondContact O-N 3.25Å; F8-A10 PolarHBondContact O-N 3Å; A10-Y13 PolarHBondContact O-N 3.35Å; A10-L14 WeakPolarHBondContact O-CG 3.42Å; A10-L14 PolarHBondContact O-N 3.45Å
11	C	76.8	Confident	73.7	Confident	74 Å²	74	94.8 Å²	94.8	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-42.5	175.7	-72.6	0	0	0	0	112.2	I7 F8 L14 S15	I7-C11 WeakPolarHBondContact O-CB 3.46Å; I7-C11 PolarHBondContact O-N 3.42Å; I7-C11 PolarHBondContact O-SG 3.32Å; I7-C11 VanDerWaalsContact O-SG 3.32Å; F8-C11 PolarHBondContact O-N 2.95Å; C11-L14 PolarHBondContact O-N 3.48Å; C11-S15 PolarHBondContact O-N 2.88Å
12	F	76	Confident	75.2	Confident	114 Å²	114	84.4 Å²	84.4	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.7	-176.9	-104.5	0	0	0	111.1	F8 T9 L14 S15 L16	F8-F12 WeakPolarHBondContact O-CB 3.45Å; F8-F12 PolarHBondContact O-N 3.5Å; T9-F12 PolarHBondContact O-N 3.14Å; F12-L14 PolarHBondContact O-N 3.28Å; F12-S15 PolarHBondContact O-N 3.33Å; F12-S15 PolarHBondContact O-OG 2.86Å; F12-L16 HydrophobicContact CD1-CD1 3.89Å; F12-L16 HydrophobicContact CD1-CG 4.44Å; F12-L16 HydrophobicContact CE1-CD1 3.41Å; F12-L16 VanDerWaalsContact CE1-CD1 3.41Å; F12-L16 HydrophobicContact CE1-CG 4.09Å; F12-L16 HydrophobicContact CZ-CD1 3.94Å; F12-L16 HydrophobicContact CZ-CD2 4.46Å; F12-L16 HydrophobicContact CZ-CG 4.24Å; F12-L16 PolarHBondContact O-N 2.87Å
13	Y	72.9	Confident	75.5	Confident	58 Å²	58	82.6 Å²	82.6	23%	0.227	46%	0.457	C	S	.	.	H	α-helix	trans	-61.1	-45.1	176.6	-175	-101.8	0	0	0	112	T9 A10 S15 L16 V17 I64 Q67	T9-Y13 WeakPolarHBondContact O-CB 3.37Å; T9-Y13 PolarHBondContact O-N 3.48Å; A10-Y13 PolarHBondContact O-N 3.35Å; Y13-S15 VanDerWaalsContact C-N 3.32Å; Y13-S15 PolarHBondContact O-N 2.9Å; Y13-L16 WeakPolarHBondContact O-CB 3.19Å; Y13-L16 PolarHBondContact O-N 3.42Å; Y13-L16 VanDerWaalsContact O-N 3.16Å; Y13-V17 HydrophobicContact CD1-CG2 3.95Å; Y13-V17 HydrophobicContact CE1-CG2 3.58Å; Y13-V17 HydrophobicContact CE2-CG2 4.41Å; Y13-V17 WeakPolarHBondContact O-CG2 3.48Å; Y13-V17 PolarHBondContact O-N 3.11Å; Y13-I64 WeakPolarHBondContact OH-CD1 3.41Å; Y13-I64 WeakPolarHBondContact OH-CG1 3.47Å; Y13-Q67 VanDerWaalsContact CD2-NE2 3.34Å
14	L	78.2	Confident	75	Confident	106 Å²	106	82.2 Å²	82.2	56%	0.555	45%	0.448	S	S	*	.	H	α-helix	trans	-58.7	-43	174.7	-73	171.2	0	0	0	111.9	A10 C11 F12 L16 V17 E18	A10-L14 WeakPolarHBondContact O-CG 3.42Å; A10-L14 PolarHBondContact O-N 3.45Å; C11-L14 PolarHBondContact O-N 3.48Å; F12-L14 PolarHBondContact O-N 3.28Å; L14-L16 VanDerWaalsContact C-N 3.31Å; L14-L16 PolarHBondContact O-N 2.93Å; L14-V17 PolarHBondContact O-N 3.26Å; L14-E18 WeakPolarHBondContact O-CG 3.43Å; L14-E18 PolarHBondContact O-N 3.45Å
15	S	76.5	Confident	74.9	Confident	56 Å²	56	86.1 Å²	86.1	39%	0.392	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-36	177	76.8	0	0	0	0	112.8	C11 F12 Y13 E18 L19	C11-S15 PolarHBondContact O-N 2.88Å; F12-S15 PolarHBondContact O-N 3.33Å; F12-S15 PolarHBondContact O-OG 2.86Å; Y13-S15 VanDerWaalsContact C-N 3.32Å; Y13-S15 PolarHBondContact O-N 2.9Å; S15-E18 PolarHBondContact O-N 3.45Å; S15-L19 WeakPolarHBondContact O-CB 3.28Å; S15-L19 PolarHBondContact O-N 3.38Å
16	L	74.3	Confident	74.9	Confident	67 Å²	67	86.5 Å²	86.5	35%	0.351	45%	0.445	S	S	.	.	H	α-helix	trans	-67.9	-43.6	173.9	-75.9	177	0	0	0	111.5	F12 Y13 L14 E18 L19 V20	F12-L16 HydrophobicContact CD1-CD1 3.89Å; F12-L16 HydrophobicContact CD1-CG 4.44Å; F12-L16 HydrophobicContact CE1-CD1 3.41Å; F12-L16 VanDerWaalsContact CE1-CD1 3.41Å; F12-L16 HydrophobicContact CE1-CG 4.09Å; F12-L16 HydrophobicContact CZ-CD1 3.94Å; F12-L16 HydrophobicContact CZ-CD2 4.46Å; F12-L16 HydrophobicContact CZ-CG 4.24Å; F12-L16 PolarHBondContact O-N 2.87Å; Y13-L16 WeakPolarHBondContact O-CB 3.19Å; Y13-L16 PolarHBondContact O-N 3.42Å; Y13-L16 VanDerWaalsContact O-N 3.16Å; L14-L16 VanDerWaalsContact C-N 3.31Å; L14-L16 PolarHBondContact O-N 2.93Å; L16-E18 VanDerWaalsContact C-N 3.31Å; L16-E18 PolarHBondContact O-N 2.95Å; L16-L19 PolarHBondContact O-N 3.48Å; L16-V20 WeakPolarHBondContact O-CB 3.42Å; L16-V20 VanDerWaalsContact O-CG2 3.31Å; L16-V20 WeakPolarHBondContact O-CG2 3.36Å; L16-V20 PolarHBondContact O-N 3.49Å
17	V	76.6	Confident	74.5	Confident	45 Å²	45	84.1 Å²	84.1	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-59.5	-44.4	175.6	178.2	0	0	0	0	110.4	Y13 L14 V20 A21 F60	Y13-V17 HydrophobicContact CD1-CG2 3.95Å; Y13-V17 HydrophobicContact CE1-CG2 3.58Å; Y13-V17 HydrophobicContact CE2-CG2 4.41Å; Y13-V17 WeakPolarHBondContact O-CG2 3.48Å; Y13-V17 PolarHBondContact O-N 3.11Å; L14-V17 PolarHBondContact O-N 3.26Å; V17-V20 PolarHBondContact O-N 3.09Å; V17-A21 VanDerWaalsContact O-CB 3.22Å; V17-A21 WeakPolarHBondContact O-CB 3.27Å; V17-A21 PolarHBondContact O-N 3.44Å; V17-F60 HydrophobicContact CG1-CE2 4.27Å; V17-F60 HydrophobicContact CG2-CE2 3.83Å
18	E	78.6	Confident	74.1	Confident	139 Å²	139	85.8 Å²	85.8	65%	0.65	44%	0.439	S	S	*	.	H	α-helix	trans	-63.7	-40.7	176.7	-74.3	-177.6	172.1	0	0	112.7	L14 S15 L16 G22	L14-E18 WeakPolarHBondContact O-CG 3.43Å; L14-E18 PolarHBondContact O-N 3.45Å; S15-E18 PolarHBondContact O-N 3.45Å; L16-E18 VanDerWaalsContact C-N 3.31Å; L16-E18 PolarHBondContact O-N 2.95Å; E18-G22 PolarHBondContact O-N 3.49Å
19	L	76.7	Confident	73.7	Confident	106 Å²	106	82.5 Å²	82.5	56%	0.555	44%	0.439	S	S	*	.	H	α-helix	trans	-63.4	-48.5	176.4	-175	71	0	0	0	111.1	S15 L16 G22 I23	S15-L19 WeakPolarHBondContact O-CB 3.28Å; S15-L19 PolarHBondContact O-N 3.38Å; L16-L19 PolarHBondContact O-N 3.48Å; L19-G22 WeakPolarHBondContact O-CA 3.44Å; L19-G22 PolarHBondContact O-N 2.97Å; L19-G22 VanDerWaalsContact O-N 3.15Å; L19-I23 HydrophobicContact CG-CD1 4.29Å; L19-I23 WeakPolarHBondContact O-CG1 3.3Å; L19-I23 PolarHBondContact O-N 3.42Å
20	V	71.4	Confident	73.2	Confident	47 Å²	47	80.9 Å²	80.9	29%	0.285	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-44.1	178.3	172.5	0	0	0	0	110.5	L16 V17 G22 I23 Y24	L16-V20 WeakPolarHBondContact O-CB 3.42Å; L16-V20 VanDerWaalsContact O-CG2 3.31Å; L16-V20 WeakPolarHBondContact O-CG2 3.36Å; L16-V20 PolarHBondContact O-N 3.49Å; V17-V20 PolarHBondContact O-N 3.09Å; V20-G22 VanDerWaalsContact C-N 3.29Å; V20-G22 PolarHBondContact O-N 3.07Å; V20-I23 PolarHBondContact O-N 3.12Å; V20-Y24 WeakPolarHBondContact O-CB 3.3Å; V20-Y24 PolarHBondContact O-N 2.92Å
21	A	75.5	Confident	72.5	Confident	39 Å²	39	85.5 Å²	85.5	32%	0.322	45%	0.445	S	S	.	.	H	α-helix	trans	-62.6	-36.3	173.9	0	0	0	0	0	111.9	V17 Y24 R25	V17-A21 VanDerWaalsContact O-CB 3.22Å; V17-A21 WeakPolarHBondContact O-CB 3.27Å; V17-A21 PolarHBondContact O-N 3.44Å; A21-Y24 PolarHBondContact O-N 3.44Å; A21-R25 WeakPolarHBondContact O-CB 3.34Å; A21-R25 VanDerWaalsContact O-CG 3.26Å; A21-R25 WeakPolarHBondContact O-CG 3.3Å; A21-R25 PolarHBondContact O-N 3.26Å; A21-R25 PolarHBondContact O-NE 3.22Å
22	G	77	Confident	71.7	Confident	20 Å²	20	85.2 Å²	85.2	21%	0.206	44%	0.439	C	S	.	.	H	α-helix	trans	-62.7	-44.9	172.6	0	0	0	0	0	112.5	E18 L19 V20 K26	E18-G22 PolarHBondContact O-N 3.49Å; L19-G22 WeakPolarHBondContact O-CA 3.44Å; L19-G22 PolarHBondContact O-N 2.97Å; L19-G22 VanDerWaalsContact O-N 3.15Å; V20-G22 VanDerWaalsContact C-N 3.29Å; V20-G22 PolarHBondContact O-N 3.07Å; G22-K26 WeakPolarHBondContact O-CB 3.3Å; G22-K26 VanDerWaalsContact O-CG 3.31Å; G22-K26 WeakPolarHBondContact O-CG 3.35Å; G22-K26 PolarHBondContact O-N 3.02Å
23	I	72.7	Confident	71	Confident	84 Å²	84	81.8 Å²	81.8	43%	0.431	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-46.3	175.5	-67	166	0	0	0	110.2	L19 V20 R25 K26 Q27	L19-I23 HydrophobicContact CG-CD1 4.29Å; L19-I23 WeakPolarHBondContact O-CG1 3.3Å; L19-I23 PolarHBondContact O-N 3.42Å; V20-I23 PolarHBondContact O-N 3.12Å; I23-R25 PolarHBondContact O-N 3.14Å; I23-K26 PolarHBondContact O-N 3.27Å; I23-Q27 HydrophobicContact CG2-CG 4.25Å; I23-Q27 VanDerWaalsContact O-CG 3.31Å; I23-Q27 WeakPolarHBondContact O-CG 3.24Å; I23-Q27 PolarHBondContact O-N 3.19Å
24	Y	70.1	Confident	70.3	Confident	61 Å²	61	87 Å²	87	24%	0.239	46%	0.459	C	S	.	.	H	α-helix	trans	-56.7	-51.3	178.3	-170.3	-83.7	0	0	0	111.4	V20 A21 K26 Q27 E28 L53 K57	V20-Y24 WeakPolarHBondContact O-CB 3.3Å; V20-Y24 PolarHBondContact O-N 2.92Å; A21-Y24 PolarHBondContact O-N 3.44Å; Y24-K26 VanDerWaalsContact C-N 3.31Å; Y24-K26 PolarHBondContact O-N 2.67Å; Y24-Q27 PolarHBondContact O-N 2.93Å; Y24-Q27 VanDerWaalsContact O-N 3.15Å; Y24-E28 WeakPolarHBondContact CE1-OE2 3.44Å; Y24-E28 WeakPolarHBondContact O-CB 3.28Å; Y24-E28 PolarHBondContact O-N 3.43Å; Y24-L53 HydrophobicContact CD2-CD1 3.46Å; Y24-L53 VanDerWaalsContact CD2-CD1 3.46Å; Y24-L53 HydrophobicContact CD2-CG 4.31Å; Y24-L53 HydrophobicContact CE1-CD1 4.31Å; Y24-L53 HydrophobicContact CE2-CD1 3.16Å; Y24-L53 HydrophobicContact CE2-CD2 4.29Å; Y24-L53 HydrophobicContact CE2-CG 3.65Å; Y24-L53 HydrophobicContact CG-CD1 4.16Å; Y24-K57 HydrophobicContact CE2-CD 4.49Å; Y24-K57 VanDerWaalsContact CE2-CE 3.5Å; Y24-K57 HydrophobicContact CE2-CG 4.16Å; Y24-K57 VanDerWaalsContact OH-CE 3.28Å; Y24-K57 WeakPolarHBondContact OH-CE 3.49Å; Y24-K57 PolarHBondContact OH-NZ 3.43Å
25	R	73.5	Confident	69.5	Low	165 Å²	165	90.2 Å²	90.2	62%	0.623	47%	0.471	S	S	*	.	H	α-helix	trans	-59.4	-41.3	177.3	-75.2	-176.9	-66.2	-158.3	1.5	112.1	A21 I23 A29	A21-R25 WeakPolarHBondContact O-CB 3.34Å; A21-R25 VanDerWaalsContact O-CG 3.26Å; A21-R25 WeakPolarHBondContact O-CG 3.3Å; A21-R25 PolarHBondContact O-N 3.26Å; A21-R25 PolarHBondContact O-NE 3.22Å; I23-R25 PolarHBondContact O-N 3.14Å; R25-A29 WeakPolarHBondContact O-CB 3.27Å; R25-A29 PolarHBondContact O-N 3.21Å
26	K	72.4	Confident	68.6	Low	157 Å²	157	89.8 Å²	89.8	68%	0.683	46%	0.464	S	S	*	.	H	α-helix	trans	-63.6	-44.4	175.6	-75.3	178	-178.7	-177.4	0	111.5	G22 I23 Y24 A29 T30	G22-K26 WeakPolarHBondContact O-CB 3.3Å; G22-K26 VanDerWaalsContact O-CG 3.31Å; G22-K26 WeakPolarHBondContact O-CG 3.35Å; G22-K26 PolarHBondContact O-N 3.02Å; I23-K26 PolarHBondContact O-N 3.27Å; Y24-K26 VanDerWaalsContact C-N 3.31Å; Y24-K26 PolarHBondContact O-N 2.67Å; K26-A29 PolarHBondContact O-N 3.33Å; K26-T30 WeakPolarHBondContact O-CB 3.36Å; K26-T30 PolarHBondContact O-N 2.9Å; K26-T30 PolarHBondContact O-OG1 2.82Å
27	Q	67.5	Low	67.7	Low	55 Å²	55	94.9 Å²	94.9	26%	0.257	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-40	179.3	-68.3	-65.1	-47.1	0	0	112	I23 Y24 R49	I23-Q27 HydrophobicContact CG2-CG 4.25Å; I23-Q27 VanDerWaalsContact O-CG 3.31Å; I23-Q27 WeakPolarHBondContact O-CG 3.24Å; I23-Q27 PolarHBondContact O-N 3.19Å; Y24-Q27 PolarHBondContact O-N 2.93Å; Y24-Q27 VanDerWaalsContact O-N 3.15Å; Q27-R49 WeakPolarHBondContact O-CD 3.43Å
28	E	68.8	Low	66.8	Low	125 Å²	125	99.7 Å²	99.7	58%	0.584	50%	0.499	S	S	*	.	H	α-helix	trans	-67.6	-41.1	176.8	-172.5	169.7	-151.6	0	0	112.1	Y24 T30	Y24-E28 WeakPolarHBondContact CE1-OE2 3.44Å; Y24-E28 WeakPolarHBondContact O-CB 3.28Å; Y24-E28 PolarHBondContact O-N 3.43Å; E28-T30 VanDerWaalsContact C-N 3.34Å
29	A	65.9	Low	66.1	Low	77 Å²	77	95.1 Å²	95.1	64%	0.636	48%	0.479	S	S	*	.	H	α-helix	trans	-78.9	-12.3	179.2	0	0	0	0	0	114.3	R25 K26 I31	R25-A29 WeakPolarHBondContact O-CB 3.27Å; R25-A29 PolarHBondContact O-N 3.21Å; K26-A29 PolarHBondContact O-N 3.33Å; A29-I31 PolarHBondContact O-N 3.31Å
30	T	61.9	Low	65.4	Low	51 Å²	51	90.7 Å²	90.7	31%	0.313	46%	0.456	S	S	.	.			trans	-74.8	101.6	178.9	-57.4	0	0	0	0	109.3	K26 E28 F45 R49	K26-T30 WeakPolarHBondContact O-CB 3.36Å; K26-T30 PolarHBondContact O-N 2.9Å; K26-T30 PolarHBondContact O-OG1 2.82Å; E28-T30 VanDerWaalsContact C-N 3.34Å; T30-F45 HydrophobicContact CG2-CZ 3.92Å; T30-R49 PolarHBondContact O-NH1 2.92Å; T30-R49 VanDerWaalsContact O-NH1 3.08Å
31	I	59.5	Low	65.3	Low	149 Å²	149	93.8 Å²	93.8	76%	0.764	47%	0.47	S	S	*	.			trans	-85.2	128.7	163.9	-59	170.9	0	0	0	106.3	A29	A29-I31 PolarHBondContact O-N 3.31Å
32	D	60.4	Low	65	Low	69 Å²	69	94 Å²	94	37%	0.369	47%	0.472	S	S	.	.			trans	-11.2	107.8	-178.3	-62.6	-20.5	0	0	0	115	L34 F45	D32-L34 PolarHBondContact O-N 3.39Å; D32-F45 WeakPolarHBondContact OD1-CD1 3.25Å; D32-F45 WeakPolarHBondContact OD1-CE1 3.49Å
33	P	60.6	Low	64.8	Low	42 Å²	42	101.5 Å²	101.5	27%	0.273	50%	0.499	S	S	.	.			trans	-61.8	115.2	175.5	15.9	-19.8	0	0	0	108.8	E35 L36 F45	P33-E35 PolarHBondContact O-N 3.35Å; P33-L36 HydrophobicContact CB-CD1 3.92Å; P33-L36 HydrophobicContact CG-CB 4.07Å; P33-L36 HydrophobicContact CG-CD1 3.81Å; P33-L36 HydrophobicContact CG-CD2 4.5Å; P33-L36 HydrophobicContact CG-CG 4.33Å; P33-L36 PolarHBondContact O-N 3.3Å; P33-F45 HydrophobicContact CG-CE2 4.25Å; P33-F45 HydrophobicContact CG-CZ 4.24Å
34	L	59.2	Low	64.6	Low	168 Å²	168	101.9 Å²	101.9	88%	0.88	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-51	-28.7	179.7	-86.3	124.7	0	0	0	112.6	D32 L36	D32-L34 PolarHBondContact O-N 3.39Å; L34-L36 VanDerWaalsContact C-N 3.31Å; L34-L36 PolarHBondContact O-N 3.03Å
35	E	60.1	Low	64.6	Low	173 Å²	173	100.4 Å²	100.4	81%	0.808	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-71.5	-19.9	177.7	-61.8	171.7	-179.1	0	0	114.1	P33	P33-E35 PolarHBondContact O-N 3.35Å
36	L	57.1	Low	64.5	Low	46 Å²	46	95.1 Å²	95.1	24%	0.241	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-101.7	-3.8	179.8	-84.8	86.2	0	0	0	113.2	P33 L34 E38 I39 L40 I201	P33-L36 HydrophobicContact CB-CD1 3.92Å; P33-L36 HydrophobicContact CG-CB 4.07Å; P33-L36 HydrophobicContact CG-CD1 3.81Å; P33-L36 HydrophobicContact CG-CD2 4.5Å; P33-L36 HydrophobicContact CG-CG 4.33Å; P33-L36 PolarHBondContact O-N 3.3Å; L34-L36 VanDerWaalsContact C-N 3.31Å; L34-L36 PolarHBondContact O-N 3.03Å; L36-E38 PolarHBondContact O-N 3.15Å; L36-I39 PolarHBondContact O-N 3.25Å; L36-L40 HydrophobicContact CD2-CD2 4.45Å; L36-L40 PolarHBondContact O-N 3.28Å; L36-I201 HydrophobicContact CD2-CD1 4.18Å
37	Y	56.8	Low	64.7	Low	174 Å²	174	92.4 Å²	92.4	68%	0.682	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.4	-179.5	-166.2	-92.4	0	0	0	112.4	I39	Y37-I39 VanDerWaalsContact C-N 3.34Å
38	E	57.6	Low	64.8	Low	147 Å²	147	90.3 Å²	90.3	69%	0.687	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-20.4	176.9	-72	-171.3	141.1	0	0	114	L36 Y208	L36-E38 PolarHBondContact O-N 3.15Å; E38-Y208 VanDerWaalsContact CD-OH 3.24Å; E38-Y208 PolarHBondContact OE2-OH 2.82Å
39	I	62.9	Low	65	Low	43 Å²	43	87.9 Å²	87.9	22%	0.221	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-23.5	-171.5	-60.3	167	0	0	0	111.3	L36 Y37	L36-I39 PolarHBondContact O-N 3.25Å; Y37-I39 VanDerWaalsContact C-N 3.34Å
40	L	62.1	Low	65.4	Low	13 Å²	13	88.4 Å²	88.4	7%	0.068	44%	0.437	C	S	.	.	S	Bend	trans	-137.6	116.3	-170.4	-163.4	65.2	0	0	0	110.4	L36 A42 E44 F45	L36-L40 HydrophobicContact CD2-CD2 4.45Å; L36-L40 PolarHBondContact O-N 3.28Å; L40-A42 PolarHBondContact O-N 3.43Å; L40-E44 HydrophobicContact CD1-CB 3.77Å; L40-E44 HydrophobicContact CG-CB 4.27Å; L40-F45 HydrophobicContact CD2-CB 3.53Å; L40-F45 HydrophobicContact CD2-CD2 3.48Å; L40-F45 VanDerWaalsContact CD2-CD2 3.48Å; L40-F45 HydrophobicContact CD2-CG 3.96Å; L40-F45 HydrophobicContact CG-CB 3.95Å
41	N	69.3	Low	66	Low	111 Å²	111	87.8 Å²	87.8	59%	0.594	43%	0.431	S	S	*	.			trans	-57.5	135.5	171.2	-80.8	-41.2	0	0	0	109.1	K43 E44 F45	N41-K43 PolarHBondContact O-N 3.07Å; N41-E44 HydrophobicContact CB-CB 4.48Å; N41-E44 HydrophobicContact CB-CG 4.23Å; N41-E44 WeakPolarHBondContact O-CA 3.24Å; N41-E44 WeakPolarHBondContact O-CB 3.46Å; N41-E44 PolarHBondContact O-N 2.98Å; N41-F45 PolarHBondContact O-N 2.97Å
42	A	70	Confident	66.6	Low	43 Å²	43	84.6 Å²	84.6	36%	0.355	41%	0.412	S	S	.	.	H	α-helix	trans	-50.9	-32.1	-179.8	0	0	0	0	0	113.2	L40 T46	L40-A42 PolarHBondContact O-N 3.43Å; A42-T46 WeakPolarHBondContact O-CB 3.48Å; A42-T46 PolarHBondContact O-N 3.23Å; A42-T46 PolarHBondContact O-OG1 3.32Å
43	K	71.7	Confident	67.3	Low	179 Å²	179	82.7 Å²	82.7	78%	0.778	40%	0.401	S	S	*	.	H	α-helix	trans	-65.1	-41.9	173.8	-170.8	179.1	-179.2	-178	0	113.1	N41 K47	N41-K43 PolarHBondContact O-N 3.07Å; K43-K47 PolarHBondContact O-N 3.35Å
44	E	69.2	Low	68	Low	91 Å²	91	82.2 Å²	82.2	43%	0.425	40%	0.396	S	S	.	.	H	α-helix	trans	-73	-38.6	178.5	-68	179.6	171.8	0	0	111.5	L40 N41 K47 A48	L40-E44 HydrophobicContact CD1-CB 3.77Å; L40-E44 HydrophobicContact CG-CB 4.27Å; N41-E44 HydrophobicContact CB-CB 4.48Å; N41-E44 HydrophobicContact CB-CG 4.23Å; N41-E44 WeakPolarHBondContact O-CA 3.24Å; N41-E44 WeakPolarHBondContact O-CB 3.46Å; N41-E44 PolarHBondContact O-N 2.98Å; E44-K47 PolarHBondContact O-N 2.93Å; E44-A48 WeakPolarHBondContact O-CB 3.3Å; E44-A48 PolarHBondContact O-N 3.33Å
45	F	70.8	Confident	68.7	Low	31 Å²	31	78.5 Å²	78.5	14%	0.136	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-47.1	172.6	-176	-108.3	0	0	0	111.4	T30 D32 P33 L40 N41 K47 A48 R49	T30-F45 HydrophobicContact CG2-CZ 3.92Å; D32-F45 WeakPolarHBondContact OD1-CD1 3.25Å; D32-F45 WeakPolarHBondContact OD1-CE1 3.49Å; P33-F45 HydrophobicContact CG-CE2 4.25Å; P33-F45 HydrophobicContact CG-CZ 4.24Å; L40-F45 HydrophobicContact CD2-CB 3.53Å; L40-F45 HydrophobicContact CD2-CD2 3.48Å; L40-F45 VanDerWaalsContact CD2-CD2 3.48Å; L40-F45 HydrophobicContact CD2-CG 3.96Å; L40-F45 HydrophobicContact CG-CB 3.95Å; N41-F45 PolarHBondContact O-N 2.97Å; F45-K47 VanDerWaalsContact C-N 3.31Å; F45-K47 PolarHBondContact O-N 2.95Å; F45-A48 PolarHBondContact O-N 3.19Å; F45-R49 VanDerWaalsContact O-CB 3.31Å; F45-R49 WeakPolarHBondContact O-CB 3.23Å; F45-R49 PolarHBondContact O-N 3.21Å
46	T	71.5	Confident	69.2	Low	53 Å²	53	71.2 Å²	71.2	33%	0.325	34%	0.343	S	S	.	.	H	α-helix	trans	-60.4	-41.9	176.6	-59.7	0	0	0	0	111.4	A42 R49 L50	A42-T46 WeakPolarHBondContact O-CB 3.48Å; A42-T46 PolarHBondContact O-N 3.23Å; A42-T46 PolarHBondContact O-OG1 3.32Å; T46-R49 PolarHBondContact O-N 3.5Å; T46-L50 HydrophobicContact CG2-CD1 4.2Å; T46-L50 WeakPolarHBondContact O-CB 3.42Å; T46-L50 WeakPolarHBondContact O-CG 3.3Å; T46-L50 PolarHBondContact O-N 2.83Å
47	K	74.9	Confident	70.1	Confident	101 Å²	101	73.7 Å²	73.7	44%	0.439	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-46.2	175.7	-171.5	-179.4	179.1	-173	0	111.8	K43 E44 F45 R49 L50 H51 H137	K43-K47 PolarHBondContact O-N 3.35Å; E44-K47 PolarHBondContact O-N 2.93Å; F45-K47 VanDerWaalsContact C-N 3.31Å; F45-K47 PolarHBondContact O-N 2.95Å; K47-R49 VanDerWaalsContact C-N 3.35Å; K47-R49 PolarHBondContact O-N 3.31Å; K47-L50 PolarHBondContact O-N 2.87Å; K47-H51 WeakPolarHBondContact O-CB 3.2Å; K47-H51 PolarHBondContact O-N 2.98Å; K47-H137 WeakPolarHBondContact CE-O 3.22Å; K47-H137 PolarHBondContact NZ-O 3.46Å
48	A	70.4	Confident	70.9	Confident	11 Å²	11	67.4 Å²	67.4	9%	0.091	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-38.9	178.7	0	0	0	0	0	112	E44 F45 H51 K52 Y197	E44-A48 WeakPolarHBondContact O-CB 3.3Å; E44-A48 PolarHBondContact O-N 3.33Å; F45-A48 PolarHBondContact O-N 3.19Å; A48-H51 PolarHBondContact O-N 2.79Å; A48-K52 WeakPolarHBondContact O-CG 3.39Å; A48-K52 PolarHBondContact O-N 2.94Å; A48-Y197 HydrophobicContact CB-CD1 4.12Å; A48-Y197 HydrophobicContact CB-CD2 3.98Å; A48-Y197 HydrophobicContact CB-CE1 4.24Å; A48-Y197 HydrophobicContact CB-CE2 4.11Å; A48-Y197 HydrophobicContact CB-CG 3.99Å
49	R	72.6	Confident	71.6	Confident	74 Å²	74	61.4 Å²	61.4	28%	0.279	30%	0.303	S	S	.	.	H	α-helix	trans	-63.4	-47.1	175.6	-171.7	177.9	72.2	160.5	2.5	111.5	Q27 T30 F45 T46 K47 H51 K52 L53	Q27-R49 WeakPolarHBondContact O-CD 3.43Å; T30-R49 PolarHBondContact O-NH1 2.92Å; T30-R49 VanDerWaalsContact O-NH1 3.08Å; F45-R49 VanDerWaalsContact O-CB 3.31Å; F45-R49 WeakPolarHBondContact O-CB 3.23Å; F45-R49 PolarHBondContact O-N 3.21Å; T46-R49 PolarHBondContact O-N 3.5Å; K47-R49 VanDerWaalsContact C-N 3.35Å; K47-R49 PolarHBondContact O-N 3.31Å; R49-H51 VanDerWaalsContact C-N 3.33Å; R49-H51 PolarHBondContact O-N 3.36Å; R49-K52 PolarHBondContact O-N 3.44Å; R49-L53 WeakPolarHBondContact O-CB 3.35Å; R49-L53 PolarHBondContact O-N 2.66Å
50	L	75.1	Confident	72	Confident	87 Å²	87	62.7 Å²	62.7	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-61.4	-41.2	175.6	-73.5	171.8	0	0	0	111.7	T46 K47 L53 D54	T46-L50 HydrophobicContact CG2-CD1 4.2Å; T46-L50 WeakPolarHBondContact O-CB 3.42Å; T46-L50 WeakPolarHBondContact O-CG 3.3Å; T46-L50 PolarHBondContact O-N 2.83Å; K47-L50 PolarHBondContact O-N 2.87Å; L50-L53 WeakPolarHBondContact O-CB 3.48Å; L50-L53 PolarHBondContact O-N 2.93Å; L50-D54 PolarHBondContact O-N 2.89Å
51	H	74.2	Confident	72.6	Confident	38 Å²	38	65.9 Å²	65.9	18%	0.176	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-48.1	174.4	179.2	-113.4	0	0	0	112.7	K47 A48 R49 L53 D54 F55 H137 F139	K47-H51 WeakPolarHBondContact O-CB 3.2Å; K47-H51 PolarHBondContact O-N 2.98Å; A48-H51 PolarHBondContact O-N 2.79Å; R49-H51 VanDerWaalsContact C-N 3.33Å; R49-H51 PolarHBondContact O-N 3.36Å; H51-L53 VanDerWaalsContact C-N 3.28Å; H51-L53 PolarHBondContact O-N 3.06Å; H51-D54 PolarHBondContact O-N 3.41Å; H51-F55 VanDerWaalsContact O-CB 3.31Å; H51-F55 WeakPolarHBondContact O-CB 3.48Å; H51-F55 PolarHBondContact O-N 3.33Å; H51-H137 VanDerWaalsContact CA-NE2 3.32Å; H51-H137 WeakPolarHBondContact CA-NE2 3.31Å; H51-H137 AromaticContact CD2-CD2 3.6Å; H51-H137 AromaticContact CD2-CE1 3.89Å; H51-H137 AromaticContact CD2-CG 3.35Å; H51-H137 AromaticContact CD2-ND1 3.55Å; H51-H137 AromaticContact CD2-NE2 3.94Å; H51-H137 AromaticContact CG-CD2 3.95Å; H51-F139 AromaticContact CD2-CE2 3.92Å; H51-F139 AromaticContact CE1-CE2 3.77Å; H51-F139 AromaticContact NE2-CE2 3.5Å
52	K	71.8	Confident	72.8	Confident	83 Å²	83	62.8 Å²	62.8	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-36.3	177.1	-73.8	-169	173.8	-164.4	0	112.1	A48 R49 A56 E195	A48-K52 WeakPolarHBondContact O-CG 3.39Å; A48-K52 PolarHBondContact O-N 2.94Å; R49-K52 PolarHBondContact O-N 3.44Å; K52-A56 WeakPolarHBondContact O-CB 3.19Å; K52-A56 PolarHBondContact O-N 2.98Å; K52-E195 VanDerWaalsContact CE-OE1 3.31Å; K52-E195 WeakPolarHBondContact CE-OE1 3.43Å; K52-E195 IonicContact NZ-OE1 3.57Å; K52-E195 PolarHBondContact NZ-OE1 3.03Å; K52-E195 IonicContact NZ-OE2 2.81Å; K52-E195 PolarHBondContact NZ-OE2 3.4Å
53	L	74.6	Confident	72.9	Confident	29 Å²	29	64.1 Å²	64.1	15%	0.152	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-47.3	177.7	-159.9	74.5	0	0	0	111.9	Y24 R49 L50 H51 F55 A56 K57	Y24-L53 HydrophobicContact CD2-CD1 3.46Å; Y24-L53 VanDerWaalsContact CD2-CD1 3.46Å; Y24-L53 HydrophobicContact CD2-CG 4.31Å; Y24-L53 HydrophobicContact CE1-CD1 4.31Å; Y24-L53 HydrophobicContact CE2-CD1 3.16Å; Y24-L53 HydrophobicContact CE2-CD2 4.29Å; Y24-L53 HydrophobicContact CE2-CG 3.65Å; Y24-L53 HydrophobicContact CG-CD1 4.16Å; R49-L53 WeakPolarHBondContact O-CB 3.35Å; R49-L53 PolarHBondContact O-N 2.66Å; L50-L53 WeakPolarHBondContact O-CB 3.48Å; L50-L53 PolarHBondContact O-N 2.93Å; H51-L53 VanDerWaalsContact C-N 3.28Å; H51-L53 PolarHBondContact O-N 3.06Å; L53-F55 VanDerWaalsContact C-N 3.35Å; L53-A56 PolarHBondContact O-N 3.5Å; L53-K57 WeakPolarHBondContact O-CG 3.35Å; L53-K57 PolarHBondContact O-N 3.45Å
54	D	76.3	Confident	73	Confident	32 Å²	32	58.3 Å²	58.3	17%	0.171	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-40.1	177.5	-85.4	-0.1	0	0	0	111.2	L50 H51 K57 F58 R136 H137	L50-D54 PolarHBondContact O-N 2.89Å; H51-D54 PolarHBondContact O-N 3.41Å; D54-K57 PolarHBondContact O-N 3Å; D54-F58 WeakPolarHBondContact O-CB 3.5Å; D54-F58 PolarHBondContact O-N 2.82Å; D54-R136 IonicContact OD1-NH1 2.95Å; D54-R136 IonicContact OD2-CZ 2.7Å; D54-R136 IonicContact OD2-NH1 3.28Å; D54-R136 PolarHBondContact OD2-NH1 3.02Å; D54-H137 IonicContact OD2-CE1 3.92Å; D54-H137 PolarHBondContact OD2-CE1 2.8Å; D54-H137 IonicContact OD2-NE2 2.79Å
55	F	73.1	Confident	73.3	Confident	89 Å²	89	55.7 Å²	55.7	39%	0.39	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-44.6	174.7	-173.6	-90.4	0	0	0	112	H51 L53 F58 A59 K129	H51-F55 VanDerWaalsContact O-CB 3.31Å; H51-F55 WeakPolarHBondContact O-CB 3.48Å; H51-F55 PolarHBondContact O-N 3.33Å; L53-F55 VanDerWaalsContact C-N 3.35Å; F55-F58 PolarHBondContact O-N 3.27Å; F55-A59 VanDerWaalsContact O-CB 3.25Å; F55-A59 WeakPolarHBondContact O-CB 3.34Å; F55-A59 PolarHBondContact O-N 2.88Å; F55-K129 VanDerWaalsContact CE2-CE 3.41Å
56	A	72	Confident	73.3	Confident	21 Å²	21	56.9 Å²	56.9	17%	0.174	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-41.9	178.3	0	0	0	0	0	112.2	K52 L53 A59 F60	K52-A56 WeakPolarHBondContact O-CB 3.19Å; K52-A56 PolarHBondContact O-N 2.98Å; L53-A56 PolarHBondContact O-N 3.5Å; A56-A59 PolarHBondContact O-N 3.39Å; A56-F60 WeakPolarHBondContact O-CB 3.42Å; A56-F60 PolarHBondContact O-N 3.21Å
57	K	74.6	Confident	73.5	Confident	97 Å²	97	58.4 Å²	58.4	42%	0.422	29%	0.294	S	S	.	.	H	α-helix	trans	-61.8	-46.3	175.2	-73	178	-175.5	-178.9	0	111.5	Y24 L53 D54 F60 C61	Y24-K57 HydrophobicContact CE2-CD 4.49Å; Y24-K57 VanDerWaalsContact CE2-CE 3.5Å; Y24-K57 HydrophobicContact CE2-CG 4.16Å; Y24-K57 VanDerWaalsContact OH-CE 3.28Å; Y24-K57 WeakPolarHBondContact OH-CE 3.49Å; Y24-K57 PolarHBondContact OH-NZ 3.43Å; L53-K57 WeakPolarHBondContact O-CG 3.35Å; L53-K57 PolarHBondContact O-N 3.45Å; D54-K57 PolarHBondContact O-N 3Å; K57-F60 PolarHBondContact O-N 3.36Å; K57-C61 PolarHBondContact O-N 3.01Å; K57-C61 VanDerWaalsContact O-N 3.1Å; K57-C61 PolarHBondContact O-SG 3.28Å; K57-C61 VanDerWaalsContact O-SG 3.41Å
58	F	74.6	Confident	73.6	Confident	42 Å²	42	59 Å²	59	18%	0.184	30%	0.3	C	S	.	.	H	α-helix	trans	-65.9	-44.9	178.5	-176.1	-82.3	0	0	0	111.6	D54 F55 F60 C61 Y62 V128 K129 I133	D54-F58 WeakPolarHBondContact O-CB 3.5Å; D54-F58 PolarHBondContact O-N 2.82Å; F55-F58 PolarHBondContact O-N 3.27Å; F58-F60 VanDerWaalsContact C-N 3.26Å; F58-F60 PolarHBondContact O-N 2.81Å; F58-C61 PolarHBondContact O-N 3.45Å; F58-C61 VanDerWaalsContact O-N 3.16Å; F58-Y62 AromaticContact CE1-CD2 3.99Å; F58-Y62 HydrophobicContact CE1-CD2 3.99Å; F58-Y62 HydrophobicContact CE1-CG 4.15Å; F58-Y62 HydrophobicContact CZ-CD2 4.45Å; F58-Y62 VanDerWaalsContact O-CB 3.24Å; F58-Y62 WeakPolarHBondContact O-CB 3.31Å; F58-Y62 PolarHBondContact O-N 2.9Å; F58-V128 HydrophobicContact CE2-CG1 4.08Å; F58-V128 HydrophobicContact CZ-CG1 4.29Å; F58-K129 HydrophobicContact CD1-CB 4.04Å; F58-K129 HydrophobicContact CD1-CD 4.2Å; F58-K129 HydrophobicContact CD1-CG 3.67Å; F58-K129 VanDerWaalsContact CE1-CA 3.46Å; F58-K129 HydrophobicContact CE1-CB 3.22Å; F58-K129 HydrophobicContact CE1-CD 3.92Å; F58-K129 HydrophobicContact CE1-CG 3.37Å; F58-K129 HydrophobicContact CZ-CB 3.55Å; F58-K129 HydrophobicContact CZ-CG 4.14Å; F58-I133 HydrophobicContact CB-CD1 3.37Å; F58-I133 HydrophobicContact CB-CG1 4.15Å; F58-I133 HydrophobicContact CD1-CD1 3.5Å; F58-I133 VanDerWaalsContact CD1-CD1 3.5Å; F58-I133 HydrophobicContact CD2-CD1 3.73Å; F58-I133 HydrophobicContact CD2-CG1 3.99Å; F58-I133 HydrophobicContact CE1-CD1 4.25Å; F58-I133 HydrophobicContact CE2-CD1 4.41Å; F58-I133 HydrophobicContact CG-CD1 3.22Å; F58-I133 HydrophobicContact CG-CG1 3.98Å
59	A	70.8	Confident	73.8	Confident	21 Å²	21	64.9 Å²	64.9	17%	0.174	32%	0.32	C	S	.	.	H	α-helix	trans	-56	-44.4	178.1	0	0	0	0	0	110.7	F55 A56 Y62 D63	F55-A59 VanDerWaalsContact O-CB 3.25Å; F55-A59 WeakPolarHBondContact O-CB 3.34Å; F55-A59 PolarHBondContact O-N 2.88Å; A56-A59 PolarHBondContact O-N 3.39Å; A59-Y62 PolarHBondContact O-N 3.13Å; A59-D63 WeakPolarHBondContact O-CB 3.27Å; A59-D63 PolarHBondContact O-N 3.44Å
60	F	72.7	Confident	73.8	Confident	71 Å²	71	63.6 Å²	63.6	31%	0.311	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-47.4	175.6	-177.8	-102	0	0	0	113.2	V17 A56 K57 F58 Y62 D63 I64	V17-F60 HydrophobicContact CG1-CE2 4.27Å; V17-F60 HydrophobicContact CG2-CE2 3.83Å; A56-F60 WeakPolarHBondContact O-CB 3.42Å; A56-F60 PolarHBondContact O-N 3.21Å; K57-F60 PolarHBondContact O-N 3.36Å; F58-F60 VanDerWaalsContact C-N 3.26Å; F58-F60 PolarHBondContact O-N 2.81Å; F60-Y62 VanDerWaalsContact C-N 3.32Å; F60-Y62 PolarHBondContact O-N 3.24Å; F60-D63 PolarHBondContact O-N 3.37Å; F60-I64 HydrophobicContact CD1-CD1 3.91Å; F60-I64 HydrophobicContact CE1-CD1 3.37Å; F60-I64 HydrophobicContact CE2-CD1 4.24Å; F60-I64 HydrophobicContact CZ-CD1 3.57Å; F60-I64 WeakPolarHBondContact O-CG1 3.27Å; F60-I64 PolarHBondContact O-N 2.89Å; F60-I64 VanDerWaalsContact O-N 3.15Å
61	C	74.9	Confident	73.8	Confident	80 Å²	80	62.2 Å²	62.2	54%	0.541	32%	0.322	S	S	.	.	H	α-helix	trans	-64.4	-38.4	177	-69.4	0	0	0	0	112.4	K57 F58 I64 A65	K57-C61 PolarHBondContact O-N 3.01Å; K57-C61 VanDerWaalsContact O-N 3.1Å; K57-C61 PolarHBondContact O-SG 3.28Å; K57-C61 VanDerWaalsContact O-SG 3.41Å; F58-C61 PolarHBondContact O-N 3.45Å; F58-C61 VanDerWaalsContact O-N 3.16Å; C61-I64 PolarHBondContact O-N 2.9Å; C61-A65 WeakPolarHBondContact O-CB 3.37Å; C61-A65 PolarHBondContact O-N 2.86Å
62	Y	73.4	Confident	73.9	Confident	46 Å²	46	62.5 Å²	62.5	18%	0.18	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-48.5	176.4	174.9	-89	0	0	0	110.6	F58 A59 F60 I64 A65 D66 L125	F58-Y62 AromaticContact CE1-CD2 3.99Å; F58-Y62 HydrophobicContact CE1-CD2 3.99Å; F58-Y62 HydrophobicContact CE1-CG 4.15Å; F58-Y62 HydrophobicContact CZ-CD2 4.45Å; F58-Y62 VanDerWaalsContact O-CB 3.24Å; F58-Y62 WeakPolarHBondContact O-CB 3.31Å; F58-Y62 PolarHBondContact O-N 2.9Å; A59-Y62 PolarHBondContact O-N 3.13Å; F60-Y62 VanDerWaalsContact C-N 3.32Å; F60-Y62 PolarHBondContact O-N 3.24Å; Y62-I64 VanDerWaalsContact C-N 3.26Å; Y62-I64 PolarHBondContact O-N 3.22Å; Y62-A65 PolarHBondContact O-N 3.22Å; Y62-A65 VanDerWaalsContact O-N 3.11Å; Y62-D66 HydrophobicContact CE1-CB 4.33Å; Y62-D66 VanDerWaalsContact O-CB 3.26Å; Y62-D66 WeakPolarHBondContact O-CB 3.47Å; Y62-D66 PolarHBondContact O-N 2.88Å; Y62-L125 HydrophobicContact CD2-CB 3.77Å; Y62-L125 HydrophobicContact CE2-CB 3.47Å; Y62-L125 VanDerWaalsContact CE2-CB 3.47Å
63	D	70.5	Confident	73.9	Confident	71 Å²	71	59.6 Å²	59.6	38%	0.38	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-36.9	-179.7	-67.3	-15.5	0	0	0	111.4	A59 F60 Q67	A59-D63 WeakPolarHBondContact O-CB 3.27Å; A59-D63 PolarHBondContact O-N 3.44Å; F60-D63 PolarHBondContact O-N 3.37Å; D63-Q67 WeakPolarHBondContact O-CB 3.25Å; D63-Q67 WeakPolarHBondContact O-CG 3.28Å; D63-Q67 PolarHBondContact O-N 3.45Å; D63-Q67 PolarHBondContact O-NE2 2.87Å
64	I	75	Confident	74	Confident	56 Å²	56	62 Å²	62	29%	0.287	33%	0.334	S	S	.	.	H	α-helix	trans	-66.6	-49.5	173.1	-69.9	169.5	0	0	0	111	Y13 F60 C61 Y62 D66 Q67 I68	Y13-I64 WeakPolarHBondContact OH-CD1 3.41Å; Y13-I64 WeakPolarHBondContact OH-CG1 3.47Å; F60-I64 HydrophobicContact CD1-CD1 3.91Å; F60-I64 HydrophobicContact CE1-CD1 3.37Å; F60-I64 HydrophobicContact CE2-CD1 4.24Å; F60-I64 HydrophobicContact CZ-CD1 3.57Å; F60-I64 WeakPolarHBondContact O-CG1 3.27Å; F60-I64 PolarHBondContact O-N 2.89Å; F60-I64 VanDerWaalsContact O-N 3.15Å; C61-I64 PolarHBondContact O-N 2.9Å; Y62-I64 VanDerWaalsContact C-N 3.26Å; Y62-I64 PolarHBondContact O-N 3.22Å; I64-D66 VanDerWaalsContact C-N 3.3Å; I64-D66 PolarHBondContact O-N 3.33Å; I64-Q67 PolarHBondContact O-N 3.33Å; I64-I68 HydrophobicContact CG2-CD1 3.74Å; I64-I68 HydrophobicContact CG2-CG1 4.45Å; I64-I68 VanDerWaalsContact O-CG1 3.31Å; I64-I68 WeakPolarHBondContact O-CG1 3.32Å; I64-I68 PolarHBondContact O-N 3.46Å
65	A	75.1	Confident	74	Confident	37 Å²	37	65.4 Å²	65.4	31%	0.306	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-40.9	-178.4	0	0	0	0	0	111.5	C61 Y62 I68 W69 L125	C61-A65 WeakPolarHBondContact O-CB 3.37Å; C61-A65 PolarHBondContact O-N 2.86Å; Y62-A65 PolarHBondContact O-N 3.22Å; Y62-A65 VanDerWaalsContact O-N 3.11Å; A65-I68 PolarHBondContact O-N 3.37Å; A65-W69 VanDerWaalsContact O-CB 3.25Å; A65-W69 WeakPolarHBondContact O-CB 3.29Å; A65-W69 PolarHBondContact O-N 3.3Å; A65-L125 HydrophobicContact CB-CD1 4.01Å
66	D	71.9	Confident	74.3	Confident	56 Å²	56	66.3 Å²	66.3	30%	0.299	36%	0.359	S	S	.	.	H	α-helix	trans	-65.9	-41.1	177.3	-174	66.5	0	0	0	111.7	Y62 I64 W69 T70	Y62-D66 HydrophobicContact CE1-CB 4.33Å; Y62-D66 VanDerWaalsContact O-CB 3.26Å; Y62-D66 WeakPolarHBondContact O-CB 3.47Å; Y62-D66 PolarHBondContact O-N 2.88Å; I64-D66 VanDerWaalsContact C-N 3.3Å; I64-D66 PolarHBondContact O-N 3.33Å; D66-W69 PolarHBondContact O-N 3.42Å; D66-T70 VanDerWaalsContact O-CB 3.23Å; D66-T70 WeakPolarHBondContact O-CB 3.39Å; D66-T70 PolarHBondContact O-N 2.86Å; D66-T70 PolarHBondContact O-OG1 2.87Å
67	Q	74.1	Confident	74.3	Confident	85 Å²	85	70.9 Å²	70.9	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-43.8	173.5	-77.9	175.7	52.8	0	0	112.5	Y13 D63 I64 W69 T70 A71	Y13-Q67 VanDerWaalsContact CD2-NE2 3.34Å; D63-Q67 WeakPolarHBondContact O-CB 3.25Å; D63-Q67 WeakPolarHBondContact O-CG 3.28Å; D63-Q67 PolarHBondContact O-N 3.45Å; D63-Q67 PolarHBondContact O-NE2 2.87Å; I64-Q67 PolarHBondContact O-N 3.33Å; Q67-W69 VanDerWaalsContact C-N 3.33Å; Q67-T70 PolarHBondContact O-N 3.3Å; Q67-A71 VanDerWaalsContact O-CB 3.26Å; Q67-A71 WeakPolarHBondContact O-CB 3.48Å; Q67-A71 PolarHBondContact O-N 3.29Å
68	I	77.7	Confident	74.4	Confident	113 Å²	113	71.1 Å²	71.1	58%	0.579	38%	0.378	S	S	*	.	H	α-helix	trans	-63	-44.5	176.5	-68.1	168	0	0	0	110	I64 A65 A71 A72	I64-I68 HydrophobicContact CG2-CD1 3.74Å; I64-I68 HydrophobicContact CG2-CG1 4.45Å; I64-I68 VanDerWaalsContact O-CG1 3.31Å; I64-I68 WeakPolarHBondContact O-CG1 3.32Å; I64-I68 PolarHBondContact O-N 3.46Å; A65-I68 PolarHBondContact O-N 3.37Å; I68-A71 PolarHBondContact O-N 3.35Å; I68-A72 WeakPolarHBondContact O-CB 3.49Å; I68-A72 PolarHBondContact O-N 2.87Å
69	W	75.7	Confident	74.6	Confident	134 Å²	134	73.1 Å²	73.1	51%	0.508	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-45.6	178.5	179.9	-100.6	0	0	0	111.9	A65 D66 Q67 A72 S73	A65-W69 VanDerWaalsContact O-CB 3.25Å; A65-W69 WeakPolarHBondContact O-CB 3.29Å; A65-W69 PolarHBondContact O-N 3.3Å; D66-W69 PolarHBondContact O-N 3.42Å; Q67-W69 VanDerWaalsContact C-N 3.33Å; W69-A72 PolarHBondContact O-N 3.08Å; W69-S73 WeakPolarHBondContact O-CB 3.38Å; W69-S73 PolarHBondContact O-N 3.42Å
70	T	71.7	Confident	74.8	Confident	47 Å²	47	74 Å²	74	29%	0.288	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-46.7	177.2	-62.2	0	0	0	0	110.6	D66 Q67 A72 S73 D74	D66-T70 VanDerWaalsContact O-CB 3.23Å; D66-T70 WeakPolarHBondContact O-CB 3.39Å; D66-T70 PolarHBondContact O-N 2.86Å; D66-T70 PolarHBondContact O-OG1 2.87Å; Q67-T70 PolarHBondContact O-N 3.3Å; T70-A72 VanDerWaalsContact C-N 3.34Å; T70-A72 PolarHBondContact O-N 3.3Å; T70-S73 WeakPolarHBondContact O-CB 3.38Å; T70-S73 PolarHBondContact O-N 3.03Å; T70-S73 VanDerWaalsContact O-N 3.16Å; T70-D74 WeakPolarHBondContact O-CB 3.39Å; T70-D74 VanDerWaalsContact O-CG 3.29Å; T70-D74 PolarHBondContact O-N 3.28Å
71	A	75.2	Confident	75.1	Confident	59 Å²	59	76.2 Å²	76.2	49%	0.488	41%	0.407	S	S	.	.	H	α-helix	trans	-61.4	-40.7	176.3	0	0	0	0	0	112.5	Q67 I68 D74 L75	Q67-A71 VanDerWaalsContact O-CB 3.26Å; Q67-A71 WeakPolarHBondContact O-CB 3.48Å; Q67-A71 PolarHBondContact O-N 3.29Å; I68-A71 PolarHBondContact O-N 3.35Å; A71-D74 PolarHBondContact O-N 3.12Å; A71-L75 WeakPolarHBondContact O-CB 3.37Å; A71-L75 PolarHBondContact O-N 2.84Å
72	A	75.6	Confident	75.2	Confident	43 Å²	43	78.8 Å²	78.8	36%	0.355	42%	0.415	S	S	.	.	H	α-helix	trans	-65.8	-41.4	174.7	0	0	0	0	0	111.8	I68 W69 T70 L75 I76	I68-A72 WeakPolarHBondContact O-CB 3.49Å; I68-A72 PolarHBondContact O-N 2.87Å; W69-A72 PolarHBondContact O-N 3.08Å; T70-A72 VanDerWaalsContact C-N 3.34Å; T70-A72 PolarHBondContact O-N 3.3Å; A72-L75 PolarHBondContact O-N 2.79Å; A72-I76 WeakPolarHBondContact O-CD1 3.45Å; A72-I76 VanDerWaalsContact O-CG1 3.25Å; A72-I76 WeakPolarHBondContact O-CG1 3.38Å; A72-I76 PolarHBondContact O-N 3.3Å
73	S	73.4	Confident	75.6	Confident	23 Å²	23	83.5 Å²	83.5	16%	0.161	44%	0.437	C	S	.	.	H	α-helix	trans	-62.8	-43.5	176.2	-168.1	0	0	0	0	111.6	W69 T70 I76 R77	W69-S73 WeakPolarHBondContact O-CB 3.38Å; W69-S73 PolarHBondContact O-N 3.42Å; T70-S73 WeakPolarHBondContact O-CB 3.38Å; T70-S73 PolarHBondContact O-N 3.03Å; T70-S73 VanDerWaalsContact O-N 3.16Å; S73-I76 PolarHBondContact O-N 3.08Å; S73-R77 WeakPolarHBondContact O-CG 3.3Å; S73-R77 PolarHBondContact O-N 3.41Å; S73-R77 PolarHBondContact OG-NH1 3.23Å; S73-R77 PolarHBondContact OG-NH2 3.41Å
74	D	75.1	Confident	76	Confident	78 Å²	78	85.2 Å²	85.2	42%	0.417	45%	0.446	S	S	.	.	H	α-helix	trans	-67.5	-36.8	177.4	-69.3	-19.2	0	0	0	112	T70 A71 R77 L78	T70-D74 WeakPolarHBondContact O-CB 3.39Å; T70-D74 VanDerWaalsContact O-CG 3.29Å; T70-D74 PolarHBondContact O-N 3.28Å; A71-D74 PolarHBondContact O-N 3.12Å; D74-R77 PolarHBondContact O-N 2.84Å; D74-R77 IonicContact OD1-CZ 3.35Å; D74-R77 IonicContact OD1-NH1 3.65Å; D74-R77 PolarHBondContact OD1-NH1 3.32Å; D74-L78 WeakPolarHBondContact O-CB 3.32Å; D74-L78 PolarHBondContact O-N 2.76Å
75	L	78	Confident	76.1	Confident	104 Å²	104	86 Å²	86	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-62.2	-46	171.3	-175.2	66.1	0	0	0	111.1	A71 A72 R77 L78 L79	A71-L75 WeakPolarHBondContact O-CB 3.37Å; A71-L75 PolarHBondContact O-N 2.84Å; A72-L75 PolarHBondContact O-N 2.79Å; L75-R77 VanDerWaalsContact C-N 3.34Å; L75-R77 PolarHBondContact O-N 3.36Å; L75-L78 WeakPolarHBondContact O-CB 3.45Å; L75-L78 PolarHBondContact O-N 3.33Å; L75-L79 HydrophobicContact CD1-CD1 3.87Å; L75-L79 HydrophobicContact CG-CD1 3.9Å; L75-L79 WeakPolarHBondContact O-CD1 3.47Å; L75-L79 PolarHBondContact O-N 3.09Å
76	I	78.1	Confident	76	Confident	108 Å²	108	87.9 Å²	87.9	55%	0.554	46%	0.455	S	S	*	.	H	α-helix	trans	-60.6	-44.4	176.3	-67.6	160.6	0	0	0	110.6	A72 S73 L78 L79 V80	A72-I76 WeakPolarHBondContact O-CD1 3.45Å; A72-I76 VanDerWaalsContact O-CG1 3.25Å; A72-I76 WeakPolarHBondContact O-CG1 3.38Å; A72-I76 PolarHBondContact O-N 3.3Å; S73-I76 PolarHBondContact O-N 3.08Å; I76-L78 VanDerWaalsContact C-N 3.32Å; I76-L78 PolarHBondContact O-N 2.95Å; I76-L79 PolarHBondContact O-N 2.92Å; I76-V80 HydrophobicContact CG2-CG2 4.39Å; I76-V80 VanDerWaalsContact O-CG2 3.29Å; I76-V80 WeakPolarHBondContact O-CG2 3.37Å; I76-V80 PolarHBondContact O-N 3.25Å
77	R	71.4	Confident	76.2	Confident	117 Å²	117	88.2 Å²	88.2	44%	0.442	46%	0.46	S	S	.	.	H	α-helix	trans	-59.7	-43	175.5	-73.1	173.1	-178	126.9	5.4	111.8	S73 D74 L75 V80 L81 Y122	S73-R77 WeakPolarHBondContact O-CG 3.3Å; S73-R77 PolarHBondContact O-N 3.41Å; S73-R77 PolarHBondContact OG-NH1 3.23Å; S73-R77 PolarHBondContact OG-NH2 3.41Å; D74-R77 PolarHBondContact O-N 2.84Å; D74-R77 IonicContact OD1-CZ 3.35Å; D74-R77 IonicContact OD1-NH1 3.65Å; D74-R77 PolarHBondContact OD1-NH1 3.32Å; L75-R77 VanDerWaalsContact C-N 3.34Å; L75-R77 PolarHBondContact O-N 3.36Å; R77-V80 PolarHBondContact O-N 3.19Å; R77-L81 PolarHBondContact O-N 2.93Å; R77-Y122 PolarHBondContact NH2-OH 3.49Å
78	L	77.8	Confident	76.3	Confident	103 Å²	103	86.5 Å²	86.5	54%	0.539	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-42.6	176.3	-175.7	67.1	0	0	0	111.3	D74 L75 I76 L81 L82	D74-L78 WeakPolarHBondContact O-CB 3.32Å; D74-L78 PolarHBondContact O-N 2.76Å; L75-L78 WeakPolarHBondContact O-CB 3.45Å; L75-L78 PolarHBondContact O-N 3.33Å; I76-L78 VanDerWaalsContact C-N 3.32Å; I76-L78 PolarHBondContact O-N 2.95Å; L78-L81 PolarHBondContact O-N 3.35Å; L78-L82 VanDerWaalsContact O-CB 3.25Å; L78-L82 WeakPolarHBondContact O-CB 3.39Å; L78-L82 PolarHBondContact O-N 3.09Å
79	L	77.7	Confident	76.2	Confident	83 Å²	83	84.8 Å²	84.8	44%	0.435	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-44.9	174.5	-92.1	76.6	0	0	0	111.5	L75 I76 L81 L82 F83	L75-L79 HydrophobicContact CD1-CD1 3.87Å; L75-L79 HydrophobicContact CG-CD1 3.9Å; L75-L79 WeakPolarHBondContact O-CD1 3.47Å; L75-L79 PolarHBondContact O-N 3.09Å; I76-L79 PolarHBondContact O-N 2.92Å; L79-L81 PolarHBondContact O-N 3.07Å; L79-L82 PolarHBondContact O-N 3.38Å; L79-F83 HydrophobicContact CB-CD2 4.4Å; L79-F83 HydrophobicContact CG-CE2 4.28Å; L79-F83 WeakPolarHBondContact O-CB 3.07Å; L79-F83 VanDerWaalsContact O-CD2 3.28Å; L79-F83 WeakPolarHBondContact O-CD2 3.47Å; L79-F83 PolarHBondContact O-N 3.47Å
80	V	76.8	Confident	76.3	Confident	39 Å²	39	83.9 Å²	83.9	24%	0.236	45%	0.448	C	S	.	.	H	α-helix	trans	-57.8	-40.6	177.5	166	0	0	0	0	111.2	I76 R77 L85 I86	I76-V80 HydrophobicContact CG2-CG2 4.39Å; I76-V80 VanDerWaalsContact O-CG2 3.29Å; I76-V80 WeakPolarHBondContact O-CG2 3.37Å; I76-V80 PolarHBondContact O-N 3.25Å; R77-V80 PolarHBondContact O-N 3.19Å; V80-L85 HydrophobicContact CB-CB 4.49Å; V80-L85 HydrophobicContact CG1-CB 4.27Å; V80-L85 HydrophobicContact CG2-CD2 4.13Å; V80-L85 PolarHBondContact O-N 3.18Å; V80-I86 HydrophobicContact CG1-CD1 4.12Å; V80-I86 HydrophobicContact CG1-CG1 3.67Å
81	L	77.2	Confident	76.7	Confident	118 Å²	118	88.7 Å²	88.7	62%	0.618	47%	0.465	S	S	*	.	H	α-helix	trans	-72.5	-43.7	176.7	-168.1	70.3	0	0	0	112.2	R77 L78 L79 F83 D84	R77-L81 PolarHBondContact O-N 2.93Å; L78-L81 PolarHBondContact O-N 3.35Å; L79-L81 PolarHBondContact O-N 3.07Å; L81-F83 VanDerWaalsContact C-N 3.34Å; L81-F83 PolarHBondContact O-N 2.86Å; L81-D84 PolarHBondContact O-N 3.36Å
82	L	79.1	Confident	77	Confident	134 Å²	134	90.5 Å²	90.5	70%	0.702	47%	0.466	S	S	*	.	H	α-helix	trans	-66.7	-34.4	-176.5	-174.3	67	0	0	0	112.7	L78 L79	L78-L82 VanDerWaalsContact O-CB 3.25Å; L78-L82 WeakPolarHBondContact O-CB 3.39Å; L78-L82 PolarHBondContact O-N 3.09Å; L79-L82 PolarHBondContact O-N 3.38Å
83	F	80.3	Confident	77	Confident	145 Å²	145	89.3 Å²	89.3	64%	0.636	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	6.9	179.3	-73.7	-72.8	0	0	0	113.8	L79 L81 L85	L79-F83 HydrophobicContact CB-CD2 4.4Å; L79-F83 HydrophobicContact CG-CE2 4.28Å; L79-F83 WeakPolarHBondContact O-CB 3.07Å; L79-F83 VanDerWaalsContact O-CD2 3.28Å; L79-F83 WeakPolarHBondContact O-CD2 3.47Å; L79-F83 PolarHBondContact O-N 3.47Å; L81-F83 VanDerWaalsContact C-N 3.34Å; L81-F83 PolarHBondContact O-N 2.86Å; F83-L85 PolarHBondContact O-N 2.79Å; F83-L85 VanDerWaalsContact O-N 3.07Å
84	D	79.5	Confident	77	Confident	108 Å²	108	88.8 Å²	88.8	58%	0.578	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	42	-170.2	-82.1	-34.8	0	0	0	111.3	L81 I86 P87 A88	L81-D84 PolarHBondContact O-N 3.36Å; D84-I86 PolarHBondContact O-N 3.16Å; D84-P87 HydrophobicContact CB-CG 4.22Å; D84-P87 WeakPolarHBondContact O-CD 3.45Å; D84-A88 PolarHBondContact O-N 3.4Å
85	L	76.3	Confident	77.4	Confident	73 Å²	73	89.6 Å²	89.6	38%	0.382	46%	0.456	S	S	.	.	H	α-helix	trans	-67.9	-21.8	-175	-155.1	74	0	0	0	110.4	V80 F83 A88 L89	V80-L85 HydrophobicContact CB-CB 4.49Å; V80-L85 HydrophobicContact CG1-CB 4.27Å; V80-L85 HydrophobicContact CG2-CD2 4.13Å; V80-L85 PolarHBondContact O-N 3.18Å; F83-L85 PolarHBondContact O-N 2.79Å; F83-L85 VanDerWaalsContact O-N 3.07Å; L85-A88 HydrophobicContact CD1-CB 4.49Å; L85-A88 PolarHBondContact O-N 3.25Å; L85-L89 HydrophobicContact CD2-CD1 4.26Å; L85-L89 HydrophobicContact CG-CD1 4.17Å; L85-L89 HydrophobicContact CG-CG 4.34Å; L85-L89 VanDerWaalsContact O-CB 3.25Å; L85-L89 WeakPolarHBondContact O-CB 3.25Å; L85-L89 WeakPolarHBondContact O-CD1 3.4Å; L85-L89 VanDerWaalsContact O-CG 3.24Å; L85-L89 WeakPolarHBondContact O-CG 3.33Å; L85-L89 PolarHBondContact O-N 2.82Å
86	I	73.1	Confident	77.5	Confident	76 Å²	76	88.6 Å²	88.6	39%	0.39	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-59	174.4	-65.6	169.7	0	0	0	110.8	V80 D84 A88 L89 W90 Y111	V80-I86 HydrophobicContact CG1-CD1 4.12Å; V80-I86 HydrophobicContact CG1-CG1 3.67Å; D84-I86 PolarHBondContact O-N 3.16Å; I86-A88 VanDerWaalsContact C-N 3.27Å; I86-A88 PolarHBondContact O-N 2.82Å; I86-L89 PolarHBondContact O-N 3.37Å; I86-W90 WeakPolarHBondContact O-CB 3.47Å; I86-W90 PolarHBondContact O-N 2.95Å; I86-Y111 WeakPolarHBondContact CG2-OH 3.43Å
87	P	76.3	Confident	77.3	Confident	63 Å²	63	83.6 Å²	83.6	41%	0.409	43%	0.425	S	S	.	.	H	α-helix	trans	-55.4	-37.7	170.8	-28.3	30.4	0	0	0	114.5	D84 W90 K91	D84-P87 HydrophobicContact CB-CG 4.22Å; D84-P87 WeakPolarHBondContact O-CD 3.45Å; P87-W90 PolarHBondContact O-N 3.5Å; P87-K91 WeakPolarHBondContact O-CG 3.43Å; P87-K91 PolarHBondContact O-N 2.94Å
88	A	77	Confident	77.7	Confident	49 Å²	49	83.4 Å²	83.4	41%	0.405	43%	0.432	S	S	.	.	H	α-helix	trans	-65.9	-45.3	179.7	0	0	0	0	0	111.9	D84 L85 I86 W90 K91 L92	D84-A88 PolarHBondContact O-N 3.4Å; L85-A88 HydrophobicContact CD1-CB 4.49Å; L85-A88 PolarHBondContact O-N 3.25Å; I86-A88 VanDerWaalsContact C-N 3.27Å; I86-A88 PolarHBondContact O-N 2.82Å; A88-W90 VanDerWaalsContact C-N 3.35Å; A88-K91 PolarHBondContact O-N 3.37Å; A88-L92 WeakPolarHBondContact O-CB 3.3Å; A88-L92 PolarHBondContact O-N 3.39Å
89	L	75.4	Confident	77.9	Confident	77 Å²	77	87 Å²	87	40%	0.403	44%	0.444	S	S	.	.	H	α-helix	trans	-63.7	-40.8	174.5	-77.5	163.9	0	0	0	111.1	L85 I86 K91 L92 V93	L85-L89 HydrophobicContact CD2-CD1 4.26Å; L85-L89 HydrophobicContact CG-CD1 4.17Å; L85-L89 HydrophobicContact CG-CG 4.34Å; L85-L89 VanDerWaalsContact O-CB 3.25Å; L85-L89 WeakPolarHBondContact O-CB 3.25Å; L85-L89 WeakPolarHBondContact O-CD1 3.4Å; L85-L89 VanDerWaalsContact O-CG 3.24Å; L85-L89 WeakPolarHBondContact O-CG 3.33Å; L85-L89 PolarHBondContact O-N 2.82Å; I86-L89 PolarHBondContact O-N 3.37Å; L89-K91 PolarHBondContact O-N 2.94Å; L89-L92 WeakPolarHBondContact O-CB 3.21Å; L89-L92 PolarHBondContact O-N 3.34Å; L89-V93 VanDerWaalsContact O-CG2 3.3Å; L89-V93 WeakPolarHBondContact O-CG2 3.49Å; L89-V93 PolarHBondContact O-N 3.41Å
90	W	77.1	Confident	78.1	Confident	114 Å²	114	88.6 Å²	88.6	43%	0.432	45%	0.451	S	S	.	.	H	α-helix	trans	-58.3	-46.9	175.2	-173.5	-88.4	0	0	0	111.8	I86 P87 A88 L92 V93 G94 Y111	I86-W90 WeakPolarHBondContact O-CB 3.47Å; I86-W90 PolarHBondContact O-N 2.95Å; P87-W90 PolarHBondContact O-N 3.5Å; A88-W90 VanDerWaalsContact C-N 3.35Å; W90-L92 PolarHBondContact O-N 2.83Å; W90-V93 PolarHBondContact O-N 2.94Å; W90-G94 PolarHBondContact O-N 3.39Å; W90-Y111 AromaticContact CE3-CD1 3.76Å; W90-Y111 HydrophobicContact CE3-CD1 3.76Å; W90-Y111 AromaticContact CE3-CD2 3.68Å; W90-Y111 HydrophobicContact CE3-CD2 3.68Å; W90-Y111 HydrophobicContact CE3-CE1 4.05Å; W90-Y111 AromaticContact CE3-CE2 3.99Å; W90-Y111 HydrophobicContact CE3-CE2 3.99Å; W90-Y111 AromaticContact CE3-CG 3.55Å; W90-Y111 HydrophobicContact CE3-CG 3.55Å; W90-Y111 AromaticContact CZ3-CD1 3.43Å; W90-Y111 HydrophobicContact CZ3-CD1 3.43Å; W90-Y111 VanDerWaalsContact CZ3-CD1 3.43Å; W90-Y111 HydrophobicContact CZ3-CD2 4.12Å; W90-Y111 HydrophobicContact CZ3-CE1 4.01Å; W90-Y111 AromaticContact CZ3-CG 3.48Å; W90-Y111 HydrophobicContact CZ3-CG 3.48Å; W90-Y111 VanDerWaalsContact CZ3-CG 3.48Å
91	K	80.4	Confident	78.1	Confident	148 Å²	148	89.9 Å²	89.9	64%	0.643	47%	0.473	S	S	*	.	H	α-helix	trans	-63.7	-40.7	175.6	-72.6	177.7	-179	178.3	0	112.2	P87 A88 L89 G94 I95	P87-K91 WeakPolarHBondContact O-CG 3.43Å; P87-K91 PolarHBondContact O-N 2.94Å; A88-K91 PolarHBondContact O-N 3.37Å; L89-K91 PolarHBondContact O-N 2.94Å; K91-G94 PolarHBondContact O-N 3.13Å; K91-I95 VanDerWaalsContact O-CG1 3.28Å; K91-I95 WeakPolarHBondContact O-CG1 3.33Å; K91-I95 PolarHBondContact O-N 2.9Å
92	L	80.6	Confident	77.7	Confident	97 Å²	97	87.4 Å²	87.4	51%	0.508	46%	0.459	S	S	.	.	H	α-helix	trans	-61.9	-46.9	177.4	-168.2	88.8	0	0	0	111.3	A88 L89 W90 G94 I95 I96	A88-L92 WeakPolarHBondContact O-CB 3.3Å; A88-L92 PolarHBondContact O-N 3.39Å; L89-L92 WeakPolarHBondContact O-CB 3.21Å; L89-L92 PolarHBondContact O-N 3.34Å; W90-L92 PolarHBondContact O-N 2.83Å; L92-G94 VanDerWaalsContact C-N 3.32Å; L92-G94 PolarHBondContact O-N 3Å; L92-I95 PolarHBondContact O-N 3.48Å; L92-I96 HydrophobicContact CD2-CD1 4.24Å; L92-I96 HydrophobicContact CG-CD1 4.1Å; L92-I96 VanDerWaalsContact O-CG1 3.3Å; L92-I96 WeakPolarHBondContact O-CG1 3.17Å; L92-I96 PolarHBondContact O-N 3.05Å
93	V	75.6	Confident	77.3	Confident	19 Å²	19	85.8 Å²	85.8	12%	0.115	46%	0.455	C	S	.	.	H	α-helix	trans	-60.6	-43.7	176	172.5	0	0	0	0	110.2	L89 W90 I95 I96 C97 I110	L89-V93 VanDerWaalsContact O-CG2 3.3Å; L89-V93 WeakPolarHBondContact O-CG2 3.49Å; L89-V93 PolarHBondContact O-N 3.41Å; W90-V93 PolarHBondContact O-N 2.94Å; V93-I95 PolarHBondContact O-N 2.83Å; V93-I96 PolarHBondContact O-N 2.71Å; V93-C97 WeakPolarHBondContact O-CB 3.17Å; V93-C97 PolarHBondContact O-N 3.26Å; V93-C97 PolarHBondContact O-SG 2.7Å; V93-I110 HydrophobicContact CG1-CG2 4.32Å
94	G	74.6	Confident	76.5	Confident	12 Å²	12	85.7 Å²	85.7	12%	0.124	46%	0.457	C	S	.	.	H	α-helix	trans	-58.1	-46.3	174.4	0	0	0	0	0	113	W90 K91 L92 I96 C97 L98	W90-G94 PolarHBondContact O-N 3.39Å; K91-G94 PolarHBondContact O-N 3.13Å; L92-G94 VanDerWaalsContact C-N 3.32Å; L92-G94 PolarHBondContact O-N 3Å; G94-I96 PolarHBondContact O-N 2.94Å; G94-C97 PolarHBondContact O-N 3.32Å; G94-L98 WeakPolarHBondContact O-CB 3.22Å; G94-L98 VanDerWaalsContact O-CG 3.27Å; G94-L98 WeakPolarHBondContact O-CG 3.38Å; G94-L98 PolarHBondContact O-N 3.33Å
95	I	82.1	Confident	75.9	Confident	95 Å²	95	88.3 Å²	88.3	49%	0.487	47%	0.465	S	S	.	.	H	α-helix	trans	-62.5	-42.1	177.5	-67.2	162.9	0	0	0	111.4	K91 L92 V93 K99	K91-I95 VanDerWaalsContact O-CG1 3.28Å; K91-I95 WeakPolarHBondContact O-CG1 3.33Å; K91-I95 PolarHBondContact O-N 2.9Å; L92-I95 PolarHBondContact O-N 3.48Å; V93-I95 PolarHBondContact O-N 2.83Å; I95-K99 WeakPolarHBondContact O-CG 3.37Å; I95-K99 PolarHBondContact O-N 3.34Å; I95-K99 VanDerWaalsContact O-N 3.11Å
96	I	80.3	Confident	75.4	Confident	83 Å²	83	85.7 Å²	85.7	43%	0.426	46%	0.455	S	S	.	.	H	α-helix	trans	-65.2	-45.4	178.1	-67.5	165.3	0	0	0	110.3	L92 V93 G94 K99 I100	L92-I96 HydrophobicContact CD2-CD1 4.24Å; L92-I96 HydrophobicContact CG-CD1 4.1Å; L92-I96 VanDerWaalsContact O-CG1 3.3Å; L92-I96 WeakPolarHBondContact O-CG1 3.17Å; L92-I96 PolarHBondContact O-N 3.05Å; V93-I96 PolarHBondContact O-N 2.71Å; G94-I96 PolarHBondContact O-N 2.94Å; I96-K99 WeakPolarHBondContact O-CB 3.34Å; I96-K99 PolarHBondContact O-N 2.9Å; I96-I100 HydrophobicContact CG2-CD1 3.81Å; I96-I100 WeakPolarHBondContact O-CG1 3.39Å; I96-I100 PolarHBondContact O-N 3.45Å; I96-I100 VanDerWaalsContact O-N 3.14Å
97	C	75.6	Confident	75	Confident	3 Å²	3	84.1 Å²	84.1	2%	0.02	44%	0.444	C	S	.	.	H	α-helix	trans	-68.1	-38.1	-179	-64.2	0	0	0	0	112.4	V93 G94 K99 I100 G101 L102 W107	V93-C97 WeakPolarHBondContact O-CB 3.17Å; V93-C97 PolarHBondContact O-N 3.26Å; V93-C97 PolarHBondContact O-SG 2.7Å; G94-C97 PolarHBondContact O-N 3.32Å; C97-K99 VanDerWaalsContact C-N 3.3Å; C97-K99 PolarHBondContact O-N 2.84Å; C97-I100 CarbonylContact O-C 3.58Å; C97-I100 PolarHBondContact O-N 3.42Å; C97-I100 VanDerWaalsContact O-N 3.12Å; C97-G101 PolarHBondContact O-N 2.91Å; C97-L102 HydrophobicContact CB-CB 4.18Å; C97-L102 PolarHBondContact O-N 3.46Å; C97-W107 HydrophobicContact CB-CD2 4.32Å; C97-W107 HydrophobicContact CB-CG 3.89Å
98	L	78.5	Confident	74.6	Confident	113 Å²	113	84.7 Å²	84.7	59%	0.592	45%	0.446	S	S	*	.	H	α-helix	trans	-60.3	-39.4	172.1	-76.7	170.7	0	0	0	111.9	G94 I100 G101 W107	G94-L98 WeakPolarHBondContact O-CB 3.22Å; G94-L98 VanDerWaalsContact O-CG 3.27Å; G94-L98 WeakPolarHBondContact O-CG 3.38Å; G94-L98 PolarHBondContact O-N 3.33Å; L98-I100 VanDerWaalsContact C-N 3.29Å; L98-I100 PolarHBondContact O-N 3.32Å; L98-G101 PolarHBondContact O-N 2.88Å; L98-W107 HydrophobicContact CD2-CH2 3.76Å; L98-W107 HydrophobicContact CD2-CZ2 3.63Å; L98-W107 HydrophobicContact CG-CH2 4.01Å; L98-W107 HydrophobicContact CG-CZ2 3.88Å
99	K	82.7	Confident	74.2	Confident	178 Å²	178	89 Å²	89	77%	0.774	46%	0.458	S	S	*	.	H	α-helix	trans	-66.3	-29.3	174.9	-77.6	-175.7	177.2	-172	0	113.4	I95 I96 C97	I95-K99 WeakPolarHBondContact O-CG 3.37Å; I95-K99 PolarHBondContact O-N 3.34Å; I95-K99 VanDerWaalsContact O-N 3.11Å; I96-K99 WeakPolarHBondContact O-CB 3.34Å; I96-K99 PolarHBondContact O-N 2.9Å; C97-K99 VanDerWaalsContact C-N 3.3Å; C97-K99 PolarHBondContact O-N 2.84Å
100	I	81.1	Confident	73.9	Confident	117 Å²	117	88.3 Å²	88.3	60%	0.6	45%	0.454	S	S	*	.	H	α-helix	trans	-86.8	-10.9	179.1	-62.2	166.9	0	0	0	111.3	I96 C97 L98 L102	I96-I100 HydrophobicContact CG2-CD1 3.81Å; I96-I100 WeakPolarHBondContact O-CG1 3.39Å; I96-I100 PolarHBondContact O-N 3.45Å; I96-I100 VanDerWaalsContact O-N 3.14Å; C97-I100 CarbonylContact O-C 3.58Å; C97-I100 PolarHBondContact O-N 3.42Å; C97-I100 VanDerWaalsContact O-N 3.12Å; L98-I100 VanDerWaalsContact C-N 3.29Å; L98-I100 PolarHBondContact O-N 3.32Å; I100-L102 HydrophobicContact CB-CD1 4.06Å; I100-L102 HydrophobicContact CB-CG 4.49Å; I100-L102 HydrophobicContact CG2-CD1 3.68Å; I100-L102 HydrophobicContact CG2-CG 4.03Å
101	G	76.9	Confident	73.5	Confident	66 Å²	66	85.4 Å²	85.4	68%	0.68	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	22.6	-178.8	0	0	0	0	0	113.8	C97 L98	C97-G101 PolarHBondContact O-N 2.91Å; L98-G101 PolarHBondContact O-N 2.88Å
102	L	68.5	Low	73	Confident	65 Å²	65	82.7 Å²	82.7	34%	0.34	44%	0.436	S	S	.	.			trans	-80.4	140	177.5	-76.9	156	0	0	0	110.8	C97 I100 A106 W107 I110	C97-L102 HydrophobicContact CB-CB 4.18Å; C97-L102 PolarHBondContact O-N 3.46Å; I100-L102 HydrophobicContact CB-CD1 4.06Å; I100-L102 HydrophobicContact CB-CG 4.49Å; I100-L102 HydrophobicContact CG2-CD1 3.68Å; I100-L102 HydrophobicContact CG2-CG 4.03Å; L102-A106 HydrophobicContact CB-CB 4.31Å; L102-A106 HydrophobicContact CD2-CB 4.02Å; L102-W107 PolarHBondContact O-NE1 2.85Å; L102-I110 HydrophobicContact CD1-CD1 4.21Å
103	T	70.9	Confident	72.4	Confident	100 Å²	100	82 Å²	82	61%	0.613	44%	0.438	S	S	*	.			trans	-72	157.6	177.8	51.9	0	0	0	0	112.3	E105 A106 W107	T103-E105 PolarHBondContact O-N 2.82Å; T103-E105 VanDerWaalsContact O-N 3.09Å; T103-A106 WeakPolarHBondContact O-CB 3.26Å; T103-A106 PolarHBondContact O-N 2.79Å; T103-W107 PolarHBondContact O-NE1 3.23Å
104	E	64.3	Low	72	Confident	144 Å²	144	85.3 Å²	85.3	67%	0.673	46%	0.455	S	S	*	.	H	α-helix	trans	-55.2	-31	-173.1	-53.7	-164	153	0	0	114.1	W107	E104-W107 HydrophobicContact CB-CD2 4.47Å; E104-W107 HydrophobicContact CB-CE3 4.22Å; E104-W107 HydrophobicContact CB-CH2 4.29Å; E104-W107 HydrophobicContact CB-CZ2 4.5Å; E104-W107 HydrophobicContact CB-CZ3 4.13Å; E104-W107 HydrophobicContact CG-CE3 4.39Å; E104-W107 HydrophobicContact CG-CH2 3.61Å; E104-W107 HydrophobicContact CG-CZ2 4.01Å; E104-W107 HydrophobicContact CG-CZ3 3.8Å; E104-W107 PolarHBondContact O-N 3.05Å
105	E	66.2	Low	71.6	Confident	162 Å²	162	86.7 Å²	86.7	76%	0.757	46%	0.462	S	S	*	.	H	α-helix	trans	-66.2	-38	178.6	-63.4	179.2	175.2	0	0	112.2	T103 W107 T108	T103-E105 PolarHBondContact O-N 2.82Å; T103-E105 VanDerWaalsContact O-N 3.09Å; E105-W107 PolarHBondContact O-N 3.38Å; E105-T108 PolarHBondContact O-N 3.14Å
106	A	65.3	Low	70.6	Confident	19 Å²	19	86.2 Å²	86.2	16%	0.157	46%	0.459	C	S	.	.	H	α-helix	trans	-67.4	-23.7	-179.7	0	0	0	0	0	112.6	L102 T103 E109 I110	L102-A106 HydrophobicContact CB-CB 4.31Å; L102-A106 HydrophobicContact CD2-CB 4.02Å; T103-A106 WeakPolarHBondContact O-CB 3.26Å; T103-A106 PolarHBondContact O-N 2.79Å; A106-E109 PolarHBondContact O-N 2.97Å; A106-I110 WeakPolarHBondContact O-CD1 3.4Å; A106-I110 VanDerWaalsContact O-CG1 3.28Å; A106-I110 WeakPolarHBondContact O-CG1 3.34Å; A106-I110 PolarHBondContact O-N 2.97Å; A106-I110 VanDerWaalsContact O-N 3.09Å
107	W	65.4	Low	69.6	Low	42 Å²	42	89.1 Å²	89.1	16%	0.159	47%	0.471	C	S	.	.	H	α-helix	trans	-71	-38.2	-176.3	-49.9	-9.9	0	0	0	111.2	C97 L98 L102 T103 E104 E105 E109 I110 Y111	C97-W107 HydrophobicContact CB-CD2 4.32Å; C97-W107 HydrophobicContact CB-CG 3.89Å; L98-W107 HydrophobicContact CD2-CH2 3.76Å; L98-W107 HydrophobicContact CD2-CZ2 3.63Å; L98-W107 HydrophobicContact CG-CH2 4.01Å; L98-W107 HydrophobicContact CG-CZ2 3.88Å; L102-W107 PolarHBondContact O-NE1 2.85Å; T103-W107 PolarHBondContact O-NE1 3.23Å; E104-W107 HydrophobicContact CB-CD2 4.47Å; E104-W107 HydrophobicContact CB-CE3 4.22Å; E104-W107 HydrophobicContact CB-CH2 4.29Å; E104-W107 HydrophobicContact CB-CZ2 4.5Å; E104-W107 HydrophobicContact CB-CZ3 4.13Å; E104-W107 HydrophobicContact CG-CE3 4.39Å; E104-W107 HydrophobicContact CG-CH2 3.61Å; E104-W107 HydrophobicContact CG-CZ2 4.01Å; E104-W107 HydrophobicContact CG-CZ3 3.8Å; E104-W107 PolarHBondContact O-N 3.05Å; E105-W107 PolarHBondContact O-N 3.38Å; W107-E109 VanDerWaalsContact C-N 3.35Å; W107-I110 PolarHBondContact O-N 2.99Å; W107-Y111 WeakPolarHBondContact O-CB 3.32Å; W107-Y111 PolarHBondContact O-N 3.32Å
108	T	67.7	Low	68.7	Low	76 Å²	76	92.8 Å²	92.8	47%	0.466	50%	0.496	S	S	.	.	H	α-helix	trans	-65.6	-41	177.2	-55.9	0	0	0	0	110.6	E105 Y111 L112	E105-T108 PolarHBondContact O-N 3.14Å; T108-Y111 PolarHBondContact O-N 3.3Å; T108-L112 VanDerWaalsContact O-CB 3.3Å; T108-L112 WeakPolarHBondContact O-CB 3.38Å; T108-L112 PolarHBondContact O-N 2.68Å
109	E	69.6	Low	67.5	Low	140 Å²	140	91.6 Å²	91.6	65%	0.654	50%	0.496	S	S	*	.	H	α-helix	trans	-64.7	-42.4	176.7	-63.5	-171.9	175.2	0	0	112.4	A106 W107 L112 S113	A106-E109 PolarHBondContact O-N 2.97Å; W107-E109 VanDerWaalsContact C-N 3.35Å; E109-L112 PolarHBondContact O-N 3.05Å; E109-S113 VanDerWaalsContact O-CB 3.3Å; E109-S113 WeakPolarHBondContact O-CB 2.83Å; E109-S113 PolarHBondContact O-N 3.02Å
110	I	68.4	Low	65.9	Low	61 Å²	61	87.1 Å²	87.1	31%	0.313	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-45.6	178.4	-67.8	165.4	0	0	0	110.5	V93 L102 A106 W107 L112 S113 I114	V93-I110 HydrophobicContact CG1-CG2 4.32Å; L102-I110 HydrophobicContact CD1-CD1 4.21Å; A106-I110 WeakPolarHBondContact O-CD1 3.4Å; A106-I110 VanDerWaalsContact O-CG1 3.28Å; A106-I110 WeakPolarHBondContact O-CG1 3.34Å; A106-I110 PolarHBondContact O-N 2.97Å; A106-I110 VanDerWaalsContact O-N 3.09Å; W107-I110 PolarHBondContact O-N 2.99Å; I110-L112 PolarHBondContact O-N 3.19Å; I110-S113 WeakPolarHBondContact O-CB 3.44Å; I110-S113 PolarHBondContact O-N 2.8Å; I110-I114 HydrophobicContact CG2-CD1 3.93Å; I110-I114 WeakPolarHBondContact O-CG1 3.2Å; I110-I114 PolarHBondContact O-N 3.48Å
111	Y	68.1	Low	64.5	Low	54 Å²	54	84.1 Å²	84.1	21%	0.212	47%	0.473	C	S	.	.	H	α-helix	trans	-62.3	-43	177.9	179.5	-94.2	0	0	0	112.1	I86 W90 W107 T108 S113 I114 S115	I86-Y111 WeakPolarHBondContact CG2-OH 3.43Å; W90-Y111 AromaticContact CE3-CD1 3.76Å; W90-Y111 HydrophobicContact CE3-CD1 3.76Å; W90-Y111 AromaticContact CE3-CD2 3.68Å; W90-Y111 HydrophobicContact CE3-CD2 3.68Å; W90-Y111 HydrophobicContact CE3-CE1 4.05Å; W90-Y111 AromaticContact CE3-CE2 3.99Å; W90-Y111 HydrophobicContact CE3-CE2 3.99Å; W90-Y111 AromaticContact CE3-CG 3.55Å; W90-Y111 HydrophobicContact CE3-CG 3.55Å; W90-Y111 AromaticContact CZ3-CD1 3.43Å; W90-Y111 HydrophobicContact CZ3-CD1 3.43Å; W90-Y111 VanDerWaalsContact CZ3-CD1 3.43Å; W90-Y111 HydrophobicContact CZ3-CD2 4.12Å; W90-Y111 HydrophobicContact CZ3-CE1 4.01Å; W90-Y111 AromaticContact CZ3-CG 3.48Å; W90-Y111 HydrophobicContact CZ3-CG 3.48Å; W90-Y111 VanDerWaalsContact CZ3-CG 3.48Å; W107-Y111 WeakPolarHBondContact O-CB 3.32Å; W107-Y111 PolarHBondContact O-N 3.32Å; T108-Y111 PolarHBondContact O-N 3.3Å; Y111-S113 VanDerWaalsContact C-N 3.35Å; Y111-I114 PolarHBondContact O-N 3.08Å; Y111-S115 WeakPolarHBondContact O-CB 3.37Å; Y111-S115 PolarHBondContact O-N 3.18Å; Y111-S115 PolarHBondContact O-OG 2.95Å
112	L	70.2	Confident	63.3	Low	91 Å²	91	86 Å²	86	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-63.8	-41.4	176.5	-174.1	64.2	0	0	0	111.3	T108 E109 I110 I114 S115 M116	T108-L112 VanDerWaalsContact O-CB 3.3Å; T108-L112 WeakPolarHBondContact O-CB 3.38Å; T108-L112 PolarHBondContact O-N 2.68Å; E109-L112 PolarHBondContact O-N 3.05Å; I110-L112 PolarHBondContact O-N 3.19Å; L112-I114 PolarHBondContact O-N 3.44Å; L112-S115 PolarHBondContact O-N 2.86Å; L112-M116 HydrophobicContact CD1-CE 3.99Å; L112-M116 HydrophobicContact CD1-CG 4.48Å; L112-M116 HydrophobicContact CG-CG 4.45Å; L112-M116 WeakPolarHBondContact O-CB 3.26Å; L112-M116 WeakPolarHBondContact O-CG 3.34Å; L112-M116 PolarHBondContact O-N 3.38Å
113	S	68	Low	62.8	Low	81 Å²	81	86.5 Å²	86.5	57%	0.566	46%	0.464	S	S	*	.	H	α-helix	trans	-60.5	-44.7	176.4	-174.4	0	0	0	0	112.3	E109 I110 Y111 M116 H117	E109-S113 VanDerWaalsContact O-CB 3.3Å; E109-S113 WeakPolarHBondContact O-CB 2.83Å; E109-S113 PolarHBondContact O-N 3.02Å; I110-S113 WeakPolarHBondContact O-CB 3.44Å; I110-S113 PolarHBondContact O-N 2.8Å; Y111-S113 VanDerWaalsContact C-N 3.35Å; S113-M116 PolarHBondContact O-N 2.67Å; S113-H117 PolarHBondContact O-N 3.04Å
114	I	67.2	Low	62.2	Low	90 Å²	90	88.5 Å²	88.5	46%	0.462	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-46.5	176.6	-66.6	165.3	0	0	0	110.5	I110 Y111 L112 M116 H117 S118	I110-I114 HydrophobicContact CG2-CD1 3.93Å; I110-I114 WeakPolarHBondContact O-CG1 3.2Å; I110-I114 PolarHBondContact O-N 3.48Å; Y111-I114 PolarHBondContact O-N 3.08Å; L112-I114 PolarHBondContact O-N 3.44Å; I114-M116 VanDerWaalsContact C-N 3.32Å; I114-M116 PolarHBondContact O-N 3.5Å; I114-H117 PolarHBondContact O-N 3.4Å; I114-H117 VanDerWaalsContact O-N 3.12Å; I114-S118 PolarHBondContact O-N 3.21Å; I114-S118 VanDerWaalsContact O-N 3.08Å; I114-S118 PolarHBondContact O-OG 2.96Å
115	S	65.8	Low	62	Low	40 Å²	40	84.8 Å²	84.8	28%	0.28	45%	0.45	S	S	.	.	H	α-helix	trans	-62.6	-39.2	-179.5	-57.5	0	0	0	0	112.1	Y111 L112 S118 C119	Y111-S115 WeakPolarHBondContact O-CB 3.37Å; Y111-S115 PolarHBondContact O-N 3.18Å; Y111-S115 PolarHBondContact O-OG 2.95Å; L112-S115 PolarHBondContact O-N 2.86Å; S115-S118 PolarHBondContact O-N 3.36Å; S115-C119 PolarHBondContact O-N 3.43Å; S115-C119 PolarHBondContact O-SG 2.83Å
116	M	61.4	Low	61.6	Low	86 Å²	86	79.5 Å²	79.5	42%	0.424	43%	0.425	S	S	.	.	H	α-helix	trans	-66.2	-39.2	174.2	-72.6	-71.7	176.4	0	0	111.5	L112 S113 I114 S118 C119 V120 V162	L112-M116 HydrophobicContact CD1-CE 3.99Å; L112-M116 HydrophobicContact CD1-CG 4.48Å; L112-M116 HydrophobicContact CG-CG 4.45Å; L112-M116 WeakPolarHBondContact O-CB 3.26Å; L112-M116 WeakPolarHBondContact O-CG 3.34Å; L112-M116 PolarHBondContact O-N 3.38Å; S113-M116 PolarHBondContact O-N 2.67Å; I114-M116 VanDerWaalsContact C-N 3.32Å; I114-M116 PolarHBondContact O-N 3.5Å; M116-S118 VanDerWaalsContact C-N 3.32Å; M116-S118 PolarHBondContact O-N 2.95Å; M116-C119 WeakPolarHBondContact O-CB 3.26Å; M116-C119 PolarHBondContact O-N 2.91Å; M116-V120 WeakPolarHBondContact O-CG2 3.23Å; M116-V120 PolarHBondContact O-N 3.41Å; M116-V162 HydrophobicContact CE-CG1 3.93Å; M116-V162 HydrophobicContact SD-CG1 4.4Å
117	H	60.5	Low	61.4	Low	144 Å²	144	82.6 Å²	82.6	67%	0.667	44%	0.438	S	S	*	.	H	α-helix	trans	-64.6	-37	178.1	-155.6	70.3	0	0	0	112.2	S113 I114 C119 V120	S113-H117 PolarHBondContact O-N 3.04Å; I114-H117 PolarHBondContact O-N 3.4Å; I114-H117 VanDerWaalsContact O-N 3.12Å; H117-C119 PolarHBondContact O-N 3.24Å; H117-V120 PolarHBondContact O-N 2.91Å; H117-V120 VanDerWaalsContact O-N 3.08Å
118	S	56.8	Low	61.3	Low	80 Å²	80	83.6 Å²	83.6	56%	0.559	45%	0.448	S	S	*	.	H	α-helix	trans	-64.2	-23.8	172.5	-55.9	0	0	0	0	113.4	I114 S115 M116	I114-S118 PolarHBondContact O-N 3.21Å; I114-S118 VanDerWaalsContact O-N 3.08Å; I114-S118 PolarHBondContact O-OG 2.96Å; S115-S118 PolarHBondContact O-N 3.36Å; M116-S118 VanDerWaalsContact C-N 3.32Å; M116-S118 PolarHBondContact O-N 2.95Å
119	C	51.7	Low	61.1	Low	87 Å²	87	82.2 Å²	82.2	59%	0.588	44%	0.436	S	S	*	.	H	α-helix	trans	-82.3	-15.5	174.4	-63.2	0	0	0	0	113.1	S115 M116 H117 Y122	S115-C119 PolarHBondContact O-N 3.43Å; S115-C119 PolarHBondContact O-SG 2.83Å; M116-C119 WeakPolarHBondContact O-CB 3.26Å; M116-C119 PolarHBondContact O-N 2.91Å; H117-C119 PolarHBondContact O-N 3.24Å; C119-Y122 WeakPolarHBondContact O-CD2 3.25Å
120	V	50.4	Low	60.7	Low	84 Å²	84	77.1 Å²	77.1	51%	0.509	41%	0.411	S	S	.	.			trans	-94.2	3.2	-175.7	178.1	0	0	0	0	112.5	M116 H117 Y122	M116-V120 WeakPolarHBondContact O-CG2 3.23Å; M116-V120 PolarHBondContact O-N 3.41Å; H117-V120 PolarHBondContact O-N 2.91Å; H117-V120 VanDerWaalsContact O-N 3.08Å; V120-Y122 PolarHBondContact O-N 3.16Å
121	S	50.1	Low	60.4	Low	55 Å²	55	76.9 Å²	76.9	39%	0.385	41%	0.412	S	S	.	.			trans	-69.5	7.9	178.5	-50.4	0	0	0	0	115.1
122	Y	51.7	Low	60.3	Low	106 Å²	106	78.3 Å²	78.3	42%	0.416	43%	0.426	S	S	.	.			trans	-97.9	102.1	-178	-67.4	-81	0	0	0	110.6	R77 C119 V120	R77-Y122 PolarHBondContact NH2-OH 3.49Å; C119-Y122 WeakPolarHBondContact O-CD2 3.25Å; V120-Y122 PolarHBondContact O-N 3.16Å
123	D	59.5	Low	60.1	Low	75 Å²	75	74.6 Å²	74.6	40%	0.401	41%	0.407	S	S	.	.			trans	162.9	21.9	130.9	-114.7	-4.7	0	0	0	114.3	L125 F126 I127	D123-L125 PolarHBondContact O-N 2.98Å; D123-L125 VanDerWaalsContact O-N 3.14Å; D123-F126 HydrophobicContact CB-CB 3.9Å; D123-F126 PolarHBondContact O-N 3.47Å; D123-F126 WeakPolarHBondContact OD1-CB 3.45Å; D123-F126 WeakPolarHBondContact OD2-CB 3.42Å; D123-F126 WeakPolarHBondContact OD2-CG 3.47Å; D123-I127 WeakPolarHBondContact O-CG1 3.4Å; D123-I127 PolarHBondContact O-N 3.39Å
124	H	58.8	Low	59.9	Low	142 Å²	142	73.3 Å²	73.3	66%	0.657	39%	0.392	S	S	*	.	H	α-helix	trans	-55.2	-36.5	177.9	-62.4	-40.5	0	0	0	112.6	V128	H124-V128 WeakPolarHBondContact O-CG2 3.5Å; H124-V128 PolarHBondContact O-N 3.43Å
125	L	58.4	Low	59.9	Low	66 Å²	66	73.6 Å²	73.6	35%	0.346	39%	0.391	S	S	.	.	H	α-helix	trans	-73.1	-31.7	177.6	-65.3	175.2	0	0	0	113	Y62 A65 D123 V128 K129	Y62-L125 HydrophobicContact CD2-CB 3.77Å; Y62-L125 HydrophobicContact CE2-CB 3.47Å; Y62-L125 VanDerWaalsContact CE2-CB 3.47Å; A65-L125 HydrophobicContact CB-CD1 4.01Å; D123-L125 PolarHBondContact O-N 2.98Å; D123-L125 VanDerWaalsContact O-N 3.14Å; L125-V128 PolarHBondContact O-N 2.88Å; L125-K129 PolarHBondContact O-N 2.83Å
126	F	59.2	Low	60	Low	50 Å²	50	80.2 Å²	80.2	22%	0.219	41%	0.41	C	S	.	.	H	α-helix	trans	-72	-36.5	174.7	-176.7	-93.7	0	0	0	112	D123 V128 K129 R130	D123-F126 HydrophobicContact CB-CB 3.9Å; D123-F126 PolarHBondContact O-N 3.47Å; D123-F126 WeakPolarHBondContact OD1-CB 3.45Å; D123-F126 WeakPolarHBondContact OD2-CB 3.42Å; D123-F126 WeakPolarHBondContact OD2-CG 3.47Å; F126-V128 VanDerWaalsContact C-N 3.28Å; F126-V128 PolarHBondContact O-N 3.24Å; F126-K129 WeakPolarHBondContact O-CB 3.22Å; F126-K129 PolarHBondContact O-N 3.11Å; F126-R130 WeakPolarHBondContact O-CB 3.03Å; F126-R130 PolarHBondContact O-N 3.35Å
127	I	60.9	Low	60.1	Low	85 Å²	85	77.1 Å²	77.1	44%	0.436	39%	0.394	S	S	.	.	H	α-helix	trans	-59.5	-44.8	171.5	-64.9	168.9	0	0	0	109.2	D123 K129 R130 T131	D123-I127 WeakPolarHBondContact O-CG1 3.4Å; D123-I127 PolarHBondContact O-N 3.39Å; I127-K129 PolarHBondContact O-N 2.95Å; I127-R130 PolarHBondContact O-N 3.49Å; I127-T131 HydrophobicContact CG2-CG2 4.04Å; I127-T131 WeakPolarHBondContact O-CB 3.24Å; I127-T131 WeakPolarHBondContact O-CG2 3.46Å; I127-T131 PolarHBondContact O-N 2.95Å; I127-T131 PolarHBondContact O-OG1 3.4Å
128	V	63.3	Low	60.1	Low	63 Å²	63	73 Å²	73	38%	0.382	39%	0.392	S	S	.	.	H	α-helix	trans	-63.4	-41.3	177.2	174.2	0	0	0	0	112.1	F58 H124 L125 F126 R130 V132	F58-V128 HydrophobicContact CE2-CG1 4.08Å; F58-V128 HydrophobicContact CZ-CG1 4.29Å; H124-V128 WeakPolarHBondContact O-CG2 3.5Å; H124-V128 PolarHBondContact O-N 3.43Å; L125-V128 PolarHBondContact O-N 2.88Å; F126-V128 VanDerWaalsContact C-N 3.28Å; F126-V128 PolarHBondContact O-N 3.24Å; V128-R130 VanDerWaalsContact C-N 3.28Å; V128-R130 PolarHBondContact O-N 3.31Å; V128-V132 HydrophobicContact CG1-CG2 3.9Å; V128-V132 VanDerWaalsContact O-CB 3.28Å; V128-V132 WeakPolarHBondContact O-CB 3.48Å; V128-V132 WeakPolarHBondContact O-CG2 3.5Å; V128-V132 PolarHBondContact O-N 3.31Å
129	K	62.7	Low	60.3	Low	47 Å²	47	71.7 Å²	71.7	20%	0.204	38%	0.376	C	S	.	.	I	π-helix	trans	-53	-51.4	173.7	-174.8	175.4	177.4	-178.9	0	110.9	F55 F58 L125 F126 I127 I133	F55-K129 VanDerWaalsContact CE2-CE 3.41Å; F58-K129 HydrophobicContact CD1-CB 4.04Å; F58-K129 HydrophobicContact CD1-CD 4.2Å; F58-K129 HydrophobicContact CD1-CG 3.67Å; F58-K129 VanDerWaalsContact CE1-CA 3.46Å; F58-K129 HydrophobicContact CE1-CB 3.22Å; F58-K129 HydrophobicContact CE1-CD 3.92Å; F58-K129 HydrophobicContact CE1-CG 3.37Å; F58-K129 HydrophobicContact CZ-CB 3.55Å; F58-K129 HydrophobicContact CZ-CG 4.14Å; L125-K129 PolarHBondContact O-N 2.83Å; F126-K129 WeakPolarHBondContact O-CB 3.22Å; F126-K129 PolarHBondContact O-N 3.11Å; I127-K129 PolarHBondContact O-N 2.95Å; K129-I133 HydrophobicContact CG-CD1 3.86Å; K129-I133 WeakPolarHBondContact O-CB 3.43Å; K129-I133 WeakPolarHBondContact O-CD1 3.33Å; K129-I133 VanDerWaalsContact O-CG1 3.31Å; K129-I133 WeakPolarHBondContact O-CG1 3.4Å; K129-I133 PolarHBondContact O-N 3.31Å
130	R	60.9	Low	60.5	Low	32 Å²	32	71.4 Å²	71.4	12%	0.121	37%	0.368	C	S	.	.	I	π-helix	trans	-71.4	-49.3	-173.3	-158.1	-178.1	-84.3	-125.6	-20.9	110.4	F126 I127 V128 E134 L144 S147	F126-R130 WeakPolarHBondContact O-CB 3.03Å; F126-R130 PolarHBondContact O-N 3.35Å; I127-R130 PolarHBondContact O-N 3.49Å; V128-R130 VanDerWaalsContact C-N 3.28Å; V128-R130 PolarHBondContact O-N 3.31Å; R130-E134 VanDerWaalsContact CG-CD 3.45Å; R130-E134 HydrophobicContact CG-CG 4.48Å; R130-E134 WeakPolarHBondContact CG-OE1 3.34Å; R130-E134 WeakPolarHBondContact CG-OE2 3.37Å; R130-E134 WeakPolarHBondContact O-CB 3.19Å; R130-E134 WeakPolarHBondContact O-CG 3.33Å; R130-E134 PolarHBondContact O-N 3.43Å; R130-L144 HydrophobicContact CB-CD2 4.32Å; R130-L144 HydrophobicContact CG-CD2 3.57Å; R130-S147 PolarHBondContact NH1-OG 3.15Å
131	T	62.7	Low	60.8	Low	56 Å²	56	75.4 Å²	75.4	34%	0.344	37%	0.374	S	S	.	.	I	π-helix	trans	-71.1	-46.2	-176.9	57.9	0	0	0	0	112.3	I127 E135	I127-T131 HydrophobicContact CG2-CG2 4.04Å; I127-T131 WeakPolarHBondContact O-CB 3.24Å; I127-T131 WeakPolarHBondContact O-CG2 3.46Å; I127-T131 PolarHBondContact O-N 2.95Å; I127-T131 PolarHBondContact O-OG1 3.4Å; T131-E135 WeakPolarHBondContact O-CB 3.4Å; T131-E135 PolarHBondContact O-N 2.76Å; T131-E135 VanDerWaalsContact O-N 3.14Å
132	V	66.7	Low	61.3	Low	84 Å²	84	78.7 Å²	78.7	51%	0.509	38%	0.384	S	S	.	.	I	π-helix	trans	-78	-43	-170.7	-179.7	0	0	0	0	112.3	V128 R136	V128-V132 HydrophobicContact CG1-CG2 3.9Å; V128-V132 VanDerWaalsContact O-CB 3.28Å; V128-V132 WeakPolarHBondContact O-CB 3.48Å; V128-V132 WeakPolarHBondContact O-CG2 3.5Å; V128-V132 PolarHBondContact O-N 3.31Å; V132-R136 VanDerWaalsContact O-CB 3.27Å; V132-R136 WeakPolarHBondContact O-CB 3.48Å; V132-R136 PolarHBondContact O-N 2.97Å
133	I	64.6	Low	61.6	Low	13 Å²	13	79.4 Å²	79.4	7%	0.067	39%	0.391	C	S	.	.	I	π-helix	trans	-77.7	-44.9	-176.9	-52.2	169.5	0	0	0	110.7	F58 K129 R136 H137	F58-I133 HydrophobicContact CB-CD1 3.37Å; F58-I133 HydrophobicContact CB-CG1 4.15Å; F58-I133 HydrophobicContact CD1-CD1 3.5Å; F58-I133 VanDerWaalsContact CD1-CD1 3.5Å; F58-I133 HydrophobicContact CD2-CD1 3.73Å; F58-I133 HydrophobicContact CD2-CG1 3.99Å; F58-I133 HydrophobicContact CE1-CD1 4.25Å; F58-I133 HydrophobicContact CE2-CD1 4.41Å; F58-I133 HydrophobicContact CG-CD1 3.22Å; F58-I133 HydrophobicContact CG-CG1 3.98Å; K129-I133 HydrophobicContact CG-CD1 3.86Å; K129-I133 WeakPolarHBondContact O-CB 3.43Å; K129-I133 WeakPolarHBondContact O-CD1 3.33Å; K129-I133 VanDerWaalsContact O-CG1 3.31Å; K129-I133 WeakPolarHBondContact O-CG1 3.4Å; K129-I133 PolarHBondContact O-N 3.31Å; I133-R136 PolarHBondContact O-N 3.5Å; I133-H137 PolarHBondContact O-N 3.45Å; I133-H137 PolarHBondContact O-ND1 3.27Å
134	E	64.9	Low	61.5	Low	54 Å²	54	77.1 Å²	77.1	25%	0.252	38%	0.378	S	S	.	.	H	α-helix	trans	-70.4	-37.5	-177.1	-55.8	-179.6	174.7	0	0	110.6	R130 H137 G138 F139 L144	R130-E134 VanDerWaalsContact CG-CD 3.45Å; R130-E134 HydrophobicContact CG-CG 4.48Å; R130-E134 WeakPolarHBondContact CG-OE1 3.34Å; R130-E134 WeakPolarHBondContact CG-OE2 3.37Å; R130-E134 WeakPolarHBondContact O-CB 3.19Å; R130-E134 WeakPolarHBondContact O-CG 3.33Å; R130-E134 PolarHBondContact O-N 3.43Å; E134-H137 PolarHBondContact O-N 3.37Å; E134-G138 PolarHBondContact O-N 2.92Å; E134-F139 HydrophobicContact CB-CB 4.06Å; E134-F139 PolarHBondContact O-N 3.43Å; E134-F139 VanDerWaalsContact O-N 3.07Å; E134-L144 HydrophobicContact CB-CD1 4.39Å; E134-L144 VanDerWaalsContact OE2-CD2 3.3Å; E134-L144 WeakPolarHBondContact OE2-CD2 3.41Å
135	E	66.8	Low	61.6	Low	96 Å²	96	75.4 Å²	75.4	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-41.1	173.2	-173.3	169.4	-159.6	0	0	111.6	T131 H137 G138 R141	T131-E135 WeakPolarHBondContact O-CB 3.4Å; T131-E135 PolarHBondContact O-N 2.76Å; T131-E135 VanDerWaalsContact O-N 3.14Å; E135-H137 VanDerWaalsContact C-N 3.25Å; E135-H137 PolarHBondContact O-N 3.19Å; E135-G138 PolarHBondContact O-N 3.49Å; E135-R141 IonicContact OE1-CZ 3.63Å; E135-R141 IonicContact OE1-NE 3.64Å; E135-R141 IonicContact OE1-NH2 2.72Å; E135-R141 PolarHBondContact OE1-NH2 3.28Å
136	R	67.2	Low	61.9	Low	180 Å²	180	77 Å²	77	68%	0.679	38%	0.382	S	S	*	.	H	α-helix	trans	-62.4	-31.7	179	-169.1	179.7	-165.3	-161.7	9.4	113	D54 V132 I133	D54-R136 IonicContact OD1-NH1 2.95Å; D54-R136 IonicContact OD2-CZ 2.7Å; D54-R136 IonicContact OD2-NH1 3.28Å; D54-R136 PolarHBondContact OD2-NH1 3.02Å; V132-R136 VanDerWaalsContact O-CB 3.27Å; V132-R136 WeakPolarHBondContact O-CB 3.48Å; V132-R136 PolarHBondContact O-N 2.97Å; I133-R136 PolarHBondContact O-N 3.5Å
137	H	65.5	Low	62.1	Low	20 Å²	20	75.7 Å²	75.7	9%	0.093	38%	0.378	C	S	.	.	H	α-helix	trans	-93.9	-2.7	-178	-67.7	86.1	0	0	0	113.9	K47 H51 D54 I133 E134 E135 F139	K47-H137 WeakPolarHBondContact CE-O 3.22Å; K47-H137 PolarHBondContact NZ-O 3.46Å; H51-H137 VanDerWaalsContact CA-NE2 3.32Å; H51-H137 WeakPolarHBondContact CA-NE2 3.31Å; H51-H137 AromaticContact CD2-CD2 3.6Å; H51-H137 AromaticContact CD2-CE1 3.89Å; H51-H137 AromaticContact CD2-CG 3.35Å; H51-H137 AromaticContact CD2-ND1 3.55Å; H51-H137 AromaticContact CD2-NE2 3.94Å; H51-H137 AromaticContact CG-CD2 3.95Å; D54-H137 IonicContact OD2-CE1 3.92Å; D54-H137 PolarHBondContact OD2-CE1 2.8Å; D54-H137 IonicContact OD2-NE2 2.79Å; I133-H137 PolarHBondContact O-N 3.45Å; I133-H137 PolarHBondContact O-ND1 3.27Å; E134-H137 PolarHBondContact O-N 3.37Å; E135-H137 VanDerWaalsContact C-N 3.25Å; E135-H137 PolarHBondContact O-N 3.19Å; H137-F139 VanDerWaalsContact C-N 3.35Å; H137-F139 HydrophobicContact CB-CD2 3.91Å; H137-F139 HydrophobicContact CB-CE2 4Å
138	G	60.5	Low	62.3	Low	59 Å²	59	77.1 Å²	77.1	61%	0.608	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	27	178.1	0	0	0	0	0	112.9	E134 E135 N140	E134-G138 PolarHBondContact O-N 2.92Å; E135-G138 PolarHBondContact O-N 3.49Å; G138-N140 PolarHBondContact O-N 2.59Å
139	F	59.4	Low	62.5	Low	51 Å²	51	78.6 Å²	78.6	22%	0.224	40%	0.395	C	S	.	.			trans	-64	128.3	163.6	-74.9	-80.7	0	0	0	107.3	H51 E134 H137 R141 P196	H51-F139 AromaticContact CD2-CE2 3.92Å; H51-F139 AromaticContact CE1-CE2 3.77Å; H51-F139 AromaticContact NE2-CE2 3.5Å; E134-F139 HydrophobicContact CB-CB 4.06Å; E134-F139 PolarHBondContact O-N 3.43Å; E134-F139 VanDerWaalsContact O-N 3.07Å; H137-F139 VanDerWaalsContact C-N 3.35Å; H137-F139 HydrophobicContact CB-CD2 3.91Å; H137-F139 HydrophobicContact CB-CE2 4Å; F139-R141 PolarHBondContact O-N 3.43Å; F139-P196 HydrophobicContact CE1-CG 3.97Å
140	N	56.4	Low	62.9	Low	82 Å²	82	80.7 Å²	80.7	44%	0.439	41%	0.408	S	S	.	.			trans	-53.7	128.1	-158.9	-161.5	15.4	0	0	0	110.9	G138 E142 E143	G138-N140 PolarHBondContact O-N 2.59Å; N140-E142 PolarHBondContact ND2-OE2 3.31Å; N140-E142 PolarHBondContact O-N 3.15Å; N140-E143 HydrophobicContact CB-CG 4.4Å; N140-E143 PolarHBondContact O-N 3.48Å
141	R	57.3	Low	63.1	Low	167 Å²	167	82.2 Å²	82.2	63%	0.63	42%	0.415	S	S	*	.	H	α-helix	trans	-52.3	-25.8	180	-75.7	-179.2	170.2	-172	-6	112.7	E135 F139 I145	E135-R141 IonicContact OE1-CZ 3.63Å; E135-R141 IonicContact OE1-NE 3.64Å; E135-R141 IonicContact OE1-NH2 2.72Å; E135-R141 PolarHBondContact OE1-NH2 3.28Å; F139-R141 PolarHBondContact O-N 3.43Å; R141-I145 WeakPolarHBondContact O-CD1 3.31Å; R141-I145 VanDerWaalsContact O-CG1 3.3Å; R141-I145 WeakPolarHBondContact O-CG1 3.48Å; R141-I145 PolarHBondContact O-N 3.48Å
142	E	59.4	Low	63.1	Low	125 Å²	125	83.3 Å²	83.3	58%	0.584	43%	0.425	S	S	*	.	H	α-helix	trans	-66.4	-39.4	177.3	-59.9	176.8	165.3	0	0	112.6	N140 I145 L146	N140-E142 PolarHBondContact ND2-OE2 3.31Å; N140-E142 PolarHBondContact O-N 3.15Å; E142-I145 PolarHBondContact O-N 3.09Å; E142-L146 WeakPolarHBondContact O-CB 3.43Å; E142-L146 WeakPolarHBondContact O-CD1 3.35Å; E142-L146 PolarHBondContact O-N 3.18Å
143	E	58.3	Low	63.4	Low	121 Å²	121	82.3 Å²	82.3	57%	0.565	42%	0.42	S	S	*	.	H	α-helix	trans	-70.9	-36.6	-178.8	-67.1	-175	173.5	0	0	111.9	N140 L146 S147	N140-E143 HydrophobicContact CB-CG 4.4Å; N140-E143 PolarHBondContact O-N 3.48Å; E143-L146 PolarHBondContact O-N 3.37Å; E143-S147 WeakPolarHBondContact O-CB 3.24Å; E143-S147 PolarHBondContact O-N 2.9Å
144	L	57.8	Low	63.7	Low	26 Å²	26	85 Å²	85	14%	0.136	43%	0.434	C	S	.	.	H	α-helix	trans	-59	-50.7	172.2	-83.9	163.6	0	0	0	111.1	R130 E134 S147 L148	R130-L144 HydrophobicContact CB-CD2 4.32Å; R130-L144 HydrophobicContact CG-CD2 3.57Å; E134-L144 HydrophobicContact CB-CD1 4.39Å; E134-L144 VanDerWaalsContact OE2-CD2 3.3Å; E134-L144 WeakPolarHBondContact OE2-CD2 3.41Å; L144-S147 PolarHBondContact O-N 2.91Å; L144-S147 PolarHBondContact O-OG 2.91Å; L144-L148 PolarHBondContact O-N 2.86Å; L144-L148 VanDerWaalsContact O-N 3.08Å
145	I	61.4	Low	63.6	Low	106 Å²	106	86.1 Å²	86.1	54%	0.544	44%	0.444	S	S	.	.	H	α-helix	trans	-64.7	-45.7	179.7	-65.5	165.7	0	0	0	110.5	R141 E142 S147 L148 V149	R141-I145 WeakPolarHBondContact O-CD1 3.31Å; R141-I145 VanDerWaalsContact O-CG1 3.3Å; R141-I145 WeakPolarHBondContact O-CG1 3.48Å; R141-I145 PolarHBondContact O-N 3.48Å; E142-I145 PolarHBondContact O-N 3.09Å; I145-S147 VanDerWaalsContact C-N 3.3Å; I145-S147 PolarHBondContact O-N 3.32Å; I145-L148 PolarHBondContact O-N 3.39Å; I145-V149 HydrophobicContact CG2-CG2 3.89Å; I145-V149 WeakPolarHBondContact O-CB 3.36Å; I145-V149 WeakPolarHBondContact O-CG2 3.33Å; I145-V149 PolarHBondContact O-N 3.15Å
146	L	64.9	Low	63.5	Low	101 Å²	101	84.3 Å²	84.3	53%	0.529	45%	0.446	S	S	.	.	H	α-helix	trans	-55.9	-45.3	175.6	-91.2	149.4	0	0	0	111.4	E142 E143 L148 V149 I150	E142-L146 WeakPolarHBondContact O-CB 3.43Å; E142-L146 WeakPolarHBondContact O-CD1 3.35Å; E142-L146 PolarHBondContact O-N 3.18Å; E143-L146 PolarHBondContact O-N 3.37Å; L146-L148 VanDerWaalsContact C-N 3.34Å; L146-L148 PolarHBondContact O-N 3.28Å; L146-V149 PolarHBondContact O-N 2.88Å; L146-I150 HydrophobicContact CD2-CD1 4.46Å; L146-I150 WeakPolarHBondContact O-CB 3.28Å; L146-I150 WeakPolarHBondContact O-CD1 3.35Å; L146-I150 WeakPolarHBondContact O-CG1 2.86Å; L146-I150 PolarHBondContact O-N 2.8Å
147	S	63.7	Low	63.6	Low	22 Å²	22	79.3 Å²	79.3	15%	0.154	44%	0.436	C	S	.	.	H	α-helix	trans	-65.3	-37.5	179.7	79.1	0	0	0	0	112.7	R130 E143 L144 I145 K151	R130-S147 PolarHBondContact NH1-OG 3.15Å; E143-S147 WeakPolarHBondContact O-CB 3.24Å; E143-S147 PolarHBondContact O-N 2.9Å; L144-S147 PolarHBondContact O-N 2.91Å; L144-S147 PolarHBondContact O-OG 2.91Å; I145-S147 VanDerWaalsContact C-N 3.3Å; I145-S147 PolarHBondContact O-N 3.32Å; S147-K151 WeakPolarHBondContact O-CB 3.3Å; S147-K151 VanDerWaalsContact O-CG 3.22Å; S147-K151 WeakPolarHBondContact O-CG 3.17Å; S147-K151 PolarHBondContact O-N 2.85Å; S147-K151 VanDerWaalsContact O-N 3.13Å
148	L	64.2	Low	63.4	Low	114 Å²	114	82 Å²	82	60%	0.597	45%	0.447	S	S	*	.	H	α-helix	trans	-72.1	-41.9	177.5	-172.6	65	0	0	0	112	L144 I145 L146 I150 K151 S152	L144-L148 PolarHBondContact O-N 2.86Å; L144-L148 VanDerWaalsContact O-N 3.08Å; I145-L148 PolarHBondContact O-N 3.39Å; L146-L148 VanDerWaalsContact C-N 3.34Å; L146-L148 PolarHBondContact O-N 3.28Å; L148-I150 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 3.44Å; L148-K151 PolarHBondContact O-N 3.43Å; L148-S152 WeakPolarHBondContact O-CB 3.46Å; L148-S152 PolarHBondContact O-N 3.22Å
149	V	67.7	Low	63.4	Low	94 Å²	94	82.7 Å²	82.7	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-68.4	-31	179.2	172.2	0	0	0	0	111.7	I145 L146 P153	I145-V149 HydrophobicContact CG2-CG2 3.89Å; I145-V149 WeakPolarHBondContact O-CB 3.36Å; I145-V149 WeakPolarHBondContact O-CG2 3.33Å; I145-V149 PolarHBondContact O-N 3.15Å; L146-V149 PolarHBondContact O-N 2.88Å; V149-P153 WeakPolarHBondContact O-CD 3.42Å; V149-P153 VanDerWaalsContact O-CG 3.26Å; V149-P153 WeakPolarHBondContact O-CG 3.46Å
150	I	70.5	Confident	63.8	Low	91 Å²	91	87.2 Å²	87.2	47%	0.467	46%	0.455	S	S	.	.	H	α-helix	trans	-77	-40.8	174.7	-67.4	164.9	0	0	0	111	L146 L148 P153 I154	L146-I150 HydrophobicContact CD2-CD1 4.46Å; L146-I150 WeakPolarHBondContact O-CB 3.28Å; L146-I150 WeakPolarHBondContact O-CD1 3.35Å; L146-I150 WeakPolarHBondContact O-CG1 2.86Å; L146-I150 PolarHBondContact O-N 2.8Å; L148-I150 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 3.44Å; I150-P153 WeakPolarHBondContact O-CD 3.43Å; I150-P153 WeakPolarHBondContact O-CG 3.43Å; I150-I154 HydrophobicContact CG2-CD1 4.01Å; I150-I154 VanDerWaalsContact O-CD1 3.3Å; I150-I154 WeakPolarHBondContact O-CD1 3.44Å; I150-I154 VanDerWaalsContact O-CG1 3.32Å; I150-I154 WeakPolarHBondContact O-CG1 3.36Å
151	K	64.6	Low	64.1	Low	65 Å²	65	85.8 Å²	85.8	28%	0.283	45%	0.447	S	S	.	.	H	α-helix	trans	-72.3	-38.3	-176.7	-73.6	-179.8	178.5	-164.1	0	113.1	S147 L148 I154 V155 D187	S147-K151 WeakPolarHBondContact O-CB 3.3Å; S147-K151 VanDerWaalsContact O-CG 3.22Å; S147-K151 WeakPolarHBondContact O-CG 3.17Å; S147-K151 PolarHBondContact O-N 2.85Å; S147-K151 VanDerWaalsContact O-N 3.13Å; L148-K151 PolarHBondContact O-N 3.43Å; K151-I154 PolarHBondContact O-N 3.46Å; K151-V155 WeakPolarHBondContact O-CG2 3.42Å; K151-V155 PolarHBondContact O-N 3.34Å; K151-V155 VanDerWaalsContact O-N 3.09Å; K151-D187 WeakPolarHBondContact CE-OD2 3.39Å; K151-D187 IonicContact NZ-OD2 3.56Å; K151-D187 PolarHBondContact NZ-OD2 2.93Å
152	S	64.1	Low	64.2	Low	78 Å²	78	80.1 Å²	80.1	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-55.2	-52	-179.1	-177.7	0	0	0	0	114.5	L148 I154 V155 A156	L148-S152 WeakPolarHBondContact O-CB 3.46Å; L148-S152 PolarHBondContact O-N 3.22Å; S152-I154 VanDerWaalsContact C-N 3.32Å; S152-I154 PolarHBondContact O-N 3.04Å; S152-V155 PolarHBondContact O-N 3.41Å; S152-A156 WeakPolarHBondContact O-CB 3.41Å; S152-A156 PolarHBondContact O-N 3.1Å
153	P	73	Confident	64.4	Low	64 Å²	64	82.9 Å²	82.9	42%	0.416	44%	0.441	S	S	.	.	H	α-helix	trans	-67.5	-31.5	178.3	26.7	-34.4	0	0	0	112	V149 I150 A156 T157	V149-P153 WeakPolarHBondContact O-CD 3.42Å; V149-P153 VanDerWaalsContact O-CG 3.26Å; V149-P153 WeakPolarHBondContact O-CG 3.46Å; I150-P153 WeakPolarHBondContact O-CD 3.43Å; I150-P153 WeakPolarHBondContact O-CG 3.43Å; P153-A156 PolarHBondContact O-N 3.47Å; P153-T157 VanDerWaalsContact O-CB 3.27Å; P153-T157 WeakPolarHBondContact O-CB 3.43Å; P153-T157 PolarHBondContact O-N 2.76Å; P153-T157 PolarHBondContact O-OG1 2.82Å
154	I	70.4	Confident	64.5	Low	68 Å²	68	84 Å²	84	35%	0.349	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-46.2	176.7	-64	167.9	0	0	0	110.2	I150 K151 S152 T157 F158	I150-I154 HydrophobicContact CG2-CD1 4.01Å; I150-I154 VanDerWaalsContact O-CD1 3.3Å; I150-I154 WeakPolarHBondContact O-CD1 3.44Å; I150-I154 VanDerWaalsContact O-CG1 3.32Å; I150-I154 WeakPolarHBondContact O-CG1 3.36Å; K151-I154 PolarHBondContact O-N 3.46Å; S152-I154 VanDerWaalsContact C-N 3.32Å; S152-I154 PolarHBondContact O-N 3.04Å; I154-T157 PolarHBondContact O-N 3.16Å; I154-F158 VanDerWaalsContact O-CB 3.31Å; I154-F158 WeakPolarHBondContact O-CB 3.3Å; I154-F158 PolarHBondContact O-N 2.97Å
155	V	63.8	Low	64.3	Low	78 Å²	78	84.7 Å²	84.7	47%	0.473	45%	0.447	S	S	.	.	H	α-helix	trans	-66.1	-42.1	176.5	178.1	0	0	0	0	110.8	K151 S152 F158 V159	K151-V155 WeakPolarHBondContact O-CG2 3.42Å; K151-V155 PolarHBondContact O-N 3.34Å; K151-V155 VanDerWaalsContact O-N 3.09Å; S152-V155 PolarHBondContact O-N 3.41Å; V155-F158 WeakPolarHBondContact O-CB 3.46Å; V155-F158 PolarHBondContact O-N 2.82Å; V155-V159 HydrophobicContact CG1-CG2 4.49Å; V155-V159 WeakPolarHBondContact O-CG2 3.37Å; V155-V159 PolarHBondContact O-N 3.28Å
156	A	64.3	Low	63.9	Low	58 Å²	58	84.4 Å²	84.4	48%	0.479	45%	0.454	S	S	.	.	H	α-helix	trans	-63.8	-42.7	177.4	0	0	0	0	0	112.3	S152 P153 F158 V159 W160	S152-A156 WeakPolarHBondContact O-CB 3.41Å; S152-A156 PolarHBondContact O-N 3.1Å; P153-A156 PolarHBondContact O-N 3.47Å; A156-F158 VanDerWaalsContact C-N 3.33Å; A156-V159 PolarHBondContact O-N 2.95Å; A156-W160 VanDerWaalsContact O-CB 3.27Å; A156-W160 WeakPolarHBondContact O-CB 3.38Å; A156-W160 PolarHBondContact O-N 3.48Å
157	T	68.6	Low	63.6	Low	76 Å²	76	87 Å²	87	47%	0.466	46%	0.464	S	S	.	.	H	α-helix	trans	-64.6	-38.2	173.9	-61.1	0	0	0	0	111.1	P153 I154 W160 L161	P153-T157 VanDerWaalsContact O-CB 3.27Å; P153-T157 WeakPolarHBondContact O-CB 3.43Å; P153-T157 PolarHBondContact O-N 2.76Å; P153-T157 PolarHBondContact O-OG1 2.82Å; I154-T157 PolarHBondContact O-N 3.16Å; T157-W160 PolarHBondContact O-N 3.36Å; T157-L161 HydrophobicContact CG2-CD1 3.97Å; T157-L161 HydrophobicContact CG2-CG 4.37Å; T157-L161 WeakPolarHBondContact O-CB 3.22Å; T157-L161 WeakPolarHBondContact O-CG 3.44Å; T157-L161 PolarHBondContact O-N 3.32Å
158	F	60.6	Low	63.2	Low	76 Å²	76	94.2 Å²	94.2	33%	0.333	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-50.8	174.8	178.7	-99.1	0	0	0	111.7	I154 V155 A156 W160 L161 V162 C176	I154-F158 VanDerWaalsContact O-CB 3.31Å; I154-F158 WeakPolarHBondContact O-CB 3.3Å; I154-F158 PolarHBondContact O-N 2.97Å; V155-F158 WeakPolarHBondContact O-CB 3.46Å; V155-F158 PolarHBondContact O-N 2.82Å; A156-F158 VanDerWaalsContact C-N 3.33Å; F158-W160 VanDerWaalsContact C-N 3.27Å; F158-W160 PolarHBondContact O-N 3.39Å; F158-L161 PolarHBondContact O-N 2.93Å; F158-V162 HydrophobicContact CD1-CG2 4.34Å; F158-V162 HydrophobicContact CE1-CG2 3.98Å; F158-V162 HydrophobicContact CE2-CG2 4.24Å; F158-V162 HydrophobicContact CZ-CG2 3.93Å; F158-V162 WeakPolarHBondContact O-CG2 3.08Å; F158-V162 PolarHBondContact O-N 3.39Å; F158-C176 HydrophobicContact CD2-CB 4.29Å; F158-C176 HydrophobicContact CE2-CB 4.24Å
159	V	61.5	Low	62.8	Low	74 Å²	74	94 Å²	94	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-60.8	-39.7	176.5	174.4	0	0	0	0	110.7	V155 A156 K163	V155-V159 HydrophobicContact CG1-CG2 4.49Å; V155-V159 WeakPolarHBondContact O-CG2 3.37Å; V155-V159 PolarHBondContact O-N 3.28Å; A156-V159 PolarHBondContact O-N 2.95Å; V159-K163 VanDerWaalsContact O-CB 3.27Å; V159-K163 WeakPolarHBondContact O-CB 3.44Å; V159-K163 PolarHBondContact O-N 3.36Å
160	W	66.8	Low	62.5	Low	145 Å²	145	96.7 Å²	96.7	55%	0.549	50%	0.498	S	S	.	.	H	α-helix	trans	-65.9	-40.9	176.7	-177	86.6	0	0	0	112.8	A156 T157 F158 K163 K164	A156-W160 VanDerWaalsContact O-CB 3.27Å; A156-W160 WeakPolarHBondContact O-CB 3.38Å; A156-W160 PolarHBondContact O-N 3.48Å; T157-W160 PolarHBondContact O-N 3.36Å; F158-W160 VanDerWaalsContact C-N 3.27Å; F158-W160 PolarHBondContact O-N 3.39Å; W160-K163 PolarHBondContact O-N 3.41Å; W160-K164 HydrophobicContact CH2-CD 3.59Å; W160-K164 HydrophobicContact CZ2-CD 3.68Å; W160-K164 HydrophobicContact CZ3-CD 4.07Å; W160-K164 WeakPolarHBondContact O-CB 3.36Å; W160-K164 PolarHBondContact O-N 2.81Å; W160-K164 VanDerWaalsContact O-N 3.15Å
161	L	62.9	Low	61.9	Low	53 Å²	53	99.2 Å²	99.2	28%	0.277	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-47.6	175.2	-80.7	166.6	0	0	0	111.1	T157 F158 K163 K164 Q165	T157-L161 HydrophobicContact CG2-CD1 3.97Å; T157-L161 HydrophobicContact CG2-CG 4.37Å; T157-L161 WeakPolarHBondContact O-CB 3.22Å; T157-L161 WeakPolarHBondContact O-CG 3.44Å; T157-L161 PolarHBondContact O-N 3.32Å; F158-L161 PolarHBondContact O-N 2.93Å; L161-K163 VanDerWaalsContact C-N 3.27Å; L161-K163 PolarHBondContact O-N 2.98Å; L161-K164 PolarHBondContact O-N 2.92Å; L161-Q165 WeakPolarHBondContact O-CG 3.47Å; L161-Q165 PolarHBondContact O-N 3.22Å
162	V	60.9	Low	61.7	Low	47 Å²	47	98 Å²	98	29%	0.285	51%	0.51	S	S	.	.	H	α-helix	trans	-58.5	-41.1	175.8	172.5	0	0	0	0	110.7	M116 F158 K164	M116-V162 HydrophobicContact CE-CG1 3.93Å; M116-V162 HydrophobicContact SD-CG1 4.4Å; F158-V162 HydrophobicContact CD1-CG2 4.34Å; F158-V162 HydrophobicContact CE1-CG2 3.98Å; F158-V162 HydrophobicContact CE2-CG2 4.24Å; F158-V162 HydrophobicContact CZ-CG2 3.93Å; F158-V162 WeakPolarHBondContact O-CG2 3.08Å; F158-V162 PolarHBondContact O-N 3.39Å; V162-K164 PolarHBondContact O-N 2.97Å
163	K	61.7	Low	61.5	Low	183 Å²	183	96.6 Å²	96.6	80%	0.796	50%	0.497	S	S	*	.	H	α-helix	trans	-66.3	-23.3	177.6	-167.7	173.7	-178.2	179.3	0	113.4	V159 W160 L161	V159-K163 VanDerWaalsContact O-CB 3.27Å; V159-K163 WeakPolarHBondContact O-CB 3.44Å; V159-K163 PolarHBondContact O-N 3.36Å; W160-K163 PolarHBondContact O-N 3.41Å; L161-K163 VanDerWaalsContact C-N 3.27Å; L161-K163 PolarHBondContact O-N 2.98Å
164	K	62	Low	61.1	Low	144 Å²	144	95.3 Å²	95.3	63%	0.626	50%	0.496	S	S	*	.	H	α-helix	trans	-97.1	-10.1	-175.3	-158.6	173.6	-178.9	-176	0	113.8	W160 L161 V162 S166	W160-K164 HydrophobicContact CH2-CD 3.59Å; W160-K164 HydrophobicContact CZ2-CD 3.68Å; W160-K164 HydrophobicContact CZ3-CD 4.07Å; W160-K164 WeakPolarHBondContact O-CB 3.36Å; W160-K164 PolarHBondContact O-N 2.81Å; W160-K164 VanDerWaalsContact O-N 3.15Å; L161-K164 PolarHBondContact O-N 2.92Å; V162-K164 PolarHBondContact O-N 2.97Å; K164-S166 PolarHBondContact O-N 3.24Å
165	Q	52.9	Low	60.7	Low	41 Å²	41	95.7 Å²	95.7	19%	0.192	50%	0.501	C	S	.	.			trans	-98.6	91.8	-171.1	-78.3	-156.4	-73.2	0	0	114	L161 Y168 V172	L161-Q165 WeakPolarHBondContact O-CG 3.47Å; L161-Q165 PolarHBondContact O-N 3.22Å; Q165-Y168 PolarHBondContact NE2-O 3.42Å; Q165-V172 VanDerWaalsContact OE1-CG1 3.28Å
166	S	52.8	Low	60.5	Low	101 Å²	101	93.3 Å²	93.3	71%	0.706	49%	0.488	S	S	*	.	S	Bend	trans	-91.9	-10	164.2	60.9	0	0	0	0	114	K164	K164-S166 PolarHBondContact O-N 3.24Å
167	E	59.1	Low	60.5	Low	155 Å²	155	95 Å²	95	72%	0.724	49%	0.489	S	S	*	.	S	Bend	trans	-134.3	-8.8	-165.5	-70.4	178.6	-176.1	0	0	117.8
168	Y	55.2	Low	60.3	Low	173 Å²	173	94.5 Å²	94.5	68%	0.678	49%	0.488	S	S	*	.			trans	-129.9	53.3	-179.1	-64.1	-81.1	0	0	0	113.5	Q165 I170	Q165-Y168 PolarHBondContact NE2-O 3.42Å; Y168-I170 PolarHBondContact O-N 3.04Å
169	N	56.6	Low	60.6	Low	110 Å²	110	94.6 Å²	94.6	59%	0.588	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-21.6	-153.9	-137.3	-20.3	0	0	0	116.9	T173	N169-T173 WeakPolarHBondContact O-CB 3.38Å; N169-T173 PolarHBondContact O-OG1 3.01Å
170	I	61.2	Low	60.8	Low	151 Å²	151	93.8 Å²	93.8	77%	0.774	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-42	-172.9	-62.8	169.1	0	0	0	112.2	Y168 G174	Y168-I170 PolarHBondContact O-N 3.04Å; I170-G174 WeakPolarHBondContact O-CA 3.25Å; I170-G174 PolarHBondContact O-N 3.14Å
171	L	58.1	Low	60.8	Low	143 Å²	143	91.2 Å²	91.2	75%	0.749	49%	0.49	S	S	*	.	H	α-helix	trans	-74	-39.8	-172.6	-162.1	76.3	0	0	0	112.3	T175	L171-T175 WeakPolarHBondContact O-CB 3.44Å; L171-T175 PolarHBondContact O-N 3.3Å; L171-T175 PolarHBondContact O-OG1 3.37Å
172	V	59.4	Low	60.9	Low	41 Å²	41	94.5 Å²	94.5	25%	0.248	50%	0.503	C	S	.	.	H	α-helix	trans	-75.5	-43.9	179	179.6	0	0	0	0	110.5	Q165 G174 T175 C176	Q165-V172 VanDerWaalsContact OE1-CG1 3.28Å; V172-G174 VanDerWaalsContact C-N 3.29Å; V172-G174 PolarHBondContact O-N 2.81Å; V172-T175 WeakPolarHBondContact CA-OG1 2.98Å; V172-T175 PolarHBondContact O-N 3.49Å; V172-T175 PolarHBondContact O-OG1 3.48Å; V172-C176 VanDerWaalsContact O-CB 3.24Å; V172-C176 WeakPolarHBondContact O-CB 3.31Å; V172-C176 PolarHBondContact O-N 3.08Å; V172-C176 PolarHBondContact O-SG 2.84Å
173	T	60.9	Low	61	Low	47 Å²	47	94.9 Å²	94.9	29%	0.288	50%	0.503	S	S	.	.	H	α-helix	trans	-59.2	-42.2	172.9	-48.7	0	0	0	0	111.1	N169 L177	N169-T173 WeakPolarHBondContact O-CB 3.38Å; N169-T173 PolarHBondContact O-OG1 3.01Å; T173-L177 HydrophobicContact CG2-CD1 4.09Å; T173-L177 VanDerWaalsContact O-CB 3.3Å; T173-L177 WeakPolarHBondContact O-CB 3.31Å; T173-L177 WeakPolarHBondContact O-CD1 3.41Å; T173-L177 VanDerWaalsContact O-CG 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.31Å; T173-L177 PolarHBondContact O-N 3.44Å
174	G	63.7	Low	61	Low	37 Å²	37	88.7 Å²	88.7	38%	0.381	49%	0.486	S	S	.	.	H	α-helix	trans	-67.6	-42	176.7	0	0	0	0	0	114	I170 V172 L177 S178	I170-G174 WeakPolarHBondContact O-CA 3.25Å; I170-G174 PolarHBondContact O-N 3.14Å; V172-G174 VanDerWaalsContact C-N 3.29Å; V172-G174 PolarHBondContact O-N 2.81Å; G174-L177 PolarHBondContact O-N 3.37Å; G174-S178 PolarHBondContact O-N 3.17Å
175	T	62.8	Low	61	Low	76 Å²	76	89.5 Å²	89.5	47%	0.466	49%	0.486	S	S	.	.	H	α-helix	trans	-69.8	-39.1	175.4	37.5	0	0	0	0	111.5	L171 V172 S178 V179	L171-T175 WeakPolarHBondContact O-CB 3.44Å; L171-T175 PolarHBondContact O-N 3.3Å; L171-T175 PolarHBondContact O-OG1 3.37Å; V172-T175 WeakPolarHBondContact CA-OG1 2.98Å; V172-T175 PolarHBondContact O-N 3.49Å; V172-T175 PolarHBondContact O-OG1 3.48Å; T175-S178 PolarHBondContact O-N 3.28Å; T175-S178 PolarHBondContact O-OG 3.31Å; T175-V179 WeakPolarHBondContact O-CG2 3.46Å; T175-V179 PolarHBondContact O-N 3.08Å
176	C	57.8	Low	61.4	Low	28 Å²	28	91.2 Å²	91.2	19%	0.189	50%	0.497	C	S	.	.	H	α-helix	trans	-63.2	-43.2	172.6	-73.3	0	0	0	0	112	F158 V172 S178 V179 T180	F158-C176 HydrophobicContact CD2-CB 4.29Å; F158-C176 HydrophobicContact CE2-CB 4.24Å; V172-C176 VanDerWaalsContact O-CB 3.24Å; V172-C176 WeakPolarHBondContact O-CB 3.31Å; V172-C176 PolarHBondContact O-N 3.08Å; V172-C176 PolarHBondContact O-SG 2.84Å; C176-S178 VanDerWaalsContact C-N 3.31Å; C176-S178 PolarHBondContact O-N 3.14Å; C176-V179 PolarHBondContact O-N 3.2Å; C176-V179 VanDerWaalsContact O-N 3.13Å; C176-T180 WeakPolarHBondContact O-CG2 3.32Å; C176-T180 PolarHBondContact O-N 3.29Å; C176-T180 PolarHBondContact O-OG1 2.9Å
177	L	65	Low	61.7	Low	94 Å²	94	88.2 Å²	88.2	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-61	-37.7	172.2	-81.8	161.7	0	0	0	112.1	T173 G174 V179 T180 T181	T173-L177 HydrophobicContact CG2-CD1 4.09Å; T173-L177 VanDerWaalsContact O-CB 3.3Å; T173-L177 WeakPolarHBondContact O-CB 3.31Å; T173-L177 WeakPolarHBondContact O-CD1 3.41Å; T173-L177 VanDerWaalsContact O-CG 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.31Å; T173-L177 PolarHBondContact O-N 3.44Å; G174-L177 PolarHBondContact O-N 3.37Å; L177-V179 VanDerWaalsContact C-N 3.33Å; L177-T180 WeakPolarHBondContact CA-OG1 3.28Å; L177-T180 PolarHBondContact O-OG1 3.3Å; L177-T180 VanDerWaalsContact O-OG1 3.06Å; L177-T181 VanDerWaalsContact O-CB 3.23Å; L177-T181 WeakPolarHBondContact O-CB 3.44Å; L177-T181 PolarHBondContact O-N 3.27Å; L177-T181 PolarHBondContact O-OG1 3.31Å
178	S	64.1	Low	61.8	Low	66 Å²	66	86.2 Å²	86.2	46%	0.462	47%	0.466	S	S	.	.	H	α-helix	trans	-65.9	-36.9	174	80.7	0	0	0	0	112	G174 T175 C176 F182	G174-S178 PolarHBondContact O-N 3.17Å; T175-S178 PolarHBondContact O-N 3.28Å; T175-S178 PolarHBondContact O-OG 3.31Å; C176-S178 VanDerWaalsContact C-N 3.31Å; C176-S178 PolarHBondContact O-N 3.14Å; S178-F182 WeakPolarHBondContact O-CB 3.48Å; S178-F182 PolarHBondContact O-N 3.14Å
179	V	67.4	Low	61.9	Low	78 Å²	78	79.4 Å²	79.4	47%	0.473	45%	0.446	S	S	.	.	H	α-helix	trans	-73.1	-40	179.4	170.8	0	0	0	0	111	T175 C176 L177 F182 N183	T175-V179 WeakPolarHBondContact O-CG2 3.46Å; T175-V179 PolarHBondContact O-N 3.08Å; C176-V179 PolarHBondContact O-N 3.2Å; C176-V179 VanDerWaalsContact O-N 3.13Å; L177-V179 VanDerWaalsContact C-N 3.33Å; V179-F182 PolarHBondContact O-N 3.21Å; V179-N183 WeakPolarHBondContact O-CB 3.26Å; V179-N183 PolarHBondContact O-N 3.26Å; V179-N183 PolarHBondContact O-ND2 2.84Å
180	T	66.4	Low	62	Low	56 Å²	56	81.6 Å²	81.6	34%	0.344	45%	0.446	S	S	.	.	H	α-helix	trans	-68.2	-39.2	174.7	55.3	0	0	0	0	111.4	C176 L177 N183 A184	C176-T180 WeakPolarHBondContact O-CG2 3.32Å; C176-T180 PolarHBondContact O-N 3.29Å; C176-T180 PolarHBondContact O-OG1 2.9Å; L177-T180 WeakPolarHBondContact CA-OG1 3.28Å; L177-T180 PolarHBondContact O-OG1 3.3Å; L177-T180 VanDerWaalsContact O-OG1 3.06Å; T180-N183 PolarHBondContact O-N 2.88Å; T180-A184 WeakPolarHBondContact O-CB 3.15Å; T180-A184 PolarHBondContact O-N 2.84Å
181	T	65.7	Low	61.7	Low	91 Å²	91	78 Å²	78	56%	0.558	43%	0.429	S	S	*	.	H	α-helix	trans	-64.9	-41	173.9	-55	0	0	0	0	111.1	L177 A184 Y185	L177-T181 VanDerWaalsContact O-CB 3.23Å; L177-T181 WeakPolarHBondContact O-CB 3.44Å; L177-T181 PolarHBondContact O-N 3.27Å; L177-T181 PolarHBondContact O-OG1 3.31Å; T181-A184 PolarHBondContact O-N 3.42Å; T181-Y185 WeakPolarHBondContact O-CB 3.18Å; T181-Y185 PolarHBondContact O-N 2.96Å
182	F	65.2	Low	61.3	Low	122 Å²	122	81.4 Å²	81.4	54%	0.535	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-40.8	174.4	-176.4	-103.3	0	0	0	111.9	S178 V179 Y185 L186	S178-F182 WeakPolarHBondContact O-CB 3.48Å; S178-F182 PolarHBondContact O-N 3.14Å; V179-F182 PolarHBondContact O-N 3.21Å; F182-Y185 WeakPolarHBondContact O-CB 3.05Å; F182-Y185 PolarHBondContact O-N 3.48Å; F182-L186 HydrophobicContact CD1-CD1 3.79Å; F182-L186 HydrophobicContact CD1-CG 4.17Å; F182-L186 HydrophobicContact CE1-CD1 3.37Å; F182-L186 HydrophobicContact CE1-CD2 4.41Å; F182-L186 HydrophobicContact CE1-CG 3.86Å; F182-L186 HydrophobicContact CZ-CD1 4.03Å; F182-L186 HydrophobicContact CZ-CD2 4.24Å; F182-L186 HydrophobicContact CZ-CG 4.11Å; F182-L186 WeakPolarHBondContact O-CB 3.29Å; F182-L186 WeakPolarHBondContact O-CG 3.33Å; F182-L186 PolarHBondContact O-N 2.83Å
183	N	62.6	Low	60.7	Low	56 Å²	56	84.3 Å²	84.3	30%	0.299	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-39.8	174	-80.5	-31.6	0	0	0	112.2	V179 T180 Y185 L186 D187	V179-N183 WeakPolarHBondContact O-CB 3.26Å; V179-N183 PolarHBondContact O-N 3.26Å; V179-N183 PolarHBondContact O-ND2 2.84Å; T180-N183 PolarHBondContact O-N 2.88Å; N183-Y185 VanDerWaalsContact C-N 3.32Å; N183-L186 PolarHBondContact O-N 3.29Å; N183-D187 PolarHBondContact O-N 3.32Å
184	A	62.4	Low	60	Low	53 Å²	53	84.9 Å²	84.9	44%	0.438	45%	0.451	S	S	.	.	H	α-helix	trans	-64.2	-38.9	173.5	0	0	0	0	0	111.6	T180 T181 D187 L188	T180-A184 WeakPolarHBondContact O-CB 3.15Å; T180-A184 PolarHBondContact O-N 2.84Å; T181-A184 PolarHBondContact O-N 3.42Å; A184-D187 PolarHBondContact O-N 3.19Å; A184-L188 WeakPolarHBondContact O-CG 3.34Å; A184-L188 PolarHBondContact O-N 3.11Å
185	Y	62.1	Low	59.2	Low	160 Å²	160	86.1 Å²	86.1	63%	0.627	45%	0.446	S	S	*	.	H	α-helix	trans	-65.7	-39.5	173.2	-170	-92.6	0	0	0	112	T181 F182 N183 L188 A189	T181-Y185 WeakPolarHBondContact O-CB 3.18Å; T181-Y185 PolarHBondContact O-N 2.96Å; F182-Y185 WeakPolarHBondContact O-CB 3.05Å; F182-Y185 PolarHBondContact O-N 3.48Å; N183-Y185 VanDerWaalsContact C-N 3.32Å; Y185-L188 PolarHBondContact O-N 2.95Å; Y185-A189 VanDerWaalsContact O-CB 3.3Å; Y185-A189 WeakPolarHBondContact O-CB 3.39Å; Y185-A189 PolarHBondContact O-N 3.05Å
186	L	60.7	Low	58.3	Low	78 Å²	78	85.6 Å²	85.6	41%	0.408	45%	0.445	S	S	.	.	H	α-helix	trans	-66.8	-36.8	173.8	-77.9	-179.1	0	0	0	112.3	F182 N183 A189 R190	F182-L186 HydrophobicContact CD1-CD1 3.79Å; F182-L186 HydrophobicContact CD1-CG 4.17Å; F182-L186 HydrophobicContact CE1-CD1 3.37Å; F182-L186 HydrophobicContact CE1-CD2 4.41Å; F182-L186 HydrophobicContact CE1-CG 3.86Å; F182-L186 HydrophobicContact CZ-CD1 4.03Å; F182-L186 HydrophobicContact CZ-CD2 4.24Å; F182-L186 HydrophobicContact CZ-CG 4.11Å; F182-L186 WeakPolarHBondContact O-CB 3.29Å; F182-L186 WeakPolarHBondContact O-CG 3.33Å; F182-L186 PolarHBondContact O-N 2.83Å; N183-L186 PolarHBondContact O-N 3.29Å; L186-A189 CarbonylContact O-C 3.57Å; L186-A189 PolarHBondContact O-N 3.41Å; L186-R190 WeakPolarHBondContact O-CB 2.9Å; L186-R190 PolarHBondContact O-N 3.44Å
187	D	60.2	Low	57.7	Low	38 Å²	38	86.8 Å²	86.8	20%	0.203	45%	0.446	C	S	.	.	H	α-helix	trans	-66.2	-43.6	173.5	-88.7	-6.9	0	0	0	110.7	K151 N183 A184 A189 R190 D191	K151-D187 WeakPolarHBondContact CE-OD2 3.39Å; K151-D187 IonicContact NZ-OD2 3.56Å; K151-D187 PolarHBondContact NZ-OD2 2.93Å; N183-D187 PolarHBondContact O-N 3.32Å; A184-D187 PolarHBondContact O-N 3.19Å; D187-A189 VanDerWaalsContact C-N 3.29Å; D187-A189 PolarHBondContact O-N 2.93Å; D187-R190 PolarHBondContact O-N 3.49Å; D187-D191 WeakPolarHBondContact O-CB 3.4Å; D187-D191 PolarHBondContact O-N 3.15Å
188	L	61.1	Low	56.5	Low	112 Å²	112	86 Å²	86	59%	0.586	44%	0.44	S	S	*	.	H	α-helix	trans	-61.4	-37.3	172.2	-77.9	167.6	0	0	0	112.4	A184 Y185 R192	A184-L188 WeakPolarHBondContact O-CG 3.34Å; A184-L188 PolarHBondContact O-N 3.11Å; Y185-L188 PolarHBondContact O-N 2.95Å; L188-R192 WeakPolarHBondContact O-CG 3.24Å; L188-R192 PolarHBondContact O-N 3.36Å
189	A	56.6	Low	55.3	Low	31 Å²	31	88.8 Å²	88.8	26%	0.256	44%	0.444	S	S	.	.	H	α-helix	trans	-71.5	-37.8	175.2	0	0	0	0	0	111.6	Y185 L186 D187 R192 L193	Y185-A189 VanDerWaalsContact O-CB 3.3Å; Y185-A189 WeakPolarHBondContact O-CB 3.39Å; Y185-A189 PolarHBondContact O-N 3.05Å; L186-A189 CarbonylContact O-C 3.57Å; L186-A189 PolarHBondContact O-N 3.41Å; D187-A189 VanDerWaalsContact C-N 3.29Å; D187-A189 PolarHBondContact O-N 2.93Å; A189-R192 WeakPolarHBondContact O-CB 3.29Å; A189-R192 PolarHBondContact O-N 2.88Å; A189-L193 WeakPolarHBondContact O-CB 3.37Å; A189-L193 WeakPolarHBondContact O-CD1 3.37Å; A189-L193 VanDerWaalsContact O-CG 3.24Å; A189-L193 WeakPolarHBondContact O-CG 3.31Å; A189-L193 PolarHBondContact O-N 2.88Å
190	R	57.9	Low	54	Low	156 Å²	156	87 Å²	87	59%	0.589	44%	0.435	S	S	*	.	H	α-helix	trans	-68	-42.6	176.7	-178.4	177.9	-89.1	156	-9.7	110.6	L186 D187 R192 L193 S194	L186-R190 WeakPolarHBondContact O-CB 2.9Å; L186-R190 PolarHBondContact O-N 3.44Å; D187-R190 PolarHBondContact O-N 3.49Å; R190-R192 PolarHBondContact O-N 3.47Å; R190-L193 CarbonylContact O-C 3.46Å; R190-L193 WeakPolarHBondContact O-CA 3.33Å; R190-L193 PolarHBondContact O-N 3.4Å; R190-S194 WeakPolarHBondContact O-CB 3.34Å; R190-S194 PolarHBondContact O-N 3.37Å; R190-S194 PolarHBondContact O-OG 3.21Å; R190-S194 VanDerWaalsContact O-OG 3.05Å
191	D	55.1	Low	52.9	Low	76 Å²	76	86.3 Å²	86.3	41%	0.406	43%	0.429	S	S	.	.	H	α-helix	trans	-62.6	-30.4	174.1	-77.4	-3.2	0	0	0	111.9	D187 S194	D187-D191 WeakPolarHBondContact O-CB 3.4Å; D187-D191 PolarHBondContact O-N 3.15Å; D191-S194 WeakPolarHBondContact CA-OG 3.19Å
192	R	50.9	Low	51.6	Low	213 Å²	213	88.9 Å²	88.9	80%	0.804	43%	0.43	S	S	*	.	H	α-helix	trans	-74.1	-28.3	170.5	-74.7	-175.5	-172.2	-140	4.2	113.6	L188 A189 R190	L188-R192 WeakPolarHBondContact O-CG 3.24Å; L188-R192 PolarHBondContact O-N 3.36Å; A189-R192 WeakPolarHBondContact O-CB 3.29Å; A189-R192 PolarHBondContact O-N 2.88Å; R190-R192 PolarHBondContact O-N 3.47Å
193	L	46.5	Very low	50.5	Low	103 Å²	103	86.7 Å²	86.7	54%	0.539	43%	0.429	S	S	.	.	H	α-helix	trans	-93.3	-23.9	-178.7	-70.5	162.6	0	0	0	112.9	A189 R190 E195 F199	A189-L193 WeakPolarHBondContact O-CB 3.37Å; A189-L193 WeakPolarHBondContact O-CD1 3.37Å; A189-L193 VanDerWaalsContact O-CG 3.24Å; A189-L193 WeakPolarHBondContact O-CG 3.31Å; A189-L193 PolarHBondContact O-N 2.88Å; R190-L193 CarbonylContact O-C 3.46Å; R190-L193 WeakPolarHBondContact O-CA 3.33Å; R190-L193 PolarHBondContact O-N 3.4Å; L193-E195 VanDerWaalsContact C-N 3.28Å; L193-E195 PolarHBondContact O-N 2.9Å; L193-F199 HydrophobicContact CB-CE2 4.48Å; L193-F199 HydrophobicContact CD2-CE2 3.59Å; L193-F199 HydrophobicContact CD2-CZ 4.18Å
194	S	45.8	Very low	49.5	Very low	58 Å²	58	85.5 Å²	85.5	41%	0.406	43%	0.425	S	S	.	.			trans	-84.4	4.5	-179	67.5	0	0	0	0	113	R190 D191 P196	R190-S194 WeakPolarHBondContact O-CB 3.34Å; R190-S194 PolarHBondContact O-N 3.37Å; R190-S194 PolarHBondContact O-OG 3.21Å; R190-S194 VanDerWaalsContact O-OG 3.05Å; D191-S194 WeakPolarHBondContact CA-OG 3.19Å; S194-P196 WeakPolarHBondContact O-CD 3.26Å; S194-P196 WeakPolarHBondContact O-CG 3.49Å
195	E	46.6	Very low	48.4	Very low	63 Å²	63	90.1 Å²	90.1	29%	0.294	43%	0.431	S	S	.	.			trans	-66.7	94.4	157.9	-77.5	-154.5	169.6	0	0	108	K52 L193 Y197 M198 F199	K52-E195 VanDerWaalsContact CE-OE1 3.31Å; K52-E195 WeakPolarHBondContact CE-OE1 3.43Å; K52-E195 IonicContact NZ-OE1 3.57Å; K52-E195 PolarHBondContact NZ-OE1 3.03Å; K52-E195 IonicContact NZ-OE2 2.81Å; K52-E195 PolarHBondContact NZ-OE2 3.4Å; L193-E195 VanDerWaalsContact C-N 3.28Å; L193-E195 PolarHBondContact O-N 2.9Å; E195-Y197 PolarHBondContact O-N 3.25Å; E195-M198 HydrophobicContact CB-CB 3.89Å; E195-M198 HydrophobicContact CB-CG 4.29Å; E195-M198 PolarHBondContact O-N 2.94Å; E195-M198 WeakPolarHBondContact OE2-CG 3.31Å; E195-F199 PolarHBondContact O-N 3.4Å
196	P	45	Very low	47.5	Very low	66 Å²	66	90.9 Å²	90.9	43%	0.429	44%	0.438	S	S	.	.	H	α-helix	trans	-67.2	-18.5	-175.9	-8.1	28.7	0	0	0	110	F139 S194 S200	F139-P196 HydrophobicContact CE1-CG 3.97Å; S194-P196 WeakPolarHBondContact O-CD 3.26Å; S194-P196 WeakPolarHBondContact O-CG 3.49Å; P196-S200 PolarHBondContact O-N 3.31Å
197	Y	45.4	Very low	46.6	Very low	53 Å²	53	90.7 Å²	90.7	21%	0.208	44%	0.443	C	S	.	.	H	α-helix	trans	-78.9	-29	177.4	-52.6	-70.9	0	0	0	112.6	A48 E195 I201	A48-Y197 HydrophobicContact CB-CD1 4.12Å; A48-Y197 HydrophobicContact CB-CD2 3.98Å; A48-Y197 HydrophobicContact CB-CE1 4.24Å; A48-Y197 HydrophobicContact CB-CE2 4.11Å; A48-Y197 HydrophobicContact CB-CG 3.99Å; E195-Y197 PolarHBondContact O-N 3.25Å; Y197-I201 VanDerWaalsContact O-CD1 3.26Å; Y197-I201 WeakPolarHBondContact O-CD1 3.47Å; Y197-I201 WeakPolarHBondContact O-CG1 3.38Å; Y197-I201 PolarHBondContact O-N 3.44Å
198	M	38.8	Very low	45.8	Very low	77 Å²	77	94 Å²	94	38%	0.379	45%	0.453	S	S	.	.	H	α-helix	trans	-78.6	-34.3	175.1	-93.9	-81.2	-100.9	0	0	112.3	E195 S200 I201 Y202	E195-M198 HydrophobicContact CB-CB 3.89Å; E195-M198 HydrophobicContact CB-CG 4.29Å; E195-M198 PolarHBondContact O-N 2.94Å; E195-M198 WeakPolarHBondContact OE2-CG 3.31Å; M198-S200 VanDerWaalsContact C-N 3.34Å; M198-I201 PolarHBondContact O-N 2.83Å; M198-Y202 HydrophobicContact CE-CD2 4.36Å; M198-Y202 HydrophobicContact CE-CE2 3.68Å; M198-Y202 WeakPolarHBondContact O-CB 3.4Å; M198-Y202 WeakPolarHBondContact O-CD2 3.5Å; M198-Y202 PolarHBondContact O-N 3.5Å; M198-Y202 HydrophobicContact SD-CD2 4Å; M198-Y202 HydrophobicContact SD-CE2 3.79Å
199	F	38.2	Very low	45	Very low	125 Å²	125	96.6 Å²	96.6	55%	0.548	46%	0.457	S	S	.	.	H	α-helix	trans	-67.1	-35.2	175	-111.6	-82.3	0	0	0	112.6	L193 E195 S203	L193-F199 HydrophobicContact CB-CE2 4.48Å; L193-F199 HydrophobicContact CD2-CE2 3.59Å; L193-F199 HydrophobicContact CD2-CZ 4.18Å; E195-F199 PolarHBondContact O-N 3.4Å; F199-S203 WeakPolarHBondContact O-CB 3.32Å; F199-S203 PolarHBondContact O-N 2.97Å; F199-S203 PolarHBondContact O-OG 3.38Å
200	S	41.2	Very low	44.5	Very low	41 Å²	41	103.4 Å²	103.4	29%	0.287	48%	0.477	S	S	.	.	H	α-helix	trans	-61.4	-45.3	169	165.9	0	0	0	0	111.7	P196 M198 S204	P196-S200 PolarHBondContact O-N 3.31Å; M198-S200 VanDerWaalsContact C-N 3.34Å; S200-S204 VanDerWaalsContact O-CB 3.24Å; S200-S204 WeakPolarHBondContact O-CB 3.49Å; S200-S204 PolarHBondContact O-N 2.9Å; S200-S204 PolarHBondContact O-OG 3.47Å
201	I	43.4	Very low	44.1	Very low	41 Å²	41	102.9 Å²	102.9	21%	0.21	48%	0.479	C	S	.	.	H	α-helix	trans	-67.8	-37.6	179.2	-67.4	165.8	0	0	0	111.6	L36 Y197 M198 R205	L36-I201 HydrophobicContact CD2-CD1 4.18Å; Y197-I201 VanDerWaalsContact O-CD1 3.26Å; Y197-I201 WeakPolarHBondContact O-CD1 3.47Å; Y197-I201 WeakPolarHBondContact O-CG1 3.38Å; Y197-I201 PolarHBondContact O-N 3.44Å; M198-I201 PolarHBondContact O-N 2.83Å; I201-R205 WeakPolarHBondContact O-CB 3.28Å; I201-R205 VanDerWaalsContact O-CG 3.29Å; I201-R205 WeakPolarHBondContact O-CG 3.4Å; I201-R205 PolarHBondContact O-N 2.96Å
202	Y	37.5	Very low	43.9	Very low	145 Å²	145	102.4 Å²	102.4	57%	0.569	48%	0.482	S	S	*	.	H	α-helix	trans	-76.7	-36.7	178.7	-94.7	-86.5	0	0	0	113.3	M198 K206	M198-Y202 HydrophobicContact CE-CD2 4.36Å; M198-Y202 HydrophobicContact CE-CE2 3.68Å; M198-Y202 WeakPolarHBondContact O-CB 3.4Å; M198-Y202 WeakPolarHBondContact O-CD2 3.5Å; M198-Y202 PolarHBondContact O-N 3.5Å; M198-Y202 HydrophobicContact SD-CD2 4Å; M198-Y202 HydrophobicContact SD-CE2 3.79Å; Y202-K206 PolarHBondContact O-N 3.23Å
203	S	42.8	Very low	43.9	Very low	75 Å²	75	95 Å²	95	52%	0.524	46%	0.461	S	S	.	.	H	α-helix	trans	-71.8	-38.7	175.6	89.5	0	0	0	0	111.3	F199 K206 S207	F199-S203 WeakPolarHBondContact O-CB 3.32Å; F199-S203 PolarHBondContact O-N 2.97Å; F199-S203 PolarHBondContact O-OG 3.38Å; S203-K206 PolarHBondContact O-N 3.28Å; S203-S207 PolarHBondContact O-N 3.34Å; S203-S207 VanDerWaalsContact O-N 3.11Å
204	S	40.5	Very low	44.3	Very low	31 Å²	31	96.4 Å²	96.4	22%	0.217	46%	0.462	C	S	.	.	H	α-helix	trans	-66.3	-38.7	173	-77.2	0	0	0	0	112.4	S200 K206 S207 Y208	S200-S204 VanDerWaalsContact O-CB 3.24Å; S200-S204 WeakPolarHBondContact O-CB 3.49Å; S200-S204 PolarHBondContact O-N 2.9Å; S200-S204 PolarHBondContact O-OG 3.47Å; S204-K206 PolarHBondContact O-N 3.34Å; S204-S207 PolarHBondContact O-N 3.21Å; S204-Y208 PolarHBondContact O-N 3.49Å
205	R	41	Very low	44.4	Very low	151 Å²	151	99.7 Å²	99.7	57%	0.57	47%	0.471	S	S	*	.	H	α-helix	trans	-61.1	-43.4	173.8	-84.3	-177.5	176.1	-160.5	-1.2	112.2	I201 S207 Y208 Y209	I201-R205 WeakPolarHBondContact O-CB 3.28Å; I201-R205 VanDerWaalsContact O-CG 3.29Å; I201-R205 WeakPolarHBondContact O-CG 3.4Å; I201-R205 PolarHBondContact O-N 2.96Å; R205-S207 VanDerWaalsContact C-N 3.3Å; R205-S207 PolarHBondContact O-N 3.35Å; R205-Y208 PolarHBondContact O-N 2.84Å; R205-Y209 VanDerWaalsContact O-CD2 3.28Å; R205-Y209 WeakPolarHBondContact O-CD2 3.27Å; R205-Y209 PolarHBondContact O-N 2.98Å
206	K	42.4	Very low	44.4	Very low	175 Å²	175	99.5 Å²	99.5	76%	0.761	48%	0.477	S	S	*	.	H	α-helix	trans	-61.9	-38.1	174.7	-87.2	-172.9	175.9	-179.9	0	112.3	Y202 S203 S204 Y210	Y202-K206 PolarHBondContact O-N 3.23Å; S203-K206 PolarHBondContact O-N 3.28Å; S204-K206 PolarHBondContact O-N 3.34Å; K206-Y210 WeakPolarHBondContact O-CB 3.41Å; K206-Y210 PolarHBondContact O-N 3.3Å; K206-Y210 VanDerWaalsContact O-N 3.15Å
207	S	42.8	Very low	44.7	Very low	75 Å²	75	104.9 Å²	104.9	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-69.1	-41.4	177.1	-163.2	0	0	0	0	112.4	S203 S204 R205 Y210 K211	S203-S207 PolarHBondContact O-N 3.34Å; S203-S207 VanDerWaalsContact O-N 3.11Å; S204-S207 PolarHBondContact O-N 3.21Å; R205-S207 VanDerWaalsContact C-N 3.3Å; R205-S207 PolarHBondContact O-N 3.35Å; S207-Y210 PolarHBondContact O-N 2.97Å; S207-K211 WeakPolarHBondContact O-CB 3.18Å; S207-K211 PolarHBondContact O-N 3.07Å
208	Y	43.2	Very low	45.2	Very low	106 Å²	106	106.4 Å²	106.4	42%	0.416	50%	0.499	S	S	.	.	H	α-helix	trans	-67.4	-41.6	177.2	-98.5	-99.6	0	0	0	113.1	E38 S204 R205 Y210 K211 S212	E38-Y208 VanDerWaalsContact CD-OH 3.24Å; E38-Y208 PolarHBondContact OE2-OH 2.82Å; S204-Y208 PolarHBondContact O-N 3.49Å; R205-Y208 PolarHBondContact O-N 2.84Å; Y208-Y210 VanDerWaalsContact C-N 3.28Å; Y208-Y210 PolarHBondContact O-N 3.38Å; Y208-K211 PolarHBondContact O-N 3.07Å; Y208-S212 WeakPolarHBondContact O-CB 3.46Å; Y208-S212 PolarHBondContact O-N 3.22Å
209	Y	43.1	Very low	45.8	Very low	167 Å²	167	109 Å²	109	66%	0.655	51%	0.512	S	S	*	.	H	α-helix	trans	-64.1	-36	174.2	-87.8	-77.5	0	0	0	111.6	R205 T213	R205-Y209 VanDerWaalsContact O-CD2 3.28Å; R205-Y209 WeakPolarHBondContact O-CD2 3.27Å; R205-Y209 PolarHBondContact O-N 2.98Å; Y209-T213 WeakPolarHBondContact O-CB 3.37Å; Y209-T213 PolarHBondContact O-N 2.96Å; Y209-T213 VanDerWaalsContact O-N 3.09Å; Y209-T213 PolarHBondContact O-OG1 3.2Å
210	Y	46.8	Very low	46.4	Very low	174 Å²	174	107.9 Å²	107.9	68%	0.682	51%	0.512	S	S	*	.	H	α-helix	trans	-71	-34.6	175.5	-156.2	-98.7	0	0	0	112.5	K206 S207 Y208 T213 K214	K206-Y210 WeakPolarHBondContact O-CB 3.41Å; K206-Y210 PolarHBondContact O-N 3.3Å; K206-Y210 VanDerWaalsContact O-N 3.15Å; S207-Y210 PolarHBondContact O-N 2.97Å; Y208-Y210 VanDerWaalsContact C-N 3.28Å; Y208-Y210 PolarHBondContact O-N 3.38Å; Y210-T213 PolarHBondContact O-OG1 2.81Å; Y210-K214 VanDerWaalsContact O-CB 3.29Å; Y210-K214 WeakPolarHBondContact O-CB 3.41Å; Y210-K214 PolarHBondContact O-N 3Å
211	K	49.3	Very low	47	Very low	145 Å²	145	108.2 Å²	108.2	63%	0.63	51%	0.514	S	S	*	.	H	α-helix	trans	-76.1	-40.9	178.5	-143.1	175.5	-175.2	-174.8	0	111.8	S207 Y208 K214 Q215	S207-K211 WeakPolarHBondContact O-CB 3.18Å; S207-K211 PolarHBondContact O-N 3.07Å; Y208-K211 PolarHBondContact O-N 3.07Å; K211-K214 PolarHBondContact O-N 3.03Å; K211-Q215 PolarHBondContact O-N 2.94Å
212	S	49.9	Very low	47.2	Very low	66 Å²	66	110.5 Å²	110.5	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-71.8	-37.3	178.2	96.3	0	0	0	0	112.4	Y208 K214 Q215 S216	Y208-S212 WeakPolarHBondContact O-CB 3.46Å; Y208-S212 PolarHBondContact O-N 3.22Å; S212-K214 VanDerWaalsContact C-N 3.28Å; S212-K214 PolarHBondContact O-N 3.47Å; S212-Q215 PolarHBondContact O-N 2.6Å; S212-S216 PolarHBondContact O-N 3.5Å
213	T	52.8	Low	47.8	Very low	59 Å²	59	109.2 Å²	109.2	36%	0.362	53%	0.529	S	S	.	.	H	α-helix	trans	-70.4	-23.6	172.4	45.6	0	0	0	0	113.3	Y209 Y210 R217	Y209-T213 WeakPolarHBondContact O-CB 3.37Å; Y209-T213 PolarHBondContact O-N 2.96Å; Y209-T213 VanDerWaalsContact O-N 3.09Å; Y209-T213 PolarHBondContact O-OG1 3.2Å; Y210-T213 PolarHBondContact O-OG1 2.81Å; T213-R217 WeakPolarHBondContact O-CB 3.46Å; T213-R217 PolarHBondContact O-N 3.46Å; T213-R217 PolarHBondContact O-NE 2.99Å
214	K	52.8	Low	48.2	Very low	131 Å²	131	109.9 Å²	109.9	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-78.7	-36.4	171.4	-156.5	176	-173.8	-175.6	0	111.4	Y210 K211 S212 I218	Y210-K214 VanDerWaalsContact O-CB 3.29Å; Y210-K214 WeakPolarHBondContact O-CB 3.41Å; Y210-K214 PolarHBondContact O-N 3Å; K211-K214 PolarHBondContact O-N 3.03Å; S212-K214 VanDerWaalsContact C-N 3.28Å; S212-K214 PolarHBondContact O-N 3.47Å; K214-I218 HydrophobicContact CG-CD1 4.41Å; K214-I218 WeakPolarHBondContact O-CD1 3.4Å; K214-I218 WeakPolarHBondContact O-CG1 3.28Å; K214-I218 PolarHBondContact O-N 3.01Å; K214-I218 VanDerWaalsContact O-N 3.14Å
215	Q	49.7	Very low	48.9	Very low	128 Å²	128	114.3 Å²	114.3	60%	0.598	55%	0.553	S	S	*	*	H	α-helix	trans	-71.1	-39.4	174.8	-111.4	168	-28.9	0	0	113.1	K211 S212 I218 M219	K211-Q215 PolarHBondContact O-N 2.94Å; S212-Q215 PolarHBondContact O-N 2.6Å; Q215-I218 PolarHBondContact O-N 2.97Å; Q215-M219 PolarHBondContact O-N 2.72Å
216	S	45.6	Very low	49.2	Very low	59 Å²	59	114.4 Å²	114.4	41%	0.413	56%	0.564	S	S	.	*	H	α-helix	trans	-64.9	-42	174	112.4	0	0	0	0	110.8	S212 I218 M219 D220	S212-S216 PolarHBondContact O-N 3.5Å; S216-I218 VanDerWaalsContact C-N 3.28Å; S216-I218 PolarHBondContact O-N 3.41Å; S216-M219 PolarHBondContact O-N 3.08Å; S216-D220 WeakPolarHBondContact O-CB 3.34Å; S216-D220 VanDerWaalsContact O-CG 3.24Å; S216-D220 PolarHBondContact O-N 2.52Å
217	R	52.3	Low	49	Very low	178 Å²	178	111 Å²	111	67%	0.672	56%	0.563	S	S	*	*	H	α-helix	trans	-62.7	-31.1	174.9	-88.7	-171.2	-96.8	-170.4	-9.7	113.9	T213 S221	T213-R217 WeakPolarHBondContact O-CB 3.46Å; T213-R217 PolarHBondContact O-N 3.46Å; T213-R217 PolarHBondContact O-NE 2.99Å; R217-S221 WeakPolarHBondContact O-CB 3.11Å; R217-S221 PolarHBondContact O-N 3Å; R217-S221 VanDerWaalsContact O-N 3.08Å; R217-S221 PolarHBondContact O-OG 2.83Å
218	I	55.9	Low	49	Very low	85 Å²	85	112.2 Å²	112.2	44%	0.436	57%	0.569	S	S	.	*	H	α-helix	trans	-77.6	-35.4	176.2	-67	164	0	0	0	111.3	K214 Q215 S216 S221 N222	K214-I218 HydrophobicContact CG-CD1 4.41Å; K214-I218 WeakPolarHBondContact O-CD1 3.4Å; K214-I218 WeakPolarHBondContact O-CG1 3.28Å; K214-I218 PolarHBondContact O-N 3.01Å; K214-I218 VanDerWaalsContact O-N 3.14Å; Q215-I218 PolarHBondContact O-N 2.97Å; S216-I218 VanDerWaalsContact C-N 3.28Å; S216-I218 PolarHBondContact O-N 3.41Å; I218-S221 WeakPolarHBondContact CA-OG 3.31Å; I218-S221 PolarHBondContact O-OG 3.24Å; I218-N222 WeakPolarHBondContact O-CB 3.47Å; I218-N222 VanDerWaalsContact O-CG 3.28Å; I218-N222 PolarHBondContact O-N 3.4Å; I218-N222 VanDerWaalsContact O-N 3.08Å; I218-N222 PolarHBondContact O-ND2 3.39Å
219	M	50.3	Low	48.9	Very low	133 Å²	133	118.7 Å²	118.7	66%	0.655	61%	0.61	S	S	*	*	H	α-helix	trans	-69.1	-42	173.2	-81.6	-174.9	166.4	0	0	111.8	Q215 S216 S221 N222 I223	Q215-M219 PolarHBondContact O-N 2.72Å; S216-M219 PolarHBondContact O-N 3.08Å; M219-S221 PolarHBondContact O-N 3.2Å; M219-N222 PolarHBondContact O-N 2.89Å; M219-I223 VanDerWaalsContact O-CG1 3.28Å; M219-I223 WeakPolarHBondContact O-CG1 3.39Å; M219-I223 PolarHBondContact O-N 3.02Å
220	D	50.8	Low	49.2	Very low	100 Å²	100	116.3 Å²	116.3	54%	0.535	61%	0.608	S	S	.	*	H	α-helix	trans	-66.4	-37.1	176.8	-66	-30.2	0	0	0	111.5	S216 S224	S216-D220 WeakPolarHBondContact O-CB 3.34Å; S216-D220 VanDerWaalsContact O-CG 3.24Å; S216-D220 PolarHBondContact O-N 2.52Å; D220-S224 PolarHBondContact O-N 2.96Å; D220-S224 PolarHBondContact O-OG 2.86Å
221	S	53.6	Low	49.3	Very low	49 Å²	49	113.2 Å²	113.2	34%	0.343	60%	0.604	S	S	.	*	H	α-helix	trans	-68.6	-35	174.7	64.2	0	0	0	0	112.9	R217 I218 M219 S224 I225	R217-S221 WeakPolarHBondContact O-CB 3.11Å; R217-S221 PolarHBondContact O-N 3Å; R217-S221 VanDerWaalsContact O-N 3.08Å; R217-S221 PolarHBondContact O-OG 2.83Å; I218-S221 WeakPolarHBondContact CA-OG 3.31Å; I218-S221 PolarHBondContact O-OG 3.24Å; M219-S221 PolarHBondContact O-N 3.2Å; S221-S224 PolarHBondContact O-OG 3.28Å; S221-I225 WeakPolarHBondContact O-CD1 3.45Å; S221-I225 WeakPolarHBondContact O-CG1 3.48Å
222	N	48.7	Very low	49.3	Very low	88 Å²	88	111.4 Å²	111.4	47%	0.471	60%	0.603	S	S	.	*	H	α-helix	trans	-77.6	-28.4	178.8	-73.9	-19.9	0	0	0	112.9	I218 M219 I225 L226	I218-N222 WeakPolarHBondContact O-CB 3.47Å; I218-N222 VanDerWaalsContact O-CG 3.28Å; I218-N222 PolarHBondContact O-N 3.4Å; I218-N222 VanDerWaalsContact O-N 3.08Å; I218-N222 PolarHBondContact O-ND2 3.39Å; M219-N222 PolarHBondContact O-N 2.89Å; N222-I225 PolarHBondContact O-N 3.04Å; N222-L226 PolarHBondContact O-N 2.85Å
223	I	50.3	Low	49.2	Very low	119 Å²	119	114.1 Å²	114.1	61%	0.61	61%	0.611	S	S	*	*	H	α-helix	trans	-72.7	-31.6	173.4	-67.8	166.8	0	0	0	110.9	M219 I225 L226	M219-I223 VanDerWaalsContact O-CG1 3.28Å; M219-I223 WeakPolarHBondContact O-CG1 3.39Å; M219-I223 PolarHBondContact O-N 3.02Å; I223-I225 VanDerWaalsContact C-N 3.28Å; I223-I225 PolarHBondContact O-N 2.98Å; I223-L226 PolarHBondContact O-N 2.79Å
224	S	51.1	Low	49	Very low	89 Å²	89	117.6 Å²	117.6	62%	0.622	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-12.1	174.3	64.7	0	0	0	0	115.3	D220 S221	D220-S224 PolarHBondContact O-N 2.96Å; D220-S224 PolarHBondContact O-OG 2.86Å; S221-S224 PolarHBondContact O-OG 3.28Å
225	I	54.3	Low	48.8	Very low	124 Å²	124	116.7 Å²	116.7	64%	0.636	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-16.8	178.5	-63.3	166	0	0	0	111.6	S221 N222 I223	S221-I225 WeakPolarHBondContact O-CD1 3.45Å; S221-I225 WeakPolarHBondContact O-CG1 3.48Å; N222-I225 PolarHBondContact O-N 3.04Å; I223-I225 VanDerWaalsContact C-N 3.28Å; I223-I225 PolarHBondContact O-N 2.98Å
226	L	47.6	Very low	48.7	Very low	152 Å²	152	115.9 Å²	115.9	80%	0.796	63%	0.633	S	S	*	*	S	Bend	trans	-98.4	16.8	178.9	-77.8	163.8	0	0	0	114	N222 I223	N222-L226 PolarHBondContact O-N 2.85Å; I223-L226 PolarHBondContact O-N 2.79Å
227	S	38.3	Very low	48.9	Very low	105 Å²	105	120.2 Å²	120.2	73%	0.734	65%	0.65	S	S	*	*			trans	-116.4	90	166	-170.2	0	0	0	0	111.1
228	P	43	Very low	48.7	Very low	99 Å²	99	115.4 Å²	115.4	64%	0.643	65%	0.648	S	S	*	*			trans	-128.7	121.1	150.5	32.9	-18.4	0	0	0	109.8
229	N	40.2	Very low	48	Very low	242 Å²	242	118.2 Å²	118.2	100%	1.294	67%	0.667	S	S	*	*			trans	44.1	0	160.4	-66.4	-29.8	0	0	0	118.6

Retrieved 229 of 229 residues in 59.9 ms (Link to these results)

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