A0A096MD00_POEFO Loading...

Syntaxin 12

AlphaFold DB , UniProt , Accession A0A096MD00, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 204 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	42.3	Very low	44.9	Very low	226 Å²	226	157.3 Å²	157.3	100%	1.113	83%	0.827	S	S	*	*				0	104.8	0	-72.8	166.7	174.4	0	0	107.3
2	S	47.2	Very low	45.9	Very low	121 Å²	121	150.9 Å²	150.9	85%	0.846	81%	0.814	S	S	*	*			trans	-108.5	109.6	179.4	-173.4	0	0	0	0	107.4	G4	S2-G4 PolarHBondContact O-N 3.03Å
3	Y	42	Very low	47.5	Very low	210 Å²	210	149.5 Å²	149.5	82%	0.824	79%	0.79	S	S	*	*			trans	-82.9	105.2	173.6	-71.5	-82.6	0	0	0	107.9	K5	Y3-K5 PolarHBondContact O-N 3.19Å
4	G	46.3	Very low	50	Low	72 Å²	72	146.9 Å²	146.9	74%	0.742	78%	0.777	S	S	*	*			trans	-61.5	121.4	169.1	0	0	0	0	0	109.5	S2 A6	S2-G4 PolarHBondContact O-N 3.03Å; G4-A6 PolarHBondContact O-N 3.26Å
5	K	45.5	Very low	52.5	Low	199 Å²	199	139.1 Å²	139.1	87%	0.865	73%	0.734	S	S	*	*			trans	-60.1	117	168.9	-78.3	-171.9	172.6	-177.9	0	108.3	Y3 E7	Y3-K5 PolarHBondContact O-N 3.19Å; K5-E7 PolarHBondContact O-N 2.99Å
6	A	47.9	Very low	54.8	Low	101 Å²	101	134.8 Å²	134.8	84%	0.835	72%	0.718	S	S	*	*			trans	-66.6	102.2	164.5	0	0	0	0	0	107.7	G4 F8	G4-A6 PolarHBondContact O-N 3.26Å; A6-F8 PolarHBondContact O-N 2.92Å; A6-F8 VanDerWaalsContact O-N 3.11Å
7	E	45.1	Very low	57.1	Low	166 Å²	166	130.6 Å²	130.6	78%	0.776	70%	0.699	S	S	*	*			trans	-63.4	109.9	165.9	-67.8	-166.7	160.3	0	0	107.8	K5 R9	K5-E7 PolarHBondContact O-N 2.99Å; E7-R9 PolarHBondContact O-N 3.08Å
8	F	42.3	Very low	59.1	Low	197 Å²	197	123.6 Å²	123.6	86%	0.864	66%	0.661	S	S	*	*			trans	-69.3	82.6	168.4	-165.3	-93.6	0	0	0	107.6	A6 P10	A6-F8 PolarHBondContact O-N 2.92Å; A6-F8 VanDerWaalsContact O-N 3.11Å; F8-P10 WeakPolarHBondContact O-CD 3.48Å
9	R	41.9	Very low	60.9	Low	202 Å²	202	118.3 Å²	118.3	76%	0.762	63%	0.633	S	S	*	*			trans	-70.6	118	169.3	-167.4	-179.7	-77.2	-151.7	-1.7	106.2	E7 V11	E7-R9 PolarHBondContact O-N 3.08Å; R9-V11 PolarHBondContact O-N 3.27Å; R9-V11 VanDerWaalsContact O-N 3.12Å
10	P	45	Very low	62.7	Low	100 Å²	100	118.9 Å²	118.9	65%	0.649	63%	0.632	S	S	*	*			trans	-55.7	124.9	172.1	-14	25.7	0	0	0	106.8	F8 A12	F8-P10 WeakPolarHBondContact O-CD 3.48Å; P10-A12 PolarHBondContact O-N 3.09Å
11	V	48.5	Very low	64.3	Low	136 Å²	136	115 Å²	115	82%	0.824	61%	0.613	S	S	*	*			trans	-58.2	108.7	173.2	-179.2	0	0	0	0	105.9	R9 R13	R9-V11 PolarHBondContact O-N 3.27Å; R9-V11 VanDerWaalsContact O-N 3.12Å; V11-R13 PolarHBondContact O-N 2.68Å; V11-R13 VanDerWaalsContact O-N 3.1Å
12	A	56.4	Low	66.9	Low	81 Å²	81	104.3 Å²	104.3	67%	0.669	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-56.1	119.8	174.6	0	0	0	0	0	106.7	P10 D14	P10-A12 PolarHBondContact O-N 3.09Å; A12-D14 PolarHBondContact O-N 3.42Å
13	R	66.4	Low	69.3	Low	132 Å²	132	100.8 Å²	100.8	50%	0.498	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-64.5	130.1	-179.6	-68.8	-176.6	-173.7	-167.5	4.8	108.6	V11 L18 H73	V11-R13 PolarHBondContact O-N 2.68Å; V11-R13 VanDerWaalsContact O-N 3.1Å; R13-L18 HydrophobicContact CB-CD1 4.28Å; R13-L18 HydrophobicContact CB-CD2 4.1Å; R13-L18 HydrophobicContact CB-CG 3.96Å; R13-H73 PolarHBondContact NH1-CE1 3.27Å; R13-H73 PolarHBondContact NH1-NE2 2.88Å
14	D	83.5	Confident	71.9	Confident	114 Å²	114	93 Å²	93	61%	0.61	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-66.2	146.3	-179.4	-66.2	-40.4	0	0	0	111.5	A12 S16 T17 L18	A12-D14 PolarHBondContact O-N 3.42Å; D14-S16 PolarHBondContact O-N 3.5Å; D14-T17 PolarHBondContact O-N 3.1Å; D14-L18 PolarHBondContact O-N 3.41Å; D14-L18 VanDerWaalsContact O-N 3.07Å
15	F	87.6	Confident	74.4	Confident	30 Å²	30	90 Å²	90	13%	0.132	48%	0.479	C	S	.	.	H	α-helix	trans	-47.6	-47.4	179.2	-173.8	-93.7	0	0	0	111.9	T17 L18 I19 L77 V80 Q92 R96	F15-T17 PolarHBondContact O-N 2.96Å; F15-L18 PolarHBondContact O-N 3.15Å; F15-I19 HydrophobicContact CD1-CG1 3.88Å; F15-I19 HydrophobicContact CE1-CD1 3.88Å; F15-I19 HydrophobicContact CE1-CG1 3.6Å; F15-I19 HydrophobicContact CZ-CD1 3.9Å; F15-I19 HydrophobicContact CZ-CG1 4.1Å; F15-I19 VanDerWaalsContact O-CG1 3.29Å; F15-I19 WeakPolarHBondContact O-CG1 3.39Å; F15-I19 PolarHBondContact O-N 3.46Å; F15-L77 HydrophobicContact CD2-CD1 3.39Å; F15-L77 HydrophobicContact CD2-CG 4.36Å; F15-L77 HydrophobicContact CE2-CD1 3.43Å; F15-L77 VanDerWaalsContact CE2-CD1 3.43Å; F15-L77 HydrophobicContact CE2-CG 4.03Å; F15-L77 HydrophobicContact CG-CD1 3.98Å; F15-L77 HydrophobicContact CZ-CD1 4.06Å; F15-V80 HydrophobicContact CB-CG1 4.13Å; F15-V80 HydrophobicContact CD2-CB 4.21Å; F15-V80 HydrophobicContact CD2-CG1 4.06Å; F15-Q92 HydrophobicContact CD1-CG 4.27Å; F15-Q92 HydrophobicContact CD2-CG 4.45Å; F15-Q92 HydrophobicContact CE1-CB 4.19Å; F15-Q92 HydrophobicContact CE1-CG 3.8Å; F15-Q92 HydrophobicContact CE2-CB 3.99Å; F15-Q92 HydrophobicContact CE2-CG 4.01Å; F15-Q92 HydrophobicContact CZ-CB 3.61Å; F15-Q92 HydrophobicContact CZ-CG 3.67Å; F15-R96 HydrophobicContact CE2-CG 4.11Å; F15-R96 HydrophobicContact CZ-CG 4.15Å
16	S	89.6	Confident	76.9	Confident	69 Å²	69	81.2 Å²	81.2	48%	0.483	44%	0.441	S	S	.	.	H	α-helix	trans	-60.9	-43.3	-179.3	-173.8	0	0	0	0	112.6	D14 I19 Q20	D14-S16 PolarHBondContact O-N 3.5Å; S16-I19 PolarHBondContact O-N 2.96Å; S16-Q20 WeakPolarHBondContact O-CG 3.41Å; S16-Q20 PolarHBondContact O-N 2.68Å
17	T	92.5	Very high	79.3	Confident	65 Å²	65	83 Å²	83	40%	0.399	43%	0.432	S	S	.	.	H	α-helix	trans	-66.3	-39.7	178.9	-53.2	0	0	0	0	111.5	D14 F15 Q20 T21	D14-T17 PolarHBondContact O-N 3.1Å; F15-T17 PolarHBondContact O-N 2.96Å; T17-Q20 PolarHBondContact O-N 2.71Å; T17-T21 WeakPolarHBondContact O-CB 3.49Å; T17-T21 PolarHBondContact O-N 3.41Å; T17-T21 PolarHBondContact O-OG1 3.48Å
18	L	92.9	Very high	81.9	Confident	3 Å²	3	78.7 Å²	78.7	2%	0.016	41%	0.411	C	S	.	.	H	α-helix	trans	-64.3	-44.2	174.7	-73.4	172.1	0	0	0	111.4	R13 D14 F15 Q20 T21 C22 H73 E76 L77 V80	R13-L18 HydrophobicContact CB-CD1 4.28Å; R13-L18 HydrophobicContact CB-CD2 4.1Å; R13-L18 HydrophobicContact CB-CG 3.96Å; D14-L18 PolarHBondContact O-N 3.41Å; D14-L18 VanDerWaalsContact O-N 3.07Å; F15-L18 PolarHBondContact O-N 3.15Å; L18-Q20 PolarHBondContact O-N 2.84Å; L18-T21 PolarHBondContact O-N 3.43Å; L18-C22 WeakPolarHBondContact O-CB 3.5Å; L18-C22 PolarHBondContact O-N 3.18Å; L18-C22 PolarHBondContact O-SG 3.38Å; L18-H73 HydrophobicContact CD2-CB 4.12Å; L18-E76 HydrophobicContact CD1-CB 4.14Å; L18-E76 HydrophobicContact CD2-CB 4.32Å; L18-E76 WeakPolarHBondContact CD2-OE2 3.49Å; L18-L77 HydrophobicContact CB-CB 4.43Å; L18-L77 HydrophobicContact CB-CD1 3.75Å; L18-L77 HydrophobicContact CD1-CB 4.34Å; L18-L77 HydrophobicContact CD1-CD1 4.32Å; L18-V80 HydrophobicContact CD1-CG2 3.92Å
19	I	94.6	Very high	84.6	Confident	24 Å²	24	69.3 Å²	69.3	12%	0.123	37%	0.369	C	S	.	.	H	α-helix	trans	-55.7	-52.3	174.7	-67.7	-65.2	0	0	0	110.7	F15 S16 T21 C22 S23 L77 Q95 L99	F15-I19 HydrophobicContact CD1-CG1 3.88Å; F15-I19 HydrophobicContact CE1-CD1 3.88Å; F15-I19 HydrophobicContact CE1-CG1 3.6Å; F15-I19 HydrophobicContact CZ-CD1 3.9Å; F15-I19 HydrophobicContact CZ-CG1 4.1Å; F15-I19 VanDerWaalsContact O-CG1 3.29Å; F15-I19 WeakPolarHBondContact O-CG1 3.39Å; F15-I19 PolarHBondContact O-N 3.46Å; S16-I19 PolarHBondContact O-N 2.96Å; I19-T21 VanDerWaalsContact C-N 3.33Å; I19-T21 PolarHBondContact O-N 2.87Å; I19-C22 PolarHBondContact O-N 3.03Å; I19-S23 PolarHBondContact O-N 2.9Å; I19-S23 PolarHBondContact O-OG 2.83Å; I19-L77 HydrophobicContact CD1-CD1 3.9Å; I19-L77 HydrophobicContact CD1-CD2 3.56Å; I19-L77 HydrophobicContact CD1-CG 4.33Å; I19-L77 HydrophobicContact CG1-CD1 4.07Å; I19-Q95 HydrophobicContact CD1-CB 4.05Å; I19-L99 HydrophobicContact CB-CD1 4.38Å; I19-L99 HydrophobicContact CD1-CD1 3.31Å; I19-L99 HydrophobicContact CD1-CG 4.49Å; I19-L99 HydrophobicContact CG1-CD1 4.4Å; I19-L99 HydrophobicContact CG2-CD1 4.23Å
20	Q	95.7	Very high	87.2	Confident	129 Å²	129	63.4 Å²	63.4	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-62.2	-41.3	-178.4	-72.4	178.8	-12.3	0	0	112.2	S16 T17 L18 S23 S24	S16-Q20 WeakPolarHBondContact O-CG 3.41Å; S16-Q20 PolarHBondContact O-N 2.68Å; T17-Q20 PolarHBondContact O-N 2.71Å; L18-Q20 PolarHBondContact O-N 2.84Å; Q20-S23 PolarHBondContact O-N 2.74Å; Q20-S24 WeakPolarHBondContact O-CB 3.3Å; Q20-S24 PolarHBondContact O-N 3.16Å
21	T	96.6	Very high	89.8	Confident	39 Å²	39	64.6 Å²	64.6	24%	0.239	35%	0.353	C	S	.	.	H	α-helix	trans	-64	-47.4	178.2	-57.1	0	0	0	0	110.8	T17 L18 I19 S24 N25	T17-T21 WeakPolarHBondContact O-CB 3.49Å; T17-T21 PolarHBondContact O-N 3.41Å; T17-T21 PolarHBondContact O-OG1 3.48Å; L18-T21 PolarHBondContact O-N 3.43Å; I19-T21 VanDerWaalsContact C-N 3.33Å; I19-T21 PolarHBondContact O-N 2.87Å; T21-S24 PolarHBondContact O-N 3.05Å; T21-N25 PolarHBondContact O-N 3.38Å
22	C	96.6	Very high	92.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-49.6	175.7	-71.5	0	0	0	0	111.4	L18 I19 S24 N25 I26 T70 H73 L74 L99	L18-C22 WeakPolarHBondContact O-CB 3.5Å; L18-C22 PolarHBondContact O-N 3.18Å; L18-C22 PolarHBondContact O-SG 3.38Å; I19-C22 PolarHBondContact O-N 3.03Å; C22-S24 VanDerWaalsContact C-N 3.33Å; C22-S24 PolarHBondContact O-N 3.34Å; C22-N25 PolarHBondContact O-N 3.46Å; C22-I26 WeakPolarHBondContact O-CD1 3.39Å; C22-I26 WeakPolarHBondContact O-CG1 3.41Å; C22-I26 PolarHBondContact O-N 3.01Å; C22-T70 HydrophobicContact CB-CG2 4.42Å; C22-H73 WeakPolarHBondContact SG-CB 3.39Å; C22-L74 HydrophobicContact CB-CD2 4.45Å; C22-L99 HydrophobicContact CB-CD1 3.9Å; C22-L99 HydrophobicContact CB-CD2 4Å
23	S	97.7	Very high	94.1	Very high	47 Å²	47	55.1 Å²	55.1	33%	0.329	29%	0.287	S	S	.	.	H	α-helix	trans	-56.4	-45.8	177.2	-67.5	0	0	0	0	112.2	I19 Q20 I26 Q27 L99	I19-S23 PolarHBondContact O-N 2.9Å; I19-S23 PolarHBondContact O-OG 2.83Å; Q20-S23 PolarHBondContact O-N 2.74Å; S23-I26 PolarHBondContact O-N 3.37Å; S23-Q27 WeakPolarHBondContact O-CG 3.15Å; S23-Q27 PolarHBondContact O-N 3.34Å; S23-Q27 VanDerWaalsContact O-N 3.08Å; S23-L99 WeakPolarHBondContact OG-CD2 3.39Å
24	S	98.4	Very high	95.7	Very high	46 Å²	46	51.5 Å²	51.5	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-44.4	178.8	-174.2	0	0	0	0	111.7	Q20 T21 C22 Q27 K28	Q20-S24 WeakPolarHBondContact O-CB 3.3Å; Q20-S24 PolarHBondContact O-N 3.16Å; T21-S24 PolarHBondContact O-N 3.05Å; C22-S24 VanDerWaalsContact C-N 3.33Å; C22-S24 PolarHBondContact O-N 3.34Å; S24-Q27 PolarHBondContact O-N 2.75Å; S24-K28 WeakPolarHBondContact O-CG 3.16Å; S24-K28 PolarHBondContact O-N 3.23Å
25	N	98.1	Very high	96.4	Very high	11 Å²	11	49.5 Å²	49.5	6%	0.059	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-41.5	178.9	-70.6	-5.7	0	0	0	112.1	T21 C22 Q27 K28 I29 L66 T70	T21-N25 PolarHBondContact O-N 3.38Å; C22-N25 PolarHBondContact O-N 3.46Å; N25-Q27 VanDerWaalsContact C-N 3.31Å; N25-Q27 PolarHBondContact O-N 3.3Å; N25-K28 PolarHBondContact O-N 3.32Å; N25-I29 VanDerWaalsContact O-CG1 3.3Å; N25-I29 WeakPolarHBondContact O-CG1 3.38Å; N25-I29 PolarHBondContact O-N 3.35Å; N25-L66 HydrophobicContact CB-CD2 4.37Å; N25-T70 WeakPolarHBondContact CB-OG1 3.46Å; N25-T70 PolarHBondContact ND2-OG1 3.06Å
26	I	98.3	Very high	96.8	Very high	13 Å²	13	48 Å²	48	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-42.6	176.2	-66.8	162.3	0	0	0	111.1	C22 S23 I29 T30 T70 L99 D102 F103 A106	C22-I26 WeakPolarHBondContact O-CD1 3.39Å; C22-I26 WeakPolarHBondContact O-CG1 3.41Å; C22-I26 PolarHBondContact O-N 3.01Å; S23-I26 PolarHBondContact O-N 3.37Å; I26-I29 PolarHBondContact O-N 3.12Å; I26-T30 PolarHBondContact O-N 3.21Å; I26-T30 PolarHBondContact O-OG1 3.04Å; I26-T70 HydrophobicContact CG1-CG2 4.11Å; I26-L99 HydrophobicContact CD1-CD2 3.65Å; I26-D102 HydrophobicContact CD1-CB 4.38Å; I26-D102 HydrophobicContact CG2-CB 4.23Å; I26-F103 HydrophobicContact CD1-CB 3.77Å; I26-F103 HydrophobicContact CG1-CB 3.91Å; I26-F103 HydrophobicContact CG1-CD2 3.93Å; I26-F103 HydrophobicContact CG1-CG 4.3Å; I26-A106 HydrophobicContact CG2-CB 4.08Å
27	Q	98.4	Very high	97.2	Very high	138 Å²	138	50.1 Å²	50.1	65%	0.645	27%	0.267	S	S	*	.	H	α-helix	trans	-63	-44.6	175.6	-73	179.2	-6.9	0	0	111.7	S23 S24 N25 I29 T30 Q31	S23-Q27 WeakPolarHBondContact O-CG 3.15Å; S23-Q27 PolarHBondContact O-N 3.34Å; S23-Q27 VanDerWaalsContact O-N 3.08Å; S24-Q27 PolarHBondContact O-N 2.75Å; N25-Q27 VanDerWaalsContact C-N 3.31Å; N25-Q27 PolarHBondContact O-N 3.3Å; Q27-I29 PolarHBondContact O-N 3.13Å; Q27-T30 WeakPolarHBondContact O-CB 3.4Å; Q27-T30 PolarHBondContact O-N 3.36Å; Q27-Q31 PolarHBondContact O-N 2.88Å
28	K	98.6	Very high	97.5	Very high	76 Å²	76	51 Å²	51	33%	0.33	27%	0.272	S	S	.	.	H	α-helix	trans	-62.7	-39.9	176.1	-70.5	166.1	178.2	175.5	0	112.3	S24 N25 T30 Q31 S32 L66	S24-K28 WeakPolarHBondContact O-CG 3.16Å; S24-K28 PolarHBondContact O-N 3.23Å; N25-K28 PolarHBondContact O-N 3.32Å; K28-T30 VanDerWaalsContact C-N 3.35Å; K28-Q31 PolarHBondContact O-N 3.11Å; K28-S32 VanDerWaalsContact O-CB 3.26Å; K28-S32 WeakPolarHBondContact O-CB 3.4Å; K28-S32 PolarHBondContact O-N 2.95Å; K28-S32 PolarHBondContact O-OG 3.09Å; K28-L66 HydrophobicContact CB-CD1 3.53Å; K28-L66 HydrophobicContact CD-CD1 4.42Å; K28-L66 HydrophobicContact CD-CD2 4.36Å
29	I	98.5	Very high	97.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-47.1	174.3	-69.7	166.3	0	0	0	109.8	N25 I26 Q27 Q31 S32 T33 T63 L66 A67 F103 A106	N25-I29 VanDerWaalsContact O-CG1 3.3Å; N25-I29 WeakPolarHBondContact O-CG1 3.38Å; N25-I29 PolarHBondContact O-N 3.35Å; I26-I29 PolarHBondContact O-N 3.12Å; Q27-I29 PolarHBondContact O-N 3.13Å; I29-Q31 PolarHBondContact O-N 3.16Å; I29-S32 PolarHBondContact O-N 3.14Å; I29-T33 VanDerWaalsContact O-CB 3.26Å; I29-T33 WeakPolarHBondContact O-CB 3.31Å; I29-T33 PolarHBondContact O-N 3.09Å; I29-T33 PolarHBondContact O-OG1 3.05Å; I29-T63 HydrophobicContact CB-CG2 4.33Å; I29-T63 HydrophobicContact CG1-CG2 4.23Å; I29-T63 HydrophobicContact CG2-CG2 3.94Å; I29-L66 HydrophobicContact CD1-CB 4.01Å; I29-L66 HydrophobicContact CG1-CB 3.67Å; I29-L66 HydrophobicContact CG1-CD1 4.09Å; I29-A67 HydrophobicContact CD1-CB 4.42Å; I29-F103 HydrophobicContact CD1-CD2 4.25Å; I29-F103 HydrophobicContact CD1-CE2 3.75Å; I29-A106 HydrophobicContact CG2-CB 4.06Å
30	T	98.4	Very high	97.7	Very high	78 Å²	78	50.3 Å²	50.3	48%	0.479	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-47	179	-58.2	0	0	0	0	111.6	I26 Q27 K28 T33 A34	I26-T30 PolarHBondContact O-N 3.21Å; I26-T30 PolarHBondContact O-OG1 3.04Å; Q27-T30 WeakPolarHBondContact O-CB 3.4Å; Q27-T30 PolarHBondContact O-N 3.36Å; K28-T30 VanDerWaalsContact C-N 3.35Å; T30-T33 PolarHBondContact O-N 3.46Å; T30-A34 PolarHBondContact O-N 3Å; T30-A34 VanDerWaalsContact O-N 3.11Å
31	Q	98.5	Very high	97.6	Very high	125 Å²	125	47.6 Å²	47.6	58%	0.584	26%	0.258	S	S	*	.	H	α-helix	trans	-64.7	-46.4	178.7	-173.4	-178.4	33.5	0	0	111.9	Q27 K28 I29 T33 A34 Q35	Q27-Q31 PolarHBondContact O-N 2.88Å; K28-Q31 PolarHBondContact O-N 3.11Å; I29-Q31 PolarHBondContact O-N 3.16Å; Q31-T33 VanDerWaalsContact C-N 3.3Å; Q31-T33 PolarHBondContact O-N 3.07Å; Q31-A34 PolarHBondContact O-N 3.24Å; Q31-Q35 PolarHBondContact O-N 3.14Å; Q31-Q35 VanDerWaalsContact O-N 3.11Å
32	S	98	Very high	97.5	Very high	7 Å²	7	48.3 Å²	48.3	5%	0.049	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-40.1	178.9	-55.4	0	0	0	0	110.8	K28 I29 A34 Q35 I36 T63	K28-S32 VanDerWaalsContact O-CB 3.26Å; K28-S32 WeakPolarHBondContact O-CB 3.4Å; K28-S32 PolarHBondContact O-N 2.95Å; K28-S32 PolarHBondContact O-OG 3.09Å; I29-S32 PolarHBondContact O-N 3.14Å; S32-A34 VanDerWaalsContact C-N 3.33Å; S32-A34 PolarHBondContact O-N 3.4Å; S32-Q35 WeakPolarHBondContact O-CB 3.41Å; S32-Q35 PolarHBondContact O-N 3.45Å; S32-Q35 VanDerWaalsContact O-N 3.14Å; S32-I36 WeakPolarHBondContact O-CD1 2.76Å; S32-I36 VanDerWaalsContact O-CG1 3.22Å; S32-I36 WeakPolarHBondContact O-CG1 3.41Å; S32-I36 PolarHBondContact O-N 3.33Å; S32-T63 WeakPolarHBondContact CB-OG1 3.46Å
33	T	98.4	Very high	97.2	Very high	11 Å²	11	48.5 Å²	48.5	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-42.2	175.3	-62	0	0	0	0	112	I29 T30 Q31 I36 K37 N109 F110 V113	I29-T33 VanDerWaalsContact O-CB 3.26Å; I29-T33 WeakPolarHBondContact O-CB 3.31Å; I29-T33 PolarHBondContact O-N 3.09Å; I29-T33 PolarHBondContact O-OG1 3.05Å; T30-T33 PolarHBondContact O-N 3.46Å; Q31-T33 VanDerWaalsContact C-N 3.3Å; Q31-T33 PolarHBondContact O-N 3.07Å; T33-I36 PolarHBondContact O-N 3.34Å; T33-K37 WeakPolarHBondContact O-CB 3.34Å; T33-K37 PolarHBondContact O-N 3.26Å; T33-N109 HydrophobicContact CG2-CB 4.42Å; T33-F110 HydrophobicContact CG2-CB 4.28Å; T33-F110 WeakPolarHBondContact OG1-CB 3.27Å; T33-V113 HydrophobicContact CG2-CB 4.29Å; T33-V113 HydrophobicContact CG2-CG2 3.81Å
34	A	98.3	Very high	96.5	Very high	57 Å²	57	48 Å²	48	47%	0.471	26%	0.262	S	S	.	.	H	α-helix	trans	-64.1	-40.3	175.7	0	0	0	0	0	112	T30 Q31 S32 K37 T38	T30-A34 PolarHBondContact O-N 3Å; T30-A34 VanDerWaalsContact O-N 3.11Å; Q31-A34 PolarHBondContact O-N 3.24Å; S32-A34 VanDerWaalsContact C-N 3.33Å; S32-A34 PolarHBondContact O-N 3.4Å; A34-K37 PolarHBondContact O-N 3.44Å; A34-T38 PolarHBondContact O-N 3.33Å; A34-T38 PolarHBondContact O-OG1 2.92Å
35	Q	98.1	Very high	96	Very high	71 Å²	71	49 Å²	49	33%	0.332	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-48.8	175.4	-66.4	-179.8	27.3	0	0	111.6	Q31 S32 K37 T38 M39	Q31-Q35 PolarHBondContact O-N 3.14Å; Q31-Q35 VanDerWaalsContact O-N 3.11Å; S32-Q35 WeakPolarHBondContact O-CB 3.41Å; S32-Q35 PolarHBondContact O-N 3.45Å; S32-Q35 VanDerWaalsContact O-N 3.14Å; Q35-K37 VanDerWaalsContact C-N 3.27Å; Q35-K37 PolarHBondContact O-N 3.47Å; Q35-T38 WeakPolarHBondContact O-CB 3.03Å; Q35-T38 PolarHBondContact O-N 3.41Å; Q35-T38 VanDerWaalsContact O-N 3.11Å; Q35-M39 WeakPolarHBondContact O-CG 3.34Å; Q35-M39 PolarHBondContact O-N 2.9Å
36	I	97.8	Very high	95.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.3	-45.6	176.1	-67.5	160.2	0	0	0	109.9	S32 T33 T38 M39 V40 L56 I59 Q60 F110 V113	S32-I36 WeakPolarHBondContact O-CD1 2.76Å; S32-I36 VanDerWaalsContact O-CG1 3.22Å; S32-I36 WeakPolarHBondContact O-CG1 3.41Å; S32-I36 PolarHBondContact O-N 3.33Å; T33-I36 PolarHBondContact O-N 3.34Å; I36-T38 VanDerWaalsContact C-N 3.31Å; I36-T38 PolarHBondContact O-N 3.42Å; I36-M39 PolarHBondContact O-N 3.03Å; I36-V40 HydrophobicContact CG2-CG2 4.05Å; I36-V40 WeakPolarHBondContact O-CB 3.24Å; I36-V40 VanDerWaalsContact O-CG2 3.22Å; I36-V40 WeakPolarHBondContact O-CG2 3.39Å; I36-V40 PolarHBondContact O-N 3.24Å; I36-L56 HydrophobicContact CB-CD1 4.17Å; I36-L56 HydrophobicContact CG1-CD1 4.25Å; I36-L56 HydrophobicContact CG2-CD1 3.61Å; I36-I59 HydrophobicContact CD1-CG2 3.76Å; I36-I59 HydrophobicContact CG1-CB 4.15Å; I36-I59 HydrophobicContact CG1-CG2 3.6Å; I36-Q60 HydrophobicContact CD1-CG 4.02Å; I36-Q60 HydrophobicContact CG1-CG 4.25Å; I36-Q60 HydrophobicContact CG2-CG 4.18Å; I36-F110 HydrophobicContact CD1-CD2 4.25Å; I36-F110 HydrophobicContact CD1-CE2 3.66Å; I36-V113 HydrophobicContact CB-CG1 4.11Å; I36-V113 HydrophobicContact CG2-CG1 3.42Å; I36-V113 VanDerWaalsContact CG2-CG1 3.42Å
37	K	97.6	Very high	94.8	Very high	113 Å²	113	63.7 Å²	63.7	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-57.9	-43.4	178.7	-175.5	179.8	178.9	-179.9	0	112.2	T33 A34 Q35 N41 V113	T33-K37 WeakPolarHBondContact O-CB 3.34Å; T33-K37 PolarHBondContact O-N 3.26Å; A34-K37 PolarHBondContact O-N 3.44Å; Q35-K37 VanDerWaalsContact C-N 3.27Å; Q35-K37 PolarHBondContact O-N 3.47Å; K37-N41 VanDerWaalsContact O-CG 3.28Å; K37-N41 PolarHBondContact O-N 3.44Å; K37-N41 PolarHBondContact O-ND2 2.95Å; K37-N41 VanDerWaalsContact O-ND2 3.16Å; K37-V113 HydrophobicContact CB-CG1 4.07Å; K37-V113 HydrophobicContact CB-CG2 3.96Å; K37-V113 HydrophobicContact CD-CG2 4.39Å; K37-V113 HydrophobicContact CG-CG2 4.26Å
38	T	97.4	Very high	94.4	Very high	82 Å²	82	58.9 Å²	58.9	50%	0.503	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-46.6	177.1	-60.2	0	0	0	0	111.1	A34 Q35 I36 N41 Q42	A34-T38 PolarHBondContact O-N 3.33Å; A34-T38 PolarHBondContact O-OG1 2.92Å; Q35-T38 WeakPolarHBondContact O-CB 3.03Å; Q35-T38 PolarHBondContact O-N 3.41Å; Q35-T38 VanDerWaalsContact O-N 3.11Å; I36-T38 VanDerWaalsContact C-N 3.31Å; I36-T38 PolarHBondContact O-N 3.42Å; T38-N41 PolarHBondContact O-N 2.81Å; T38-Q42 PolarHBondContact O-N 3.21Å
39	M	96.7	Very high	94	Very high	13 Å²	13	58.6 Å²	58.6	6%	0.064	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-41.7	179.7	-62.6	173.6	77.4	0	0	112.1	Q35 I36 N41 Q42 L43 L52 R55 L56 I59	Q35-M39 WeakPolarHBondContact O-CG 3.34Å; Q35-M39 PolarHBondContact O-N 2.9Å; I36-M39 PolarHBondContact O-N 3.03Å; M39-N41 PolarHBondContact O-N 2.98Å; M39-Q42 WeakPolarHBondContact O-CA 3.3Å; M39-Q42 WeakPolarHBondContact O-CB 3.43Å; M39-Q42 PolarHBondContact O-N 3.37Å; M39-L43 PolarHBondContact O-N 3.07Å; M39-L52 HydrophobicContact CB-CD1 4.07Å; M39-L52 HydrophobicContact CE-CD1 3.62Å; M39-L52 HydrophobicContact CE-CG 4.16Å; M39-L52 WeakPolarHBondContact CE-O 3.47Å; M39-L52 HydrophobicContact CG-CD1 3.94Å; M39-R55 HydrophobicContact CE-CB 3.63Å; M39-R55 HydrophobicContact CE-CG 3.62Å; M39-R55 HydrophobicContact SD-CG 4.35Å; M39-L56 HydrophobicContact CB-CD1 4.18Å; M39-L56 HydrophobicContact CE-CB 3.91Å; M39-I59 HydrophobicContact SD-CD1 3.95Å
40	V	95.8	Very high	93.5	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.4	-34.6	175.4	167.5	0	0	0	0	111.9	I36 Q42 L43 L56 R116 A117 K120	I36-V40 HydrophobicContact CG2-CG2 4.05Å; I36-V40 WeakPolarHBondContact O-CB 3.24Å; I36-V40 VanDerWaalsContact O-CG2 3.22Å; I36-V40 WeakPolarHBondContact O-CG2 3.39Å; I36-V40 PolarHBondContact O-N 3.24Å; V40-Q42 PolarHBondContact O-N 3.41Å; V40-L43 PolarHBondContact O-N 3.43Å; V40-L56 HydrophobicContact CG2-CD1 4.01Å; V40-L56 HydrophobicContact CG2-CD2 4.17Å; V40-R116 HydrophobicContact CG1-CB 4.28Å; V40-R116 HydrophobicContact CG1-CG 3.89Å; V40-A117 HydrophobicContact CG1-CB 4.35Å; V40-A117 HydrophobicContact CG2-CB 3.64Å; V40-K120 HydrophobicContact CG1-CG 4.02Å
41	N	94.5	Very high	93.2	Very high	73 Å²	73	65.9 Å²	65.9	39%	0.39	35%	0.351	S	S	.	.	H	α-helix	trans	-72.4	-17.1	176.1	-69.8	-31.7	0	0	0	113.4	K37 T38 M39 R116	K37-N41 VanDerWaalsContact O-CG 3.28Å; K37-N41 PolarHBondContact O-N 3.44Å; K37-N41 PolarHBondContact O-ND2 2.95Å; K37-N41 VanDerWaalsContact O-ND2 3.16Å; T38-N41 PolarHBondContact O-N 2.81Å; M39-N41 PolarHBondContact O-N 2.98Å; N41-R116 PolarHBondContact OD1-NE 2.95Å; N41-R116 PolarHBondContact OD1-NH2 3.43Å; N41-R116 VanDerWaalsContact OD1-NH2 3.09Å
42	Q	92.8	Very high	93	Very high	53 Å²	53	61 Å²	61	25%	0.248	33%	0.329	C	S	.	.	H	α-helix	trans	-88.6	-19	176	-66.7	170.7	-24.6	0	0	112.2	T38 M39 V40 T45 Q47 L52	T38-Q42 PolarHBondContact O-N 3.21Å; M39-Q42 WeakPolarHBondContact O-CA 3.3Å; M39-Q42 WeakPolarHBondContact O-CB 3.43Å; M39-Q42 PolarHBondContact O-N 3.37Å; V40-Q42 PolarHBondContact O-N 3.41Å; Q42-T45 WeakPolarHBondContact O-CB 3.3Å; Q42-T45 WeakPolarHBondContact O-CG2 3.36Å; Q42-T45 PolarHBondContact O-N 3.2Å; Q42-T45 VanDerWaalsContact O-N 3.16Å; Q42-T45 PolarHBondContact O-OG1 3.35Å; Q42-Q47 HydrophobicContact CB-CB 4.3Å; Q42-L52 HydrophobicContact CB-CD2 3.74Å; Q42-L52 VanDerWaalsContact OE1-CD1 3.32Å
43	L	90.4	Very high	92.6	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	138.1	175.2	-62.2	-179.5	0	0	0	111.8	M39 V40 T45 L52 Q53 L56 K120	M39-L43 PolarHBondContact O-N 3.07Å; V40-L43 PolarHBondContact O-N 3.43Å; L43-T45 PolarHBondContact O-N 3.33Å; L43-L52 HydrophobicContact CD2-CD2 4.17Å; L43-Q53 HydrophobicContact CD2-CG 4.01Å; L43-L56 HydrophobicContact CD1-CD2 3.74Å; L43-L56 HydrophobicContact CD2-CD2 4.36Å; L43-L56 HydrophobicContact CG-CD2 4.38Å; L43-K120 HydrophobicContact CB-CB 4.25Å; L43-K120 HydrophobicContact CD1-CB 4.21Å
44	G	83.8	Confident	92.4	Very high	36 Å²	36	65 Å²	65	37%	0.371	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	9	-175.6	0	0	0	0	0	115.1	D48 R127	G44-D48 PolarHBondContact N-OD2 2.93Å; G44-R127 VanDerWaalsContact CA-NH2 3.31Å
45	T	87.9	Confident	92.3	Very high	66 Å²	66	68.8 Å²	68.8	41%	0.405	35%	0.351	S	S	.	.	S	Bend	trans	-105.3	178.8	171.7	78	0	0	0	0	110.4	Q42 L43 Q47 D48	Q42-T45 WeakPolarHBondContact O-CB 3.3Å; Q42-T45 WeakPolarHBondContact O-CG2 3.36Å; Q42-T45 PolarHBondContact O-N 3.2Å; Q42-T45 VanDerWaalsContact O-N 3.16Å; Q42-T45 PolarHBondContact O-OG1 3.35Å; L43-T45 PolarHBondContact O-N 3.33Å; T45-Q47 PolarHBondContact O-N 2.9Å; T45-Q47 PolarHBondContact OG1-N 3.41Å; T45-Q47 VanDerWaalsContact OG1-N 3.14Å; T45-D48 VanDerWaalsContact O-CB 3.28Å; T45-D48 WeakPolarHBondContact O-CB 3.29Å; T45-D48 PolarHBondContact O-N 3.1Å
46	K	85.4	Confident	92.2	Very high	217 Å²	217	65.6 Å²	65.6	94%	0.943	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.2	172.7	-59.5	-175.3	-179.5	-175.7	0	113.9
47	Q	85	Confident	92	Very high	117 Å²	117	68.7 Å²	68.7	55%	0.547	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-1.9	177.4	-56.1	-164.9	-63.4	0	0	113	Q42 T45 T49	Q42-Q47 HydrophobicContact CB-CB 4.3Å; T45-Q47 PolarHBondContact O-N 2.9Å; T45-Q47 PolarHBondContact OG1-N 3.41Å; T45-Q47 VanDerWaalsContact OG1-N 3.14Å; Q47-T49 PolarHBondContact O-N 3Å; Q47-T49 VanDerWaalsContact O-N 3.14Å
48	D	89.6	Confident	91.9	Very high	36 Å²	36	70 Å²	70	19%	0.193	36%	0.359	C	S	.	.			trans	-73.2	103.5	177.6	-167.8	-8.9	0	0	0	109.9	G44 T45 Q53 R177	G44-D48 PolarHBondContact N-OD2 2.93Å; T45-D48 VanDerWaalsContact O-CB 3.28Å; T45-D48 WeakPolarHBondContact O-CB 3.29Å; T45-D48 PolarHBondContact O-N 3.1Å; D48-Q53 PolarHBondContact OD1-NE2 3.14Å; D48-R177 IonicContact OD1-NH2 3.83Å; D48-R177 IonicContact OD2-NH2 3.67Å
49	T	90.5	Very high	91.9	Very high	70 Å²	70	67 Å²	67	43%	0.429	34%	0.339	S	S	.	.			trans	-121.3	158.6	178.5	65.4	0	0	0	0	110.1	Q47 E51 L52 Q53	Q47-T49 PolarHBondContact O-N 3Å; Q47-T49 VanDerWaalsContact O-N 3.14Å; T49-E51 VanDerWaalsContact C-N 3.27Å; T49-E51 PolarHBondContact O-N 3.16Å; T49-L52 WeakPolarHBondContact O-CB 3.05Å; T49-L52 PolarHBondContact O-N 3.41Å; T49-L52 VanDerWaalsContact O-N 3.13Å; T49-L52 PolarHBondContact OG1-N 3.4Å; T49-Q53 PolarHBondContact O-N 2.77Å; T49-Q53 VanDerWaalsContact O-N 3.12Å
50	S	88.4	Confident	91.9	Very high	80 Å²	80	67.2 Å²	67.2	56%	0.559	34%	0.341	S	S	*	.	H	α-helix	trans	-57.1	-40.1	173.8	163.1	0	0	0	0	111.8	L52 Q53 D54	S50-L52 VanDerWaalsContact C-N 3.33Å; S50-L52 PolarHBondContact O-N 2.83Å; S50-Q53 PolarHBondContact O-N 3.01Å; S50-Q53 VanDerWaalsContact O-N 3.11Å; S50-D54 PolarHBondContact O-N 2.66Å
51	E	92.3	Very high	91.9	Very high	151 Å²	151	72.7 Å²	72.7	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-60.4	-40.1	175.5	-173.5	-172.7	172.5	0	0	112.8	T49 Q53 R55	T49-E51 VanDerWaalsContact C-N 3.27Å; T49-E51 PolarHBondContact O-N 3.16Å; E51-Q53 VanDerWaalsContact C-N 3.32Å; E51-R55 VanDerWaalsContact O-CB 3.31Å; E51-R55 WeakPolarHBondContact O-CB 3.28Å; E51-R55 PolarHBondContact O-N 3.05Å
52	L	93.6	Very high	92	Very high	23 Å²	23	74.1 Å²	74.1	12%	0.12	37%	0.366	C	S	.	.	H	α-helix	trans	-62.9	-42.5	175.9	-177	76.2	0	0	0	110.6	M39 Q42 L43 T49 S50 L56	M39-L52 HydrophobicContact CB-CD1 4.07Å; M39-L52 HydrophobicContact CE-CD1 3.62Å; M39-L52 HydrophobicContact CE-CG 4.16Å; M39-L52 WeakPolarHBondContact CE-O 3.47Å; M39-L52 HydrophobicContact CG-CD1 3.94Å; Q42-L52 HydrophobicContact CB-CD2 3.74Å; Q42-L52 VanDerWaalsContact OE1-CD1 3.32Å; L43-L52 HydrophobicContact CD2-CD2 4.17Å; T49-L52 WeakPolarHBondContact O-CB 3.05Å; T49-L52 PolarHBondContact O-N 3.41Å; T49-L52 VanDerWaalsContact O-N 3.13Å; T49-L52 PolarHBondContact OG1-N 3.4Å; S50-L52 VanDerWaalsContact C-N 3.33Å; S50-L52 PolarHBondContact O-N 2.83Å; L52-L56 VanDerWaalsContact O-CB 3.29Å; L52-L56 WeakPolarHBondContact O-CB 3.38Å; L52-L56 PolarHBondContact O-N 3.2Å
53	Q	91.5	Very high	92.2	Very high	16 Å²	16	71.6 Å²	71.6	8%	0.075	36%	0.355	C	S	.	.	H	α-helix	trans	-68.2	-45	-180	-69	168.9	52.3	0	0	112.1	L43 D48 T49 S50 E51 R55 L56 Q57 R177	L43-Q53 HydrophobicContact CD2-CG 4.01Å; D48-Q53 PolarHBondContact OD1-NE2 3.14Å; T49-Q53 PolarHBondContact O-N 2.77Å; T49-Q53 VanDerWaalsContact O-N 3.12Å; S50-Q53 PolarHBondContact O-N 3.01Å; S50-Q53 VanDerWaalsContact O-N 3.11Å; E51-Q53 VanDerWaalsContact C-N 3.32Å; Q53-R55 VanDerWaalsContact C-N 3.33Å; Q53-R55 PolarHBondContact O-N 3.31Å; Q53-L56 WeakPolarHBondContact O-CB 3.44Å; Q53-L56 PolarHBondContact O-N 2.81Å; Q53-L56 VanDerWaalsContact O-N 3.1Å; Q53-Q57 WeakPolarHBondContact O-CG 3.45Å; Q53-Q57 PolarHBondContact O-N 3.28Å; Q53-R177 VanDerWaalsContact CD-CZ 3.49Å; Q53-R177 VanDerWaalsContact OE1-NH2 3.15Å
54	D	93.1	Very high	92.4	Very high	87 Å²	87	72.3 Å²	72.3	47%	0.465	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-46.7	176.6	-72.4	-15.6	0	0	0	110.9	S50 L56 Q57 Q58	S50-D54 PolarHBondContact O-N 2.66Å; D54-L56 VanDerWaalsContact C-N 3.3Å; D54-L56 PolarHBondContact O-N 3.03Å; D54-Q57 PolarHBondContact O-N 3.29Å; D54-Q58 WeakPolarHBondContact O-CB 3.39Å; D54-Q58 PolarHBondContact O-N 3.47Å
55	R	95.8	Very high	93	Very high	135 Å²	135	74.2 Å²	74.2	51%	0.509	36%	0.358	S	S	.	.	H	α-helix	trans	-64.1	-37.2	176.9	-177	177.6	179.5	171.4	1.4	111.6	M39 E51 Q53 Q58 I59	M39-R55 HydrophobicContact CE-CB 3.63Å; M39-R55 HydrophobicContact CE-CG 3.62Å; M39-R55 HydrophobicContact SD-CG 4.35Å; E51-R55 VanDerWaalsContact O-CB 3.31Å; E51-R55 WeakPolarHBondContact O-CB 3.28Å; E51-R55 PolarHBondContact O-N 3.05Å; Q53-R55 VanDerWaalsContact C-N 3.33Å; Q53-R55 PolarHBondContact O-N 3.31Å; R55-Q58 PolarHBondContact O-N 3.26Å; R55-I59 HydrophobicContact CG-CD1 3.91Å; R55-I59 HydrophobicContact CG-CG1 4.46Å; R55-I59 VanDerWaalsContact O-CG1 3.3Å; R55-I59 WeakPolarHBondContact O-CG1 3.44Å; R55-I59 PolarHBondContact O-N 3.37Å
56	L	95.7	Very high	93.4	Very high	5 Å²	5	71.4 Å²	71.4	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-48.7	177.3	172.9	63.5	0	0	0	110	I36 M39 V40 L43 L52 Q53 D54 Q58 I59 Q60	I36-L56 HydrophobicContact CB-CD1 4.17Å; I36-L56 HydrophobicContact CG1-CD1 4.25Å; I36-L56 HydrophobicContact CG2-CD1 3.61Å; M39-L56 HydrophobicContact CB-CD1 4.18Å; M39-L56 HydrophobicContact CE-CB 3.91Å; V40-L56 HydrophobicContact CG2-CD1 4.01Å; V40-L56 HydrophobicContact CG2-CD2 4.17Å; L43-L56 HydrophobicContact CD1-CD2 3.74Å; L43-L56 HydrophobicContact CD2-CD2 4.36Å; L43-L56 HydrophobicContact CG-CD2 4.38Å; L52-L56 VanDerWaalsContact O-CB 3.29Å; L52-L56 WeakPolarHBondContact O-CB 3.38Å; L52-L56 PolarHBondContact O-N 3.2Å; Q53-L56 WeakPolarHBondContact O-CB 3.44Å; Q53-L56 PolarHBondContact O-N 2.81Å; Q53-L56 VanDerWaalsContact O-N 3.1Å; D54-L56 VanDerWaalsContact C-N 3.3Å; D54-L56 PolarHBondContact O-N 3.03Å; L56-Q58 VanDerWaalsContact C-N 3.34Å; L56-Q58 PolarHBondContact O-N 3.14Å; L56-I59 PolarHBondContact O-N 3.4Å; L56-Q60 HydrophobicContact CD1-CG 4.22Å; L56-Q60 WeakPolarHBondContact O-CB 3.43Å; L56-Q60 VanDerWaalsContact O-CG 3.24Å; L56-Q60 WeakPolarHBondContact O-CG 3.38Å; L56-Q60 PolarHBondContact O-N 3.27Å
57	Q	93.9	Very high	93.9	Very high	64 Å²	64	61.1 Å²	61.1	30%	0.299	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-43.2	176.8	-70.1	-178.5	1.2	0	0	111.6	Q53 D54 I59 Q60 H61 N180	Q53-Q57 WeakPolarHBondContact O-CG 3.45Å; Q53-Q57 PolarHBondContact O-N 3.28Å; D54-Q57 PolarHBondContact O-N 3.29Å; Q57-I59 PolarHBondContact O-N 3.36Å; Q57-Q60 PolarHBondContact O-N 3.11Å; Q57-H61 WeakPolarHBondContact O-CB 3.38Å; Q57-H61 PolarHBondContact O-N 2.94Å; Q57-N180 PolarHBondContact NE2-ND2 2.97Å; Q57-N180 PolarHBondContact NE2-OD1 3.41Å; Q57-N180 VanDerWaalsContact NE2-OD1 3.14Å
58	Q	96.5	Very high	94.3	Very high	141 Å²	141	60.2 Å²	60.2	66%	0.659	29%	0.29	S	S	*	.	H	α-helix	trans	-60.5	-48.1	178.2	-171.2	-176.2	15.2	0	0	111.9	D54 R55 L56 H61 Y62	D54-Q58 WeakPolarHBondContact O-CB 3.39Å; D54-Q58 PolarHBondContact O-N 3.47Å; R55-Q58 PolarHBondContact O-N 3.26Å; L56-Q58 VanDerWaalsContact C-N 3.34Å; L56-Q58 PolarHBondContact O-N 3.14Å; Q58-H61 PolarHBondContact O-N 3.44Å; Q58-Y62 WeakPolarHBondContact O-CB 3.4Å; Q58-Y62 PolarHBondContact O-N 3.35Å
59	I	97.3	Very high	94.5	Very high	18 Å²	18	62.3 Å²	62.3	9%	0.092	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-37.7	179.9	-62.1	169.4	0	0	0	110.4	I36 M39 R55 L56 Q57 Y62 T63	I36-I59 HydrophobicContact CD1-CG2 3.76Å; I36-I59 HydrophobicContact CG1-CB 4.15Å; I36-I59 HydrophobicContact CG1-CG2 3.6Å; M39-I59 HydrophobicContact SD-CD1 3.95Å; R55-I59 HydrophobicContact CG-CD1 3.91Å; R55-I59 HydrophobicContact CG-CG1 4.46Å; R55-I59 VanDerWaalsContact O-CG1 3.3Å; R55-I59 WeakPolarHBondContact O-CG1 3.44Å; R55-I59 PolarHBondContact O-N 3.37Å; L56-I59 PolarHBondContact O-N 3.4Å; Q57-I59 PolarHBondContact O-N 3.36Å; I59-Y62 PolarHBondContact O-N 3.38Å; I59-T63 WeakPolarHBondContact O-CB 3.45Å; I59-T63 PolarHBondContact O-N 2.85Å; I59-T63 PolarHBondContact O-OG1 3.02Å
60	Q	96.1	Very high	94.7	Very high	19 Å²	19	59 Å²	59	9%	0.089	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-48.4	173	-76.7	175.4	-17	0	0	111.6	I36 L56 Q57 T63 N64	I36-Q60 HydrophobicContact CD1-CG 4.02Å; I36-Q60 HydrophobicContact CG1-CG 4.25Å; I36-Q60 HydrophobicContact CG2-CG 4.18Å; L56-Q60 HydrophobicContact CD1-CG 4.22Å; L56-Q60 WeakPolarHBondContact O-CB 3.43Å; L56-Q60 VanDerWaalsContact O-CG 3.24Å; L56-Q60 WeakPolarHBondContact O-CG 3.38Å; L56-Q60 PolarHBondContact O-N 3.27Å; Q57-Q60 PolarHBondContact O-N 3.11Å; Q60-T63 PolarHBondContact O-N 3.34Å; Q60-N64 PolarHBondContact O-N 2.82Å; Q60-N64 PolarHBondContact O-ND2 2.88Å
61	H	95.4	Very high	94.9	Very high	114 Å²	114	55.6 Å²	55.6	53%	0.528	25%	0.254	S	S	.	.	H	α-helix	trans	-59.8	-49.8	177.8	-174.9	82.8	0	0	0	111.3	Q57 Q58 T63 N64 Q65	Q57-H61 WeakPolarHBondContact O-CB 3.38Å; Q57-H61 PolarHBondContact O-N 2.94Å; Q58-H61 PolarHBondContact O-N 3.44Å; H61-T63 VanDerWaalsContact C-N 3.3Å; H61-T63 PolarHBondContact O-N 3.5Å; H61-N64 WeakPolarHBondContact O-CB 3.4Å; H61-N64 PolarHBondContact O-N 3Å; H61-N64 VanDerWaalsContact O-N 3.17Å; H61-Q65 PolarHBondContact CE1-NE2 3.06Å; H61-Q65 VanDerWaalsContact CE1-NE2 3.28Å; H61-Q65 PolarHBondContact NE2-NE2 3.14Å; H61-Q65 WeakPolarHBondContact O-CG 3.34Å; H61-Q65 PolarHBondContact O-N 3.17Å
62	Y	97.6	Very high	94.9	Very high	103 Å²	103	53.6 Å²	53.6	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-55.7	-44.7	176.2	170.7	-111	0	0	0	112.2	Q58 I59 N64 Q65 L66	Q58-Y62 WeakPolarHBondContact O-CB 3.4Å; Q58-Y62 PolarHBondContact O-N 3.35Å; I59-Y62 PolarHBondContact O-N 3.38Å; Y62-N64 PolarHBondContact O-N 3.16Å; Y62-Q65 PolarHBondContact O-N 3.45Å; Y62-L66 HydrophobicContact CD1-CD1 4.09Å; Y62-L66 HydrophobicContact CE1-CD1 3.48Å; Y62-L66 VanDerWaalsContact CE1-CD1 3.48Å; Y62-L66 HydrophobicContact CE1-CG 4.24Å; Y62-L66 HydrophobicContact CE2-CD1 4.18Å; Y62-L66 HydrophobicContact CE2-CD2 4.24Å; Y62-L66 HydrophobicContact CE2-CG 4.09Å; Y62-L66 PolarHBondContact O-N 3.02Å
63	T	97.4	Very high	94.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-38.8	179.1	-52.6	0	0	0	0	111.7	I29 S32 I59 Q60 H61 L66 A67 F110	I29-T63 HydrophobicContact CB-CG2 4.33Å; I29-T63 HydrophobicContact CG1-CG2 4.23Å; I29-T63 HydrophobicContact CG2-CG2 3.94Å; S32-T63 WeakPolarHBondContact CB-OG1 3.46Å; I59-T63 WeakPolarHBondContact O-CB 3.45Å; I59-T63 PolarHBondContact O-N 2.85Å; I59-T63 PolarHBondContact O-OG1 3.02Å; Q60-T63 PolarHBondContact O-N 3.34Å; H61-T63 VanDerWaalsContact C-N 3.3Å; H61-T63 PolarHBondContact O-N 3.5Å; T63-L66 PolarHBondContact O-N 3.41Å; T63-A67 PolarHBondContact O-N 3.49Å; T63-F110 HydrophobicContact CG2-CD1 3.71Å; T63-F110 HydrophobicContact CG2-CD2 3.95Å; T63-F110 HydrophobicContact CG2-CE1 3.49Å; T63-F110 VanDerWaalsContact CG2-CE1 3.49Å; T63-F110 HydrophobicContact CG2-CE2 3.79Å; T63-F110 HydrophobicContact CG2-CG 3.93Å; T63-F110 HydrophobicContact CG2-CZ 3.52Å
64	N	94.6	Very high	94.8	Very high	21 Å²	21	53 Å²	53	11%	0.112	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-39.1	173.2	-76.5	-54.3	0	0	0	112.1	Q60 H61 Y62 A67 K68 Q114	Q60-N64 PolarHBondContact O-N 2.82Å; Q60-N64 PolarHBondContact O-ND2 2.88Å; H61-N64 WeakPolarHBondContact O-CB 3.4Å; H61-N64 PolarHBondContact O-N 3Å; H61-N64 VanDerWaalsContact O-N 3.17Å; Y62-N64 PolarHBondContact O-N 3.16Å; N64-A67 WeakPolarHBondContact O-CB 3.41Å; N64-A67 PolarHBondContact O-N 3.5Å; N64-K68 WeakPolarHBondContact O-CG 3.42Å; N64-K68 PolarHBondContact O-N 3.01Å; N64-K68 VanDerWaalsContact O-N 3.08Å; N64-Q114 PolarHBondContact OD1-NE2 3.09Å
65	Q	95.7	Very high	94.7	Very high	75 Å²	75	53.6 Å²	53.6	35%	0.35	24%	0.235	S	C	.	.	H	α-helix	trans	-65.8	-43.9	175.8	-61.7	-60.7	-0.8	0	0	111.4	H61 Y62 A67 K68 E69	H61-Q65 PolarHBondContact CE1-NE2 3.06Å; H61-Q65 VanDerWaalsContact CE1-NE2 3.28Å; H61-Q65 PolarHBondContact NE2-NE2 3.14Å; H61-Q65 WeakPolarHBondContact O-CG 3.34Å; H61-Q65 PolarHBondContact O-N 3.17Å; Y62-Q65 PolarHBondContact O-N 3.45Å; Q65-A67 VanDerWaalsContact C-N 3.28Å; Q65-A67 PolarHBondContact O-N 3.16Å; Q65-K68 PolarHBondContact O-N 2.98Å; Q65-E69 WeakPolarHBondContact O-CG 3.47Å; Q65-E69 PolarHBondContact O-N 3.39Å
66	L	96.9	Very high	94.4	Very high	8 Å²	8	50 Å²	50	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-57.5	-41.5	173.7	-71.5	177	0	0	0	112	N25 K28 I29 Y62 T63 E69 T70	N25-L66 HydrophobicContact CB-CD2 4.37Å; K28-L66 HydrophobicContact CB-CD1 3.53Å; K28-L66 HydrophobicContact CD-CD1 4.42Å; K28-L66 HydrophobicContact CD-CD2 4.36Å; I29-L66 HydrophobicContact CD1-CB 4.01Å; I29-L66 HydrophobicContact CG1-CB 3.67Å; I29-L66 HydrophobicContact CG1-CD1 4.09Å; Y62-L66 HydrophobicContact CD1-CD1 4.09Å; Y62-L66 HydrophobicContact CE1-CD1 3.48Å; Y62-L66 VanDerWaalsContact CE1-CD1 3.48Å; Y62-L66 HydrophobicContact CE1-CG 4.24Å; Y62-L66 HydrophobicContact CE2-CD1 4.18Å; Y62-L66 HydrophobicContact CE2-CD2 4.24Å; Y62-L66 HydrophobicContact CE2-CG 4.09Å; Y62-L66 PolarHBondContact O-N 3.02Å; T63-L66 PolarHBondContact O-N 3.41Å; L66-E69 PolarHBondContact O-N 3.38Å; L66-T70 VanDerWaalsContact O-CB 3.27Å; L66-T70 WeakPolarHBondContact O-CB 3.37Å; L66-T70 PolarHBondContact O-N 2.67Å; L66-T70 PolarHBondContact O-OG1 3.38Å
67	A	95	Very high	94	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-49.8	176.4	0	0	0	0	0	111.5	I29 T63 N64 Q65 E69 T70 N71 F103 L107 L191	I29-A67 HydrophobicContact CD1-CB 4.42Å; T63-A67 PolarHBondContact O-N 3.49Å; N64-A67 WeakPolarHBondContact O-CB 3.41Å; N64-A67 PolarHBondContact O-N 3.5Å; Q65-A67 VanDerWaalsContact C-N 3.28Å; Q65-A67 PolarHBondContact O-N 3.16Å; A67-E69 PolarHBondContact O-N 3.41Å; A67-T70 PolarHBondContact O-N 2.9Å; A67-N71 WeakPolarHBondContact O-CB 3.37Å; A67-N71 PolarHBondContact O-N 2.99Å; A67-F103 WeakPolarHBondContact O-CZ 3.24Å; A67-L107 HydrophobicContact CB-CD2 3.65Å; A67-L191 HydrophobicContact CB-CD2 4.05Å
68	K	93.2	Very high	93.6	Very high	99 Å²	99	48.3 Å²	48.3	43%	0.43	22%	0.224	S	C	.	.	H	α-helix	trans	-60.4	-46.7	178.1	-70.2	175.8	-177.6	178.9	0	112.5	N64 Q65 T70 N71 R72	N64-K68 WeakPolarHBondContact O-CG 3.42Å; N64-K68 PolarHBondContact O-N 3.01Å; N64-K68 VanDerWaalsContact O-N 3.08Å; Q65-K68 PolarHBondContact O-N 2.98Å; K68-T70 VanDerWaalsContact C-N 3.35Å; K68-N71 PolarHBondContact O-N 3Å; K68-R72 PolarHBondContact O-N 3.05Å
69	E	94.3	Very high	93.1	Very high	80 Å²	80	45.6 Å²	45.6	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-64.4	-40.4	178.4	-69	-150.7	113.4	0	0	112.2	Q65 L66 A67 R72 H73	Q65-E69 WeakPolarHBondContact O-CG 3.47Å; Q65-E69 PolarHBondContact O-N 3.39Å; L66-E69 PolarHBondContact O-N 3.38Å; A67-E69 PolarHBondContact O-N 3.41Å; E69-R72 WeakPolarHBondContact O-CB 3.48Å; E69-R72 PolarHBondContact O-N 2.82Å; E69-R72 IonicContact OE1-CZ 2.82Å; E69-R72 IonicContact OE1-NH1 3.8Å; E69-R72 IonicContact OE1-NH2 3.16Å; E69-R72 PolarHBondContact OE1-NH2 3.26Å; E69-H73 PolarHBondContact O-CD2 3.44Å; E69-H73 PolarHBondContact O-N 3.4Å
70	T	95.2	Very high	92.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-41.8	177.5	-53	0	0	0	0	111.2	C22 N25 I26 L66 A67 K68 R72 H73 L74 F103	C22-T70 HydrophobicContact CB-CG2 4.42Å; N25-T70 WeakPolarHBondContact CB-OG1 3.46Å; N25-T70 PolarHBondContact ND2-OG1 3.06Å; I26-T70 HydrophobicContact CG1-CG2 4.11Å; L66-T70 VanDerWaalsContact O-CB 3.27Å; L66-T70 WeakPolarHBondContact O-CB 3.37Å; L66-T70 PolarHBondContact O-N 2.67Å; L66-T70 PolarHBondContact O-OG1 3.38Å; A67-T70 PolarHBondContact O-N 2.9Å; K68-T70 VanDerWaalsContact C-N 3.35Å; T70-R72 VanDerWaalsContact C-N 3.33Å; T70-R72 PolarHBondContact O-N 3.2Å; T70-H73 PolarHBondContact O-N 2.94Å; T70-L74 HydrophobicContact CG2-CD1 4.26Å; T70-L74 HydrophobicContact CG2-CG 4.46Å; T70-L74 WeakPolarHBondContact O-CB 3.44Å; T70-L74 WeakPolarHBondContact O-CG 3.45Å; T70-L74 PolarHBondContact O-N 3.18Å; T70-F103 HydrophobicContact CG2-CD1 4.26Å; T70-F103 HydrophobicContact CG2-CD2 3.68Å; T70-F103 HydrophobicContact CG2-CE1 4.26Å; T70-F103 HydrophobicContact CG2-CE2 3.68Å; T70-F103 HydrophobicContact CG2-CG 3.98Å; T70-F103 HydrophobicContact CG2-CZ 3.98Å
71	N	92.5	Very high	91.9	Very high	8 Å²	8	50.7 Å²	50.7	4%	0.043	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-44.4	174.8	-168	-73.6	0	0	0	111.3	A67 K68 L74 K75 F103 D194	A67-N71 WeakPolarHBondContact O-CB 3.37Å; A67-N71 PolarHBondContact O-N 2.99Å; K68-N71 PolarHBondContact O-N 3Å; N71-L74 PolarHBondContact O-N 3.11Å; N71-K75 WeakPolarHBondContact O-CG 3.22Å; N71-K75 PolarHBondContact O-N 3.24Å; N71-K75 WeakPolarHBondContact OD1-CE 3.48Å; N71-K75 PolarHBondContact OD1-NZ 3.11Å; N71-F103 HydrophobicContact CB-CE1 4.21Å; N71-F103 HydrophobicContact CB-CZ 4.43Å; N71-D194 PolarHBondContact ND2-O 3.33Å
72	R	91.8	Very high	91.2	Very high	110 Å²	110	48.7 Å²	48.7	42%	0.415	25%	0.249	S	C	.	.	H	α-helix	trans	-58.7	-48.1	174	-177	-175	62.7	-151.6	-7.3	111.6	K68 E69 T70 L74 K75 E76	K68-R72 PolarHBondContact O-N 3.05Å; E69-R72 WeakPolarHBondContact O-CB 3.48Å; E69-R72 PolarHBondContact O-N 2.82Å; E69-R72 IonicContact OE1-CZ 2.82Å; E69-R72 IonicContact OE1-NH1 3.8Å; E69-R72 IonicContact OE1-NH2 3.16Å; E69-R72 PolarHBondContact OE1-NH2 3.26Å; T70-R72 VanDerWaalsContact C-N 3.33Å; T70-R72 PolarHBondContact O-N 3.2Å; R72-L74 PolarHBondContact O-N 3.38Å; R72-K75 WeakPolarHBondContact O-CB 3.48Å; R72-K75 PolarHBondContact O-N 3.05Å; R72-E76 WeakPolarHBondContact CG-OE1 3.41Å; R72-E76 IonicContact NE-OE1 3.95Å; R72-E76 WeakPolarHBondContact O-CG 3.48Å; R72-E76 PolarHBondContact O-N 2.83Å
73	H	92.4	Very high	90.5	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.019	24%	0.238	C	C	.	.	H	α-helix	trans	-67	-33.2	179.6	-68.6	-38.1	0	0	0	113.3	R13 L18 C22 E69 T70 E76 L77	R13-H73 PolarHBondContact NH1-CE1 3.27Å; R13-H73 PolarHBondContact NH1-NE2 2.88Å; L18-H73 HydrophobicContact CD2-CB 4.12Å; C22-H73 WeakPolarHBondContact SG-CB 3.39Å; E69-H73 PolarHBondContact O-CD2 3.44Å; E69-H73 PolarHBondContact O-N 3.4Å; T70-H73 PolarHBondContact O-N 2.94Å; H73-E76 IonicContact CE1-OE2 3.63Å; H73-E76 IonicContact CG-OE2 3.99Å; H73-E76 IonicContact ND1-OE1 3.98Å; H73-E76 IonicContact ND1-OE2 2.87Å; H73-E76 PolarHBondContact ND1-OE2 2.99Å; H73-E76 PolarHBondContact O-N 3.06Å; H73-L77 WeakPolarHBondContact O-CB 3.41Å; H73-L77 PolarHBondContact O-N 3.46Å
74	L	91.5	Very high	89.6	Confident	21 Å²	21	50.9 Å²	50.9	11%	0.11	28%	0.281	C	S	.	.	H	α-helix	trans	-66.6	-37.7	172.7	-74.1	173.1	0	0	0	112.2	C22 T70 N71 R72 L77 G78 L99 F103	C22-L74 HydrophobicContact CB-CD2 4.45Å; T70-L74 HydrophobicContact CG2-CD1 4.26Å; T70-L74 HydrophobicContact CG2-CG 4.46Å; T70-L74 WeakPolarHBondContact O-CB 3.44Å; T70-L74 WeakPolarHBondContact O-CG 3.45Å; T70-L74 PolarHBondContact O-N 3.18Å; N71-L74 PolarHBondContact O-N 3.11Å; R72-L74 PolarHBondContact O-N 3.38Å; L74-L77 HydrophobicContact CD2-CD2 4.25Å; L74-L77 PolarHBondContact O-N 2.89Å; L74-G78 PolarHBondContact O-N 3.15Å; L74-L99 HydrophobicContact CD2-CB 3.96Å; L74-L99 HydrophobicContact CD2-CD1 4.42Å; L74-F103 HydrophobicContact CD1-CB 4.1Å; L74-F103 HydrophobicContact CD1-CD1 3.26Å; L74-F103 HydrophobicContact CD1-CE1 3.89Å; L74-F103 HydrophobicContact CD1-CG 3.92Å
75	K	89.1	Confident	89.4	Confident	100 Å²	100	51.8 Å²	51.8	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-65.3	-46.3	172.9	-73.2	171.9	174.3	159.9	0	111.7	N71 R72 L77 G78 S79	N71-K75 WeakPolarHBondContact O-CG 3.22Å; N71-K75 PolarHBondContact O-N 3.24Å; N71-K75 WeakPolarHBondContact OD1-CE 3.48Å; N71-K75 PolarHBondContact OD1-NZ 3.11Å; R72-K75 WeakPolarHBondContact O-CB 3.48Å; R72-K75 PolarHBondContact O-N 3.05Å; K75-L77 VanDerWaalsContact C-N 3.3Å; K75-L77 PolarHBondContact O-N 2.84Å; K75-G78 PolarHBondContact O-N 2.71Å; K75-G78 VanDerWaalsContact O-N 3.14Å; K75-S79 PolarHBondContact O-N 3.37Å
76	E	89.8	Confident	89	Confident	61 Å²	61	53.2 Å²	53.2	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-56.7	-46	173.7	-72	168.2	-171.4	0	0	110.8	L18 R72 H73 G78 S79 V80	L18-E76 HydrophobicContact CD1-CB 4.14Å; L18-E76 HydrophobicContact CD2-CB 4.32Å; L18-E76 WeakPolarHBondContact CD2-OE2 3.49Å; R72-E76 WeakPolarHBondContact CG-OE1 3.41Å; R72-E76 IonicContact NE-OE1 3.95Å; R72-E76 WeakPolarHBondContact O-CG 3.48Å; R72-E76 PolarHBondContact O-N 2.83Å; H73-E76 IonicContact CE1-OE2 3.63Å; H73-E76 IonicContact CG-OE2 3.99Å; H73-E76 IonicContact ND1-OE1 3.98Å; H73-E76 IonicContact ND1-OE2 2.87Å; H73-E76 PolarHBondContact ND1-OE2 2.99Å; H73-E76 PolarHBondContact O-N 3.06Å; E76-G78 VanDerWaalsContact C-N 3.27Å; E76-G78 PolarHBondContact O-N 3.36Å; E76-S79 WeakPolarHBondContact O-CA 3.37Å; E76-S79 PolarHBondContact O-N 2.76Å; E76-S79 PolarHBondContact O-OG 2.86Å; E76-V80 PolarHBondContact O-N 3.2Å
77	L	88.6	Confident	88.6	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-33.3	178.1	-173.7	71.8	0	0	0	112.6	F15 L18 I19 H73 L74 K75 S79 R96 L99	F15-L77 HydrophobicContact CD2-CD1 3.39Å; F15-L77 HydrophobicContact CD2-CG 4.36Å; F15-L77 HydrophobicContact CE2-CD1 3.43Å; F15-L77 VanDerWaalsContact CE2-CD1 3.43Å; F15-L77 HydrophobicContact CE2-CG 4.03Å; F15-L77 HydrophobicContact CG-CD1 3.98Å; F15-L77 HydrophobicContact CZ-CD1 4.06Å; L18-L77 HydrophobicContact CB-CB 4.43Å; L18-L77 HydrophobicContact CB-CD1 3.75Å; L18-L77 HydrophobicContact CD1-CB 4.34Å; L18-L77 HydrophobicContact CD1-CD1 4.32Å; I19-L77 HydrophobicContact CD1-CD1 3.9Å; I19-L77 HydrophobicContact CD1-CD2 3.56Å; I19-L77 HydrophobicContact CD1-CG 4.33Å; I19-L77 HydrophobicContact CG1-CD1 4.07Å; H73-L77 WeakPolarHBondContact O-CB 3.41Å; H73-L77 PolarHBondContact O-N 3.46Å; L74-L77 HydrophobicContact CD2-CD2 4.25Å; L74-L77 PolarHBondContact O-N 2.89Å; K75-L77 VanDerWaalsContact C-N 3.3Å; K75-L77 PolarHBondContact O-N 2.84Å; L77-S79 VanDerWaalsContact C-N 3.32Å; L77-R96 HydrophobicContact CD2-CG 3.67Å; L77-R96 HydrophobicContact CG-CG 3.85Å; L77-L99 HydrophobicContact CD2-CD1 3.99Å
78	G	85.6	Confident	88.2	Confident	30 Å²	30	61.6 Å²	61.6	31%	0.309	35%	0.352	S	S	.	.	H	α-helix	trans	-69.7	-26.2	172.8	0	0	0	0	0	114.1	L74 K75 E76	L74-G78 PolarHBondContact O-N 3.15Å; K75-G78 PolarHBondContact O-N 2.71Å; K75-G78 VanDerWaalsContact O-N 3.14Å; E76-G78 VanDerWaalsContact C-N 3.27Å; E76-G78 PolarHBondContact O-N 3.36Å
79	S	86.1	Confident	88	Confident	84 Å²	84	59.7 Å²	59.7	59%	0.587	35%	0.345	S	S	*	.	H	α-helix	trans	-86.4	-10.3	176.7	73.2	0	0	0	0	114.3	K75 E76 L77	K75-S79 PolarHBondContact O-N 3.37Å; E76-S79 WeakPolarHBondContact O-CA 3.37Å; E76-S79 PolarHBondContact O-N 2.76Å; E76-S79 PolarHBondContact O-OG 2.86Å; L77-S79 VanDerWaalsContact C-N 3.32Å
80	V	85.8	Confident	87.8	Confident	34 Å²	34	64.5 Å²	64.5	21%	0.206	36%	0.359	C	S	.	.	S	Bend	trans	-65.1	129.6	177.3	178.9	0	0	0	0	109.5	F15 L18 E76 L82	F15-V80 HydrophobicContact CB-CG1 4.13Å; F15-V80 HydrophobicContact CD2-CB 4.21Å; F15-V80 HydrophobicContact CD2-CG1 4.06Å; L18-V80 HydrophobicContact CD1-CG2 3.92Å; E76-V80 PolarHBondContact O-N 3.2Å; V80-L82 PolarHBondContact O-N 2.98Å
81	P	82.4	Confident	87.5	Confident	110 Å²	110	70 Å²	70	71%	0.714	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-53.5	136.4	177.8	-26.9	34.5	0	0	0	112
82	L	80.1	Confident	87.4	Confident	73 Å²	73	71.1 Å²	71.1	38%	0.382	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-65	140.5	175.6	-68.1	161	0	0	0	109.6	V80 Q89	V80-L82 PolarHBondContact O-N 2.98Å; L82-Q89 HydrophobicContact CB-CG 4.06Å; L82-Q89 HydrophobicContact CD1-CG 4.37Å; L82-Q89 HydrophobicContact CD2-CG 3.8Å; L82-Q89 HydrophobicContact CG-CG 4.28Å
83	A	81.6	Confident	87.3	Confident	20 Å²	20	71.3 Å²	71.3	17%	0.165	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-56.2	148.4	175	0	0	0	0	0	111.9	S85 E88 Q92	A83-S85 VanDerWaalsContact C-N 3.28Å; A83-S85 PolarHBondContact O-N 3.34Å; A83-E88 HydrophobicContact CB-CB 3.43Å; A83-E88 VanDerWaalsContact CB-CB 3.43Å; A83-Q92 VanDerWaalsContact N-OE1 3.1Å
84	S	80.3	Confident	87.3	Confident	129 Å²	129	74.2 Å²	74.2	90%	0.902	41%	0.406	S	S	*	.	S	Bend	trans	-68.7	-27	-176.8	-50	0	0	0	0	112.8
85	S	89.6	Confident	87.3	Confident	40 Å²	40	76.3 Å²	76.3	28%	0.28	42%	0.415	S	S	.	.	S	Bend	trans	-84.9	134.1	175.9	176	0	0	0	0	111.8	A83 S87 E88 Q89	A83-S85 VanDerWaalsContact C-N 3.28Å; A83-S85 PolarHBondContact O-N 3.34Å; S85-S87 PolarHBondContact O-N 3.17Å; S85-S87 PolarHBondContact OG-N 2.95Å; S85-S87 PolarHBondContact OG-OG 2.98Å; S85-E88 PolarHBondContact O-N 3.34Å; S85-Q89 WeakPolarHBondContact O-CB 3.36Å; S85-Q89 PolarHBondContact O-N 3.46Å
86	P	87.6	Confident	87.4	Confident	105 Å²	105	74 Å²	74	68%	0.682	40%	0.404	S	S	*	.	H	α-helix	trans	-56.6	-33.3	174.2	-25.9	34.4	0	0	0	114.3	R90	P86-R90 WeakPolarHBondContact O-CB 3.38Å; P86-R90 PolarHBondContact O-N 3.47Å; P86-R90 VanDerWaalsContact O-N 3.08Å
87	S	88.5	Confident	87.5	Confident	81 Å²	81	74.7 Å²	74.7	57%	0.566	41%	0.409	S	S	*	.	H	α-helix	trans	-69.7	-44.3	179.3	57.2	0	0	0	0	111.9	S85 R90 Q91	S85-S87 PolarHBondContact O-N 3.17Å; S85-S87 PolarHBondContact OG-N 2.95Å; S85-S87 PolarHBondContact OG-OG 2.98Å; S87-R90 PolarHBondContact O-N 3.21Å; S87-Q91 PolarHBondContact O-N 2.9Å
88	E	86.9	Confident	87.8	Confident	103 Å²	103	82.3 Å²	82.3	48%	0.481	44%	0.438	S	S	.	.	H	α-helix	trans	-67.6	-40.8	177.3	-66.1	174.9	168.4	0	0	110.9	A83 S85 R90 Q91 Q92	A83-E88 HydrophobicContact CB-CB 3.43Å; A83-E88 VanDerWaalsContact CB-CB 3.43Å; S85-E88 PolarHBondContact O-N 3.34Å; E88-R90 VanDerWaalsContact C-N 3.31Å; E88-R90 PolarHBondContact O-N 3.28Å; E88-Q91 WeakPolarHBondContact O-CB 3.49Å; E88-Q91 PolarHBondContact O-N 3.4Å; E88-Q91 VanDerWaalsContact O-N 3.12Å; E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 2.99Å
89	Q	87.6	Confident	88.2	Confident	58 Å²	58	81.2 Å²	81.2	27%	0.271	43%	0.425	S	S	.	.	H	α-helix	trans	-57.7	-44.8	174.1	-176.6	-178.9	86.7	0	0	111.6	L82 S85 Q91 Q92 R93	L82-Q89 HydrophobicContact CB-CG 4.06Å; L82-Q89 HydrophobicContact CD1-CG 4.37Å; L82-Q89 HydrophobicContact CD2-CG 3.8Å; L82-Q89 HydrophobicContact CG-CG 4.28Å; S85-Q89 WeakPolarHBondContact O-CB 3.36Å; S85-Q89 PolarHBondContact O-N 3.46Å; Q89-Q91 VanDerWaalsContact C-N 3.33Å; Q89-Q91 PolarHBondContact O-N 2.96Å; Q89-Q92 PolarHBondContact O-N 3.34Å; Q89-R93 WeakPolarHBondContact O-CG 3.22Å; Q89-R93 PolarHBondContact O-N 2.94Å; Q89-R93 VanDerWaalsContact O-N 3.1Å
90	R	90.1	Very high	88.6	Confident	181 Å²	181	79 Å²	79	68%	0.683	41%	0.405	S	S	*	.	H	α-helix	trans	-61.4	-42.4	175.4	-174.7	-178.8	179.8	-151.7	0.1	111.3	P86 S87 E88 R93 I94	P86-R90 WeakPolarHBondContact O-CB 3.38Å; P86-R90 PolarHBondContact O-N 3.47Å; P86-R90 VanDerWaalsContact O-N 3.08Å; S87-R90 PolarHBondContact O-N 3.21Å; E88-R90 VanDerWaalsContact C-N 3.31Å; E88-R90 PolarHBondContact O-N 3.28Å; R90-R93 PolarHBondContact O-N 3.41Å; R90-I94 HydrophobicContact CG-CD1 4.08Å; R90-I94 WeakPolarHBondContact O-CG1 3.42Å; R90-I94 PolarHBondContact O-N 3.13Å; R90-I94 VanDerWaalsContact O-N 3.08Å
91	Q	90.1	Very high	89.1	Confident	117 Å²	117	81.3 Å²	81.3	55%	0.547	42%	0.417	S	S	.	.	H	α-helix	trans	-64.4	-42.9	178.7	-171.1	173.3	7.1	0	0	112.2	S87 E88 Q89 R93 I94 Q95	S87-Q91 PolarHBondContact O-N 2.9Å; E88-Q91 WeakPolarHBondContact O-CB 3.49Å; E88-Q91 PolarHBondContact O-N 3.4Å; E88-Q91 VanDerWaalsContact O-N 3.12Å; Q89-Q91 VanDerWaalsContact C-N 3.33Å; Q89-Q91 PolarHBondContact O-N 2.96Å; Q91-R93 PolarHBondContact O-N 3.25Å; Q91-I94 PolarHBondContact O-N 3.23Å; Q91-Q95 WeakPolarHBondContact O-CG 3.13Å; Q91-Q95 PolarHBondContact O-N 2.91Å
92	Q	89.8	Confident	89.7	Confident	30 Å²	30	80.5 Å²	80.5	14%	0.14	41%	0.406	C	S	.	.	H	α-helix	trans	-59.8	-43.8	175.4	-73.4	-179.5	-15.6	0	0	111.9	F15 A83 E88 Q89 Q95 R96	F15-Q92 HydrophobicContact CD1-CG 4.27Å; F15-Q92 HydrophobicContact CD2-CG 4.45Å; F15-Q92 HydrophobicContact CE1-CB 4.19Å; F15-Q92 HydrophobicContact CE1-CG 3.8Å; F15-Q92 HydrophobicContact CE2-CB 3.99Å; F15-Q92 HydrophobicContact CE2-CG 4.01Å; F15-Q92 HydrophobicContact CZ-CB 3.61Å; F15-Q92 HydrophobicContact CZ-CG 3.67Å; A83-Q92 VanDerWaalsContact N-OE1 3.1Å; E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 2.99Å; Q89-Q92 PolarHBondContact O-N 3.34Å; Q92-Q95 PolarHBondContact O-N 2.98Å; Q92-R96 WeakPolarHBondContact O-CG 3.34Å; Q92-R96 PolarHBondContact O-N 2.72Å
93	R	89	Confident	90.5	Very high	115 Å²	115	77 Å²	77	43%	0.434	39%	0.388	S	S	.	.	H	α-helix	trans	-60.2	-49.4	176.2	-71.5	178.1	-174.4	-176.3	4.1	111.6	Q89 R90 Q91 Q95 R96 D97	Q89-R93 WeakPolarHBondContact O-CG 3.22Å; Q89-R93 PolarHBondContact O-N 2.94Å; Q89-R93 VanDerWaalsContact O-N 3.1Å; R90-R93 PolarHBondContact O-N 3.41Å; Q91-R93 PolarHBondContact O-N 3.25Å; R93-Q95 VanDerWaalsContact C-N 3.3Å; R93-Q95 PolarHBondContact O-N 2.74Å; R93-R96 PolarHBondContact O-N 2.88Å; R93-D97 WeakPolarHBondContact O-CB 3.26Å; R93-D97 PolarHBondContact O-N 3.21Å
94	I	92.5	Very high	91.2	Very high	64 Å²	64	76.7 Å²	76.7	33%	0.328	39%	0.385	S	S	.	.	H	α-helix	trans	-58.9	-41.9	178.9	-68.9	167.1	0	0	0	111.6	R90 Q91 R98	R90-I94 HydrophobicContact CG-CD1 4.08Å; R90-I94 WeakPolarHBondContact O-CG1 3.42Å; R90-I94 PolarHBondContact O-N 3.13Å; R90-I94 VanDerWaalsContact O-N 3.08Å; Q91-I94 PolarHBondContact O-N 3.23Å; I94-R98 WeakPolarHBondContact O-CB 3.22Å; I94-R98 VanDerWaalsContact O-CG 3.26Å; I94-R98 WeakPolarHBondContact O-CG 3.4Å; I94-R98 PolarHBondContact O-N 3.43Å
95	Q	92	Very high	92	Very high	65 Å²	65	73 Å²	73	30%	0.304	36%	0.362	S	S	.	.	H	α-helix	trans	-66.6	-41.6	178.2	-71.9	-177.2	3.2	0	0	112.2	I19 Q91 Q92 R93 L99	I19-Q95 HydrophobicContact CD1-CB 4.05Å; Q91-Q95 WeakPolarHBondContact O-CG 3.13Å; Q91-Q95 PolarHBondContact O-N 2.91Å; Q92-Q95 PolarHBondContact O-N 2.98Å; R93-Q95 VanDerWaalsContact C-N 3.3Å; R93-Q95 PolarHBondContact O-N 2.74Å; Q95-L99 PolarHBondContact O-N 3.44Å; Q95-L99 VanDerWaalsContact O-N 3.11Å
96	R	90.9	Very high	92.4	Very high	53 Å²	53	71.3 Å²	71.3	20%	0.2	35%	0.35	C	S	.	.	H	α-helix	trans	-61	-49	174.1	-75.5	-166.2	-70.8	111.4	-12	111.7	F15 L77 Q92 R93 R98 L99 M100	F15-R96 HydrophobicContact CE2-CG 4.11Å; F15-R96 HydrophobicContact CZ-CG 4.15Å; L77-R96 HydrophobicContact CD2-CG 3.67Å; L77-R96 HydrophobicContact CG-CG 3.85Å; Q92-R96 WeakPolarHBondContact O-CG 3.34Å; Q92-R96 PolarHBondContact O-N 2.72Å; R93-R96 PolarHBondContact O-N 2.88Å; R96-R98 VanDerWaalsContact C-N 3.32Å; R96-R98 PolarHBondContact O-N 3.4Å; R96-L99 PolarHBondContact O-N 3.46Å; R96-M100 WeakPolarHBondContact O-CG 3.49Å; R96-M100 PolarHBondContact O-N 3.11Å
97	D	92.3	Very high	92.8	Very high	74 Å²	74	66.3 Å²	66.3	40%	0.396	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-41.1	-177.6	-64.5	-17.4	0	0	0	111.6	R93 M100 N101	R93-D97 WeakPolarHBondContact O-CB 3.26Å; R93-D97 PolarHBondContact O-N 3.21Å; D97-M100 HydrophobicContact CB-CE 4.42Å; D97-M100 PolarHBondContact O-N 2.87Å; D97-M100 WeakPolarHBondContact OD1-CE 3.42Å; D97-N101 VanDerWaalsContact O-CG 3.25Å; D97-N101 PolarHBondContact O-N 3.18Å; D97-N101 PolarHBondContact O-ND2 3.41Å
98	R	95.3	Very high	93.2	Very high	163 Å²	163	65.9 Å²	65.9	62%	0.615	31%	0.309	S	S	*	.	H	α-helix	trans	-60	-49.3	173.7	-74.5	174.5	-176.1	-177.4	1.4	111.8	I94 R96 M100 N101 D102	I94-R98 WeakPolarHBondContact O-CB 3.22Å; I94-R98 VanDerWaalsContact O-CG 3.26Å; I94-R98 WeakPolarHBondContact O-CG 3.4Å; I94-R98 PolarHBondContact O-N 3.43Å; R96-R98 VanDerWaalsContact C-N 3.32Å; R96-R98 PolarHBondContact O-N 3.4Å; R98-M100 VanDerWaalsContact C-N 3.34Å; R98-M100 PolarHBondContact O-N 3.14Å; R98-N101 PolarHBondContact O-N 3.4Å; R98-D102 WeakPolarHBondContact O-CB 3.41Å; R98-D102 VanDerWaalsContact O-CG 3.26Å; R98-D102 PolarHBondContact O-N 3.11Å
99	L	94.8	Very high	93.7	Very high	6 Å²	6	65.9 Å²	65.9	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-40.7	178.1	-80.5	175.1	0	0	0	113	I19 C22 S23 I26 L74 L77 Q95 R96 N101 D102 F103	I19-L99 HydrophobicContact CB-CD1 4.38Å; I19-L99 HydrophobicContact CD1-CD1 3.31Å; I19-L99 HydrophobicContact CD1-CG 4.49Å; I19-L99 HydrophobicContact CG1-CD1 4.4Å; I19-L99 HydrophobicContact CG2-CD1 4.23Å; C22-L99 HydrophobicContact CB-CD1 3.9Å; C22-L99 HydrophobicContact CB-CD2 4Å; S23-L99 WeakPolarHBondContact OG-CD2 3.39Å; I26-L99 HydrophobicContact CD1-CD2 3.65Å; L74-L99 HydrophobicContact CD2-CB 3.96Å; L74-L99 HydrophobicContact CD2-CD1 4.42Å; L77-L99 HydrophobicContact CD2-CD1 3.99Å; Q95-L99 PolarHBondContact O-N 3.44Å; Q95-L99 VanDerWaalsContact O-N 3.11Å; R96-L99 PolarHBondContact O-N 3.46Å; L99-N101 VanDerWaalsContact C-N 3.33Å; L99-D102 PolarHBondContact O-N 2.93Å; L99-F103 WeakPolarHBondContact O-CB 3.48Å; L99-F103 PolarHBondContact O-N 2.85Å
100	M	93.8	Very high	94.1	Very high	37 Å²	37	63.1 Å²	63.1	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-43.4	176.8	-71.7	-173.2	-63.8	0	0	111.1	R96 D97 R98 S104 I198	R96-M100 WeakPolarHBondContact O-CG 3.49Å; R96-M100 PolarHBondContact O-N 3.11Å; D97-M100 HydrophobicContact CB-CE 4.42Å; D97-M100 PolarHBondContact O-N 2.87Å; D97-M100 WeakPolarHBondContact OD1-CE 3.42Å; R98-M100 VanDerWaalsContact C-N 3.34Å; R98-M100 PolarHBondContact O-N 3.14Å; M100-S104 VanDerWaalsContact O-CB 3.24Å; M100-S104 WeakPolarHBondContact O-CB 3.37Å; M100-S104 PolarHBondContact O-N 3.25Å; M100-I198 HydrophobicContact CB-CG2 3.77Å; M100-I198 HydrophobicContact CG-CG2 3.94Å; M100-I198 HydrophobicContact SD-CG2 4.37Å
101	N	95.2	Very high	94.4	Very high	83 Å²	83	55 Å²	55	44%	0.444	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-46.3	177.4	-68.9	-27	0	0	0	112	D97 R98 L99 F103 S104 A105 Y199	D97-N101 VanDerWaalsContact O-CG 3.25Å; D97-N101 PolarHBondContact O-N 3.18Å; D97-N101 PolarHBondContact O-ND2 3.41Å; R98-N101 PolarHBondContact O-N 3.4Å; L99-N101 VanDerWaalsContact C-N 3.33Å; N101-F103 VanDerWaalsContact C-N 3.34Å; N101-F103 PolarHBondContact O-N 3.35Å; N101-S104 PolarHBondContact O-N 3.09Å; N101-A105 WeakPolarHBondContact O-CB 3.5Å; N101-A105 PolarHBondContact O-N 3.32Å; N101-Y199 PolarHBondContact OD1-OH 3.08Å
102	D	96.6	Very high	94.8	Very high	93 Å²	93	52.1 Å²	52.1	50%	0.497	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-41.9	178.8	-68	-17.6	0	0	0	111.2	I26 R98 L99 A105 A106	I26-D102 HydrophobicContact CD1-CB 4.38Å; I26-D102 HydrophobicContact CG2-CB 4.23Å; R98-D102 WeakPolarHBondContact O-CB 3.41Å; R98-D102 VanDerWaalsContact O-CG 3.26Å; R98-D102 PolarHBondContact O-N 3.11Å; L99-D102 PolarHBondContact O-N 2.93Å; D102-A105 PolarHBondContact O-N 3.42Å; D102-A106 WeakPolarHBondContact O-CB 3.42Å; D102-A106 PolarHBondContact O-N 3.1Å
103	F	97.1	Very high	95.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.1	-46.2	177.2	-177.4	-133	0	0	0	111.8	I26 I29 A67 T70 N71 L74 L99 N101 A105 A106 L107 I198	I26-F103 HydrophobicContact CD1-CB 3.77Å; I26-F103 HydrophobicContact CG1-CB 3.91Å; I26-F103 HydrophobicContact CG1-CD2 3.93Å; I26-F103 HydrophobicContact CG1-CG 4.3Å; I29-F103 HydrophobicContact CD1-CD2 4.25Å; I29-F103 HydrophobicContact CD1-CE2 3.75Å; A67-F103 WeakPolarHBondContact O-CZ 3.24Å; T70-F103 HydrophobicContact CG2-CD1 4.26Å; T70-F103 HydrophobicContact CG2-CD2 3.68Å; T70-F103 HydrophobicContact CG2-CE1 4.26Å; T70-F103 HydrophobicContact CG2-CE2 3.68Å; T70-F103 HydrophobicContact CG2-CG 3.98Å; T70-F103 HydrophobicContact CG2-CZ 3.98Å; N71-F103 HydrophobicContact CB-CE1 4.21Å; N71-F103 HydrophobicContact CB-CZ 4.43Å; L74-F103 HydrophobicContact CD1-CB 4.1Å; L74-F103 HydrophobicContact CD1-CD1 3.26Å; L74-F103 HydrophobicContact CD1-CE1 3.89Å; L74-F103 HydrophobicContact CD1-CG 3.92Å; L99-F103 WeakPolarHBondContact O-CB 3.48Å; L99-F103 PolarHBondContact O-N 2.85Å; N101-F103 VanDerWaalsContact C-N 3.34Å; N101-F103 PolarHBondContact O-N 3.35Å; F103-A105 VanDerWaalsContact C-N 3.31Å; F103-A105 PolarHBondContact O-N 3.16Å; F103-A106 PolarHBondContact O-N 2.87Å; F103-L107 HydrophobicContact CD1-CD1 4.39Å; F103-L107 HydrophobicContact CD2-CD1 4.49Å; F103-L107 HydrophobicContact CD2-CD2 4.36Å; F103-L107 HydrophobicContact CD2-CG 4.05Å; F103-L107 HydrophobicContact CE1-CD1 3.81Å; F103-L107 HydrophobicContact CE1-CG 4.4Å; F103-L107 HydrophobicContact CE2-CD1 3.92Å; F103-L107 HydrophobicContact CE2-CD2 3.65Å; F103-L107 HydrophobicContact CE2-CG 3.68Å; F103-L107 HydrophobicContact CZ-CD1 3.55Å; F103-L107 HydrophobicContact CZ-CD2 4.01Å; F103-L107 HydrophobicContact CZ-CG 3.88Å; F103-L107 WeakPolarHBondContact O-CG 3.48Å; F103-L107 PolarHBondContact O-N 2.93Å; F103-I198 HydrophobicContact CD1-CD1 3.31Å; F103-I198 HydrophobicContact CD1-CG1 3.78Å; F103-I198 HydrophobicContact CE1-CD1 3.63Å; F103-I198 HydrophobicContact CE1-CG1 3.9Å; F103-I198 HydrophobicContact CG-CD1 4.22Å
104	S	95.9	Very high	95.4	Very high	14 Å²	14	45.8 Å²	45.8	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-57.1	-45.5	174.8	179.3	0	0	0	0	111.2	M100 N101 A106 L107 N108	M100-S104 VanDerWaalsContact O-CB 3.24Å; M100-S104 WeakPolarHBondContact O-CB 3.37Å; M100-S104 PolarHBondContact O-N 3.25Å; N101-S104 PolarHBondContact O-N 3.09Å; S104-A106 PolarHBondContact O-N 3.24Å; S104-L107 PolarHBondContact O-N 3.45Å; S104-N108 WeakPolarHBondContact O-CB 3.38Å; S104-N108 PolarHBondContact O-N 3.02Å; S104-N108 PolarHBondContact O-ND2 2.9Å; S104-N108 PolarHBondContact OG-ND2 3.12Å
105	A	96.9	Very high	95.5	Very high	50 Å²	50	49.4 Å²	49.4	41%	0.413	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-42.3	176.6	0	0	0	0	0	112.3	N101 D102 F103 N108 N109	N101-A105 WeakPolarHBondContact O-CB 3.5Å; N101-A105 PolarHBondContact O-N 3.32Å; D102-A105 PolarHBondContact O-N 3.42Å; F103-A105 VanDerWaalsContact C-N 3.31Å; F103-A105 PolarHBondContact O-N 3.16Å; A105-N108 PolarHBondContact O-N 3.32Å; A105-N109 PolarHBondContact O-N 3.04Å; A105-N109 VanDerWaalsContact O-N 3.12Å; A105-N109 PolarHBondContact O-ND2 3.34Å
106	A	97.7	Very high	95.6	Very high	5 Å²	5	51.7 Å²	51.7	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-44	176.6	0	0	0	0	0	112	I26 I29 D102 F103 S104 N109 F110	I26-A106 HydrophobicContact CG2-CB 4.08Å; I29-A106 HydrophobicContact CG2-CB 4.06Å; D102-A106 WeakPolarHBondContact O-CB 3.42Å; D102-A106 PolarHBondContact O-N 3.1Å; F103-A106 PolarHBondContact O-N 2.87Å; S104-A106 PolarHBondContact O-N 3.24Å; A106-N109 PolarHBondContact O-N 3.48Å; A106-F110 WeakPolarHBondContact O-CB 3.36Å; A106-F110 PolarHBondContact O-N 3.21Å
107	L	96.6	Very high	95.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-40.8	177.3	-68.6	-168.5	0	0	0	112.7	A67 F103 S104 N109 F110 Q111 L191 D194 I195 I198	A67-L107 HydrophobicContact CB-CD2 3.65Å; F103-L107 HydrophobicContact CD1-CD1 4.39Å; F103-L107 HydrophobicContact CD2-CD1 4.49Å; F103-L107 HydrophobicContact CD2-CD2 4.36Å; F103-L107 HydrophobicContact CD2-CG 4.05Å; F103-L107 HydrophobicContact CE1-CD1 3.81Å; F103-L107 HydrophobicContact CE1-CG 4.4Å; F103-L107 HydrophobicContact CE2-CD1 3.92Å; F103-L107 HydrophobicContact CE2-CD2 3.65Å; F103-L107 HydrophobicContact CE2-CG 3.68Å; F103-L107 HydrophobicContact CZ-CD1 3.55Å; F103-L107 HydrophobicContact CZ-CD2 4.01Å; F103-L107 HydrophobicContact CZ-CG 3.88Å; F103-L107 WeakPolarHBondContact O-CG 3.48Å; F103-L107 PolarHBondContact O-N 2.93Å; S104-L107 PolarHBondContact O-N 3.45Å; L107-N109 VanDerWaalsContact C-N 3.32Å; L107-N109 PolarHBondContact O-N 3.5Å; L107-F110 PolarHBondContact O-N 3.08Å; L107-Q111 VanDerWaalsContact O-CB 3.31Å; L107-Q111 WeakPolarHBondContact O-CB 3.45Å; L107-Q111 PolarHBondContact O-N 3.42Å; L107-L191 HydrophobicContact CD2-CD2 3.95Å; L107-D194 HydrophobicContact CD1-CB 4.18Å; L107-I195 HydrophobicContact CB-CD1 3.85Å; L107-I195 HydrophobicContact CB-CG1 3.68Å; L107-I195 HydrophobicContact CD1-CG1 3.78Å; L107-I195 HydrophobicContact CG-CG1 4.42Å; L107-I198 HydrophobicContact CD1-CD1 4.07Å
108	N	95.9	Very high	95.8	Very high	73 Å²	73	45.8 Å²	45.8	39%	0.39	23%	0.23	S	C	.	.	H	α-helix	trans	-60.3	-43.5	176.2	-84.3	-73.6	0	0	0	111.5	S104 A105 Q111 A112	S104-N108 WeakPolarHBondContact O-CB 3.38Å; S104-N108 PolarHBondContact O-N 3.02Å; S104-N108 PolarHBondContact O-ND2 2.9Å; S104-N108 PolarHBondContact OG-ND2 3.12Å; A105-N108 PolarHBondContact O-N 3.32Å; N108-Q111 PolarHBondContact O-N 2.86Å; N108-A112 PolarHBondContact O-N 3.32Å
109	N	96.9	Very high	95.8	Very high	103 Å²	103	43 Å²	43	55%	0.551	22%	0.224	S	C	*	.	H	α-helix	trans	-63.8	-44.5	174.7	-78.6	-64.6	0	0	0	111.8	T33 A105 A106 L107 Q111 A112 V113	T33-N109 HydrophobicContact CG2-CB 4.42Å; A105-N109 PolarHBondContact O-N 3.04Å; A105-N109 VanDerWaalsContact O-N 3.12Å; A105-N109 PolarHBondContact O-ND2 3.34Å; A106-N109 PolarHBondContact O-N 3.48Å; L107-N109 VanDerWaalsContact C-N 3.32Å; L107-N109 PolarHBondContact O-N 3.5Å; N109-Q111 VanDerWaalsContact C-N 3.35Å; N109-Q111 PolarHBondContact O-N 3.28Å; N109-A112 PolarHBondContact O-N 2.9Å; N109-V113 WeakPolarHBondContact O-CG2 3.05Å; N109-V113 PolarHBondContact O-N 3.39Å; N109-V113 VanDerWaalsContact O-N 3.11Å
110	F	97.6	Very high	95.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-44.4	178	-179.8	-141.5	0	0	0	111.9	T33 I36 T63 A106 L107 A112 V113 Q114 L191	T33-F110 HydrophobicContact CG2-CB 4.28Å; T33-F110 WeakPolarHBondContact OG1-CB 3.27Å; I36-F110 HydrophobicContact CD1-CD2 4.25Å; I36-F110 HydrophobicContact CD1-CE2 3.66Å; T63-F110 HydrophobicContact CG2-CD1 3.71Å; T63-F110 HydrophobicContact CG2-CD2 3.95Å; T63-F110 HydrophobicContact CG2-CE1 3.49Å; T63-F110 VanDerWaalsContact CG2-CE1 3.49Å; T63-F110 HydrophobicContact CG2-CE2 3.79Å; T63-F110 HydrophobicContact CG2-CG 3.93Å; T63-F110 HydrophobicContact CG2-CZ 3.52Å; A106-F110 WeakPolarHBondContact O-CB 3.36Å; A106-F110 PolarHBondContact O-N 3.21Å; L107-F110 PolarHBondContact O-N 3.08Å; F110-A112 PolarHBondContact O-N 2.92Å; F110-V113 PolarHBondContact O-N 3.36Å; F110-Q114 HydrophobicContact CD2-CG 4.22Å; F110-Q114 HydrophobicContact CE2-CG 3.81Å; F110-Q114 HydrophobicContact CZ-CG 4.11Å; F110-Q114 PolarHBondContact O-N 3.21Å; F110-L191 HydrophobicContact CD1-CD1 3.46Å; F110-L191 VanDerWaalsContact CD1-CD1 3.46Å; F110-L191 HydrophobicContact CD1-CD2 4.16Å; F110-L191 HydrophobicContact CD1-CG 4.45Å; F110-L191 HydrophobicContact CE1-CD1 3.69Å; F110-L191 HydrophobicContact CE1-CD2 4.32Å; F110-L191 HydrophobicContact CG-CD1 4.27Å
111	Q	96.4	Very high	95.5	Very high	10 Å²	10	43.4 Å²	43.4	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-44.5	176.2	-171.2	-162.8	0.7	0	0	111.8	L107 N108 N109 V113 Q114 R115 I188 L191	L107-Q111 VanDerWaalsContact O-CB 3.31Å; L107-Q111 WeakPolarHBondContact O-CB 3.45Å; L107-Q111 PolarHBondContact O-N 3.42Å; N108-Q111 PolarHBondContact O-N 2.86Å; N109-Q111 VanDerWaalsContact C-N 3.35Å; N109-Q111 PolarHBondContact O-N 3.28Å; Q111-V113 VanDerWaalsContact C-N 3.28Å; Q111-V113 PolarHBondContact O-N 2.98Å; Q111-Q114 PolarHBondContact O-N 3.47Å; Q111-R115 WeakPolarHBondContact O-CG 3.34Å; Q111-R115 PolarHBondContact O-N 3.39Å; Q111-I188 HydrophobicContact CG-CG2 4.04Å; Q111-L191 HydrophobicContact CB-CD1 4.38Å
112	A	96.7	Very high	95.3	Very high	56 Å²	56	45 Å²	45	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-60.2	-39.9	177.3	0	0	0	0	0	111.7	N108 N109 F110 R115 R116	N108-A112 PolarHBondContact O-N 3.32Å; N109-A112 PolarHBondContact O-N 2.9Å; F110-A112 PolarHBondContact O-N 2.92Å; A112-R115 PolarHBondContact O-N 2.92Å; A112-R116 PolarHBondContact O-N 3.5Å; A112-R116 VanDerWaalsContact O-N 3.17Å
113	V	97.2	Very high	95	Very high	13 Å²	13	43.9 Å²	43.9	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-39.9	175.4	175.8	0	0	0	0	111.7	T33 I36 K37 N109 F110 Q111 R115 R116 A117	T33-V113 HydrophobicContact CG2-CB 4.29Å; T33-V113 HydrophobicContact CG2-CG2 3.81Å; I36-V113 HydrophobicContact CB-CG1 4.11Å; I36-V113 HydrophobicContact CG2-CG1 3.42Å; I36-V113 VanDerWaalsContact CG2-CG1 3.42Å; K37-V113 HydrophobicContact CB-CG1 4.07Å; K37-V113 HydrophobicContact CB-CG2 3.96Å; K37-V113 HydrophobicContact CD-CG2 4.39Å; K37-V113 HydrophobicContact CG-CG2 4.26Å; N109-V113 WeakPolarHBondContact O-CG2 3.05Å; N109-V113 PolarHBondContact O-N 3.39Å; N109-V113 VanDerWaalsContact O-N 3.11Å; F110-V113 PolarHBondContact O-N 3.36Å; Q111-V113 VanDerWaalsContact C-N 3.28Å; Q111-V113 PolarHBondContact O-N 2.98Å; V113-R115 VanDerWaalsContact C-N 3.33Å; V113-R115 PolarHBondContact O-N 2.63Å; V113-R116 PolarHBondContact O-N 2.99Å; V113-A117 PolarHBondContact O-N 2.97Å
114	Q	94.4	Very high	94.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-39.7	173.9	-76.4	-169.1	-11.5	0	0	112.2	N64 F110 Q111 R116 A117 A118 L184 I188	N64-Q114 PolarHBondContact OD1-NE2 3.09Å; F110-Q114 HydrophobicContact CD2-CG 4.22Å; F110-Q114 HydrophobicContact CE2-CG 3.81Å; F110-Q114 HydrophobicContact CZ-CG 4.11Å; F110-Q114 PolarHBondContact O-N 3.21Å; Q111-Q114 PolarHBondContact O-N 3.47Å; Q114-R116 VanDerWaalsContact C-N 3.34Å; Q114-R116 PolarHBondContact O-N 3.37Å; Q114-A117 WeakPolarHBondContact O-CB 3.4Å; Q114-A117 PolarHBondContact O-N 2.92Å; Q114-A118 PolarHBondContact O-N 3.48Å; Q114-L184 HydrophobicContact CG-CD2 4.43Å; Q114-I188 HydrophobicContact CB-CD1 4.06Å; Q114-I188 HydrophobicContact CB-CG1 3.72Å; Q114-I188 VanDerWaalsContact OE1-CG1 3.3Å
115	R	95.1	Very high	94.1	Very high	139 Å²	139	44.8 Å²	44.8	53%	0.525	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-44.1	174.6	-71.6	179.3	-175	-143.2	4.1	111.6	Q111 A112 V113 A117 A118 E119 I188	Q111-R115 WeakPolarHBondContact O-CG 3.34Å; Q111-R115 PolarHBondContact O-N 3.39Å; A112-R115 PolarHBondContact O-N 2.92Å; V113-R115 VanDerWaalsContact C-N 3.33Å; V113-R115 PolarHBondContact O-N 2.63Å; R115-A117 VanDerWaalsContact C-N 3.32Å; R115-A117 PolarHBondContact O-N 3.3Å; R115-A118 PolarHBondContact O-N 3.21Å; R115-E119 PolarHBondContact O-N 3.39Å; R115-I188 HydrophobicContact CG-CD1 3.91Å
116	R	95.4	Very high	93.6	Very high	113 Å²	113	45.1 Å²	45.1	43%	0.426	22%	0.224	S	C	.	.	H	α-helix	trans	-64.3	-36.5	176	-169.8	177.9	177.9	91.7	-3.5	112	V40 N41 A112 V113 Q114 E119 K120	V40-R116 HydrophobicContact CG1-CB 4.28Å; V40-R116 HydrophobicContact CG1-CG 3.89Å; N41-R116 PolarHBondContact OD1-NE 2.95Å; N41-R116 PolarHBondContact OD1-NH2 3.43Å; N41-R116 VanDerWaalsContact OD1-NH2 3.09Å; A112-R116 PolarHBondContact O-N 3.5Å; A112-R116 VanDerWaalsContact O-N 3.17Å; V113-R116 PolarHBondContact O-N 2.99Å; Q114-R116 VanDerWaalsContact C-N 3.34Å; Q114-R116 PolarHBondContact O-N 3.37Å; R116-E119 PolarHBondContact O-N 3.48Å; R116-K120 WeakPolarHBondContact O-CG 3.41Å; R116-K120 PolarHBondContact O-N 2.89Å
117	A	94.1	Very high	92.9	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-49.2	172.6	0	0	0	0	0	110.7	V40 V113 Q114 R115 E119 K120 E121 L184	V40-A117 HydrophobicContact CG1-CB 4.35Å; V40-A117 HydrophobicContact CG2-CB 3.64Å; V113-A117 PolarHBondContact O-N 2.97Å; Q114-A117 WeakPolarHBondContact O-CB 3.4Å; Q114-A117 PolarHBondContact O-N 2.92Å; R115-A117 VanDerWaalsContact C-N 3.32Å; R115-A117 PolarHBondContact O-N 3.3Å; A117-E119 VanDerWaalsContact C-N 3.3Å; A117-E119 PolarHBondContact O-N 2.74Å; A117-K120 WeakPolarHBondContact O-CB 3.19Å; A117-K120 PolarHBondContact O-N 3.45Å; A117-K120 VanDerWaalsContact O-N 3.13Å; A117-E121 WeakPolarHBondContact O-CG 3.47Å; A117-E121 PolarHBondContact O-N 2.93Å; A117-L184 HydrophobicContact CB-CD1 3.97Å; A117-L184 HydrophobicContact CB-CD2 4.46Å
118	A	93.3	Very high	92.2	Very high	2 Å²	2	51 Å²	51	2%	0.017	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-36.3	178.4	0	0	0	0	0	112.6	Q114 R115 R122 L184	Q114-A118 PolarHBondContact O-N 3.48Å; R115-A118 PolarHBondContact O-N 3.21Å; A118-R122 WeakPolarHBondContact O-CG 3.45Å; A118-R122 PolarHBondContact O-N 3.23Å; A118-L184 HydrophobicContact CB-CB 4.27Å; A118-L184 HydrophobicContact CB-CD1 4.01Å
119	E	94.1	Very high	91.5	Very high	104 Å²	104	52.8 Å²	52.8	49%	0.486	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-45.3	172.8	-173.3	174.6	-156.7	0	0	111.9	R115 R116 A117 E121 R122 E123	R115-E119 PolarHBondContact O-N 3.39Å; R116-E119 PolarHBondContact O-N 3.48Å; A117-E119 VanDerWaalsContact C-N 3.3Å; A117-E119 PolarHBondContact O-N 2.74Å; E119-E121 VanDerWaalsContact C-N 3.33Å; E119-E121 PolarHBondContact O-N 3.42Å; E119-R122 PolarHBondContact O-N 2.95Å; E119-R122 VanDerWaalsContact O-N 3.16Å; E119-E123 WeakPolarHBondContact O-CG 3.3Å; E119-E123 PolarHBondContact O-N 2.92Å
120	K	92.6	Very high	90.6	Very high	44 Å²	44	50.1 Å²	50.1	19%	0.191	25%	0.245	C	C	.	.	H	α-helix	trans	-60.6	-40.2	176.4	-76.4	-75.6	160	-150.3	0	112.9	V40 L43 R116 A117 E123 S124	V40-K120 HydrophobicContact CG1-CG 4.02Å; L43-K120 HydrophobicContact CB-CB 4.25Å; L43-K120 HydrophobicContact CD1-CB 4.21Å; R116-K120 WeakPolarHBondContact O-CG 3.41Å; R116-K120 PolarHBondContact O-N 2.89Å; A117-K120 WeakPolarHBondContact O-CB 3.19Å; A117-K120 PolarHBondContact O-N 3.45Å; A117-K120 VanDerWaalsContact O-N 3.13Å; K120-E123 IonicContact NZ-OE1 3.68Å; K120-E123 IonicContact NZ-OE2 2.74Å; K120-E123 PolarHBondContact NZ-OE2 3.34Å; K120-E123 PolarHBondContact O-N 3.34Å; K120-S124 PolarHBondContact O-N 2.85Å
121	E	90.2	Very high	89	Confident	9 Å²	9	52.1 Å²	52.1	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-43.8	174.3	-64.3	-63.4	172.8	0	0	111.5	A117 E119 E123 S124 I125 R177 I181 L184	A117-E121 WeakPolarHBondContact O-CG 3.47Å; A117-E121 PolarHBondContact O-N 2.93Å; E119-E121 VanDerWaalsContact C-N 3.33Å; E119-E121 PolarHBondContact O-N 3.42Å; E121-E123 PolarHBondContact O-N 2.91Å; E121-S124 WeakPolarHBondContact O-CB 3.44Å; E121-S124 PolarHBondContact O-N 3.33Å; E121-S124 VanDerWaalsContact O-N 3.14Å; E121-I125 WeakPolarHBondContact O-CG1 3.4Å; E121-I125 PolarHBondContact O-N 3.46Å; E121-R177 IonicContact OE1-NH1 3.93Å; E121-R177 PolarHBondContact OE1-NH1 2.93Å; E121-R177 VanDerWaalsContact OE1-NH1 3.16Å; E121-R177 WeakPolarHBondContact OE2-CD 3.45Å; E121-R177 IonicContact OE2-CZ 3.57Å; E121-R177 IonicContact OE2-NE 3.58Å; E121-R177 IonicContact OE2-NH1 2.76Å; E121-R177 PolarHBondContact OE2-NH1 3.46Å; E121-I181 HydrophobicContact CB-CD1 3.87Å; E121-I181 HydrophobicContact CB-CG1 3.51Å; E121-I181 HydrophobicContact CG-CG1 4.37Å; E121-L184 HydrophobicContact CG-CD1 4.44Å
122	R	90.7	Very high	87.2	Confident	117 Å²	117	52.3 Å²	52.3	44%	0.442	27%	0.268	S	S	.	.	H	α-helix	trans	-62.2	-43.4	175.6	-72.8	-177.2	-165.2	105.8	-1.5	112.3	A118 E119 S124 I125 A126 I181 E185	A118-R122 WeakPolarHBondContact O-CG 3.45Å; A118-R122 PolarHBondContact O-N 3.23Å; E119-R122 PolarHBondContact O-N 2.95Å; E119-R122 VanDerWaalsContact O-N 3.16Å; R122-S124 VanDerWaalsContact C-N 3.26Å; R122-S124 PolarHBondContact O-N 3.37Å; R122-I125 PolarHBondContact O-N 3.41Å; R122-A126 PolarHBondContact O-N 3.48Å; R122-I181 HydrophobicContact CB-CD1 4.47Å; R122-I181 HydrophobicContact CG-CD1 3.61Å; R122-I181 HydrophobicContact CG-CG1 4.41Å; R122-E185 IonicContact CZ-OE1 3.87Å; R122-E185 IonicContact NH2-OE1 2.71Å; R122-E185 PolarHBondContact NH2-OE1 3Å
123	E	90.8	Very high	85.2	Confident	68 Å²	68	52.3 Å²	52.3	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-38.2	174.1	-70.8	174.7	-173.7	0	0	111.4	E119 K120 E121 A126 R127	E119-E123 WeakPolarHBondContact O-CG 3.3Å; E119-E123 PolarHBondContact O-N 2.92Å; K120-E123 IonicContact NZ-OE1 3.68Å; K120-E123 IonicContact NZ-OE2 2.74Å; K120-E123 PolarHBondContact NZ-OE2 3.34Å; K120-E123 PolarHBondContact O-N 3.34Å; E121-E123 PolarHBondContact O-N 2.91Å; E123-A126 PolarHBondContact O-N 3.48Å; E123-R127 WeakPolarHBondContact O-CG 3.47Å; E123-R127 PolarHBondContact O-N 2.81Å; E123-R127 IonicContact OE2-NH1 2.81Å
124	S	86.4	Confident	83	Confident	22 Å²	22	57 Å²	57	15%	0.154	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-45	178.4	-158	0	0	0	0	112.3	K120 E121 R122 A126 R127 A128	K120-S124 PolarHBondContact O-N 2.85Å; E121-S124 WeakPolarHBondContact O-CB 3.44Å; E121-S124 PolarHBondContact O-N 3.33Å; E121-S124 VanDerWaalsContact O-N 3.14Å; R122-S124 VanDerWaalsContact C-N 3.26Å; R122-S124 PolarHBondContact O-N 3.37Å; S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 3.48Å; S124-R127 VanDerWaalsContact CA-NH2 3.31Å; S124-R127 PolarHBondContact O-N 3.36Å; S124-A128 PolarHBondContact O-N 2.89Å
125	I	86.7	Confident	80.8	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.056	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-44.7	174.1	-66.9	164.9	0	0	0	110.6	E121 R122 R127 A128 R129 I174 R177 E178 I181	E121-I125 WeakPolarHBondContact O-CG1 3.4Å; E121-I125 PolarHBondContact O-N 3.46Å; R122-I125 PolarHBondContact O-N 3.41Å; I125-R127 VanDerWaalsContact C-N 3.32Å; I125-R127 PolarHBondContact O-N 3.19Å; I125-A128 PolarHBondContact O-N 3.19Å; I125-R129 VanDerWaalsContact CG2-CZ 3.46Å; I125-R129 WeakPolarHBondContact O-CG 3.26Å; I125-R129 PolarHBondContact O-N 3.41Å; I125-I174 HydrophobicContact CG2-CG1 4.47Å; I125-I174 HydrophobicContact CG2-CG2 4.04Å; I125-R177 HydrophobicContact CD1-CB 3.77Å; I125-R177 HydrophobicContact CG1-CB 3.57Å; I125-R177 HydrophobicContact CG1-CG 4.44Å; I125-E178 HydrophobicContact CD1-CG 3.69Å; I125-I181 HydrophobicContact CD1-CD1 3.42Å; I125-I181 VanDerWaalsContact CD1-CD1 3.42Å
126	A	86.4	Confident	78.4	Confident	57 Å²	57	57.1 Å²	57.1	47%	0.471	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-40.2	178.5	0	0	0	0	0	112.1	R122 E123 S124 A130	R122-A126 PolarHBondContact O-N 3.48Å; E123-A126 PolarHBondContact O-N 3.48Å; S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 3.48Å; A126-A130 WeakPolarHBondContact O-CB 3.12Å; A126-A130 PolarHBondContact O-N 2.96Å
127	R	83.8	Confident	76.1	Confident	104 Å²	104	57.8 Å²	57.8	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-44.9	175.1	-75	-170.7	-58.2	-88.4	-3.2	112.8	G44 E123 S124 I125 R129 A130 G131	G44-R127 VanDerWaalsContact CA-NH2 3.31Å; E123-R127 WeakPolarHBondContact O-CG 3.47Å; E123-R127 PolarHBondContact O-N 2.81Å; E123-R127 IonicContact OE2-NH1 2.81Å; S124-R127 VanDerWaalsContact CA-NH2 3.31Å; S124-R127 PolarHBondContact O-N 3.36Å; I125-R127 VanDerWaalsContact C-N 3.32Å; I125-R127 PolarHBondContact O-N 3.19Å; R127-R129 VanDerWaalsContact C-N 3.28Å; R127-R129 PolarHBondContact O-N 3.45Å; R127-A130 PolarHBondContact O-N 3.11Å; R127-G131 PolarHBondContact O-N 3.31Å
128	A	81.7	Confident	73.8	Confident	26 Å²	26	63.7 Å²	63.7	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-59.1	-42.7	177.4	0	0	0	0	0	111.1	S124 I125 S132 I174	S124-A128 PolarHBondContact O-N 2.89Å; I125-A128 PolarHBondContact O-N 3.19Å; A128-S132 PolarHBondContact O-N 2.71Å; A128-I174 HydrophobicContact CB-CD1 4.03Å; A128-I174 HydrophobicContact CB-CG1 3.95Å
129	R	80.9	Confident	71.5	Confident	109 Å²	109	72.1 Å²	72.1	41%	0.411	38%	0.375	S	S	.	.	H	α-helix	trans	-64.3	-42	175	-68.9	176.8	-177.6	170.5	5	113	I125 R127 C133 I166 I174 E178	I125-R129 VanDerWaalsContact CG2-CZ 3.46Å; I125-R129 WeakPolarHBondContact O-CG 3.26Å; I125-R129 PolarHBondContact O-N 3.41Å; R127-R129 VanDerWaalsContact C-N 3.28Å; R127-R129 PolarHBondContact O-N 3.45Å; R129-C133 PolarHBondContact O-SG 3.23Å; R129-C133 VanDerWaalsContact O-SG 3.37Å; R129-I166 HydrophobicContact CG-CD1 4.36Å; R129-I174 HydrophobicContact CG-CD1 3.87Å; R129-E178 IonicContact NH2-OE1 3.76Å; R129-E178 PolarHBondContact NH2-OE1 2.92Å
130	A	78.2	Confident	69.2	Low	48 Å²	48	72.6 Å²	72.6	40%	0.397	38%	0.376	S	S	.	.	H	α-helix	trans	-76.4	-33.4	-179	0	0	0	0	0	113.8	A126 R127 S132 C133 L134	A126-A130 WeakPolarHBondContact O-CB 3.12Å; A126-A130 PolarHBondContact O-N 2.96Å; R127-A130 PolarHBondContact O-N 3.11Å; A130-S132 VanDerWaalsContact C-N 3.28Å; A130-S132 PolarHBondContact O-N 3.17Å; A130-C133 VanDerWaalsContact O-CB 3.3Å; A130-C133 WeakPolarHBondContact O-CB 3.07Å; A130-C133 PolarHBondContact O-N 3.02Å; A130-L134 PolarHBondContact O-N 3.36Å
131	G	63.7	Low	67	Low	41 Å²	41	79.6 Å²	79.6	42%	0.423	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-36.5	175.8	0	0	0	0	0	112.2	R127 C133 L134 S135	R127-G131 PolarHBondContact O-N 3.31Å; G131-C133 VanDerWaalsContact C-N 3.29Å; G131-C133 PolarHBondContact O-N 3.01Å; G131-L134 PolarHBondContact O-N 3.08Å; G131-S135 PolarHBondContact O-N 2.91Å; G131-S135 VanDerWaalsContact O-N 3.16Å
132	S	58.3	Low	64.8	Low	15 Å²	15	85.2 Å²	85.2	11%	0.105	43%	0.432	C	S	.	.	H	α-helix	trans	-61.5	-34.2	170.7	175.3	0	0	0	0	112.5	A128 A130 A165 I166	A128-S132 PolarHBondContact O-N 2.71Å; A130-S132 VanDerWaalsContact C-N 3.28Å; A130-S132 PolarHBondContact O-N 3.17Å; S132-A165 PolarHBondContact OG-O 3.28Å; S132-I166 WeakPolarHBondContact OG-CA 3.5Å; S132-I166 PolarHBondContact OG-N 3.48Å
133	C	54.6	Low	62.7	Low	56 Å²	56	87 Å²	87	38%	0.378	45%	0.445	S	S	.	.	H	α-helix	trans	-67.7	-45.1	174.6	-52.3	0	0	0	0	113	R129 A130 G131 N136 M164	R129-C133 PolarHBondContact O-SG 3.23Å; R129-C133 VanDerWaalsContact O-SG 3.37Å; A130-C133 VanDerWaalsContact O-CB 3.3Å; A130-C133 WeakPolarHBondContact O-CB 3.07Å; A130-C133 PolarHBondContact O-N 3.02Å; G131-C133 VanDerWaalsContact C-N 3.29Å; G131-C133 PolarHBondContact O-N 3.01Å; C133-N136 PolarHBondContact O-N 3.24Å; C133-M164 WeakPolarHBondContact SG-CE 3.41Å
134	L	51.2	Low	60.3	Low	111 Å²	111	92.3 Å²	92.3	58%	0.581	47%	0.467	S	S	*	.	H	α-helix	trans	-74.6	-31	-172.7	-68.1	171.4	0	0	0	112.9	A130 G131 N136 E137	A130-L134 PolarHBondContact O-N 3.36Å; G131-L134 PolarHBondContact O-N 3.08Å; L134-N136 PolarHBondContact O-N 2.91Å; L134-E137 PolarHBondContact O-N 2.9Å
135	S	48.6	Very low	58.4	Low	77 Å²	77	98.3 Å²	98.3	54%	0.538	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-18.5	175	-172.2	0	0	0	0	113.2	G131	G131-S135 PolarHBondContact O-N 2.91Å; G131-S135 VanDerWaalsContact O-N 3.16Å
136	N	45.7	Very low	56.5	Low	64 Å²	64	103.6 Å²	103.6	34%	0.342	53%	0.529	S	S	.	.	H	α-helix	trans	-91.7	-32.2	175.2	-98.9	12.4	0	0	0	113	C133 L134 D138 R139 F140	C133-N136 PolarHBondContact O-N 3.24Å; L134-N136 PolarHBondContact O-N 2.91Å; N136-D138 VanDerWaalsContact C-N 3.25Å; N136-D138 PolarHBondContact O-N 2.97Å; N136-R139 WeakPolarHBondContact O-CB 3.45Å; N136-R139 PolarHBondContact O-N 3.47Å; N136-F140 HydrophobicContact CB-CD2 4.37Å; N136-F140 HydrophobicContact CB-CE2 4.37Å; N136-F140 WeakPolarHBondContact O-CD2 3.43Å; N136-F140 PolarHBondContact O-N 2.98Å
137	E	47.1	Very low	54.1	Low	128 Å²	128	106.3 Å²	106.3	60%	0.598	55%	0.545	S	S	*	.	H	α-helix	trans	-60.6	-34.8	175.2	-99.5	-170	126.2	0	0	112.6	L134 F140 R141	L134-E137 PolarHBondContact O-N 2.9Å; E137-F140 PolarHBondContact O-N 3.32Å; E137-R141 PolarHBondContact O-N 3.23Å; E137-R141 VanDerWaalsContact O-N 3.07Å
138	D	45.1	Very low	52	Low	125 Å²	125	110.7 Å²	110.7	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-69.7	-34.6	173.7	-109.6	-11	0	0	0	112.2	N136 R141 D142	N136-D138 VanDerWaalsContact C-N 3.25Å; N136-D138 PolarHBondContact O-N 2.97Å; D138-R141 PolarHBondContact O-N 3.42Å; D138-D142 PolarHBondContact O-N 3.45Å; D138-D142 VanDerWaalsContact O-N 3.15Å
139	R	44.4	Very low	50.1	Low	179 Å²	179	116.3 Å²	116.3	68%	0.675	59%	0.594	S	S	*	*	H	α-helix	trans	-68	-37.9	172.1	-75.7	-177.3	172.7	-106.5	0.9	112.2	N136 R141 D142 E143	N136-R139 WeakPolarHBondContact O-CB 3.45Å; N136-R139 PolarHBondContact O-N 3.47Å; R139-R141 VanDerWaalsContact C-N 3.35Å; R139-R141 PolarHBondContact O-N 2.85Å; R139-D142 PolarHBondContact O-N 3.42Å; R139-E143 PolarHBondContact O-N 2.65Å; R139-E143 VanDerWaalsContact O-N 3.1Å
140	F	45.8	Very low	47.9	Very low	113 Å²	113	118.8 Å²	118.8	50%	0.496	62%	0.615	S	S	.	*	H	α-helix	trans	-71.3	-25.2	176.9	-82.9	-71.4	0	0	0	113.7	N136 E137	N136-F140 HydrophobicContact CB-CD2 4.37Å; N136-F140 HydrophobicContact CB-CE2 4.37Å; N136-F140 WeakPolarHBondContact O-CD2 3.43Å; N136-F140 PolarHBondContact O-N 2.98Å; E137-F140 PolarHBondContact O-N 3.32Å
141	R	46.9	Very low	46.3	Very low	191 Å²	191	123.8 Å²	123.8	72%	0.721	63%	0.63	S	S	*	*	H	α-helix	trans	-78.6	-36.8	171.2	-84.6	-171.6	-174.2	-112.5	1.5	112.7	E137 D138 R139	E137-R141 PolarHBondContact O-N 3.23Å; E137-R141 VanDerWaalsContact O-N 3.07Å; D138-R141 PolarHBondContact O-N 3.42Å; R139-R141 VanDerWaalsContact C-N 3.35Å; R139-R141 PolarHBondContact O-N 2.85Å
142	D	44.2	Very low	45.3	Very low	128 Å²	128	129.7 Å²	129.7	68%	0.684	65%	0.647	S	S	*	*	H	α-helix	trans	-75.9	-31	-176.7	-144	34.8	0	0	0	112.2	D138 R139	D138-D142 PolarHBondContact O-N 3.45Å; D138-D142 VanDerWaalsContact O-N 3.15Å; R139-D142 PolarHBondContact O-N 3.42Å
143	E	45.8	Very low	44.4	Very low	154 Å²	154	136.3 Å²	136.3	72%	0.72	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-80.3	-17	176.9	-152.9	169.6	-161.5	0	0	113.5	R139	R139-E143 PolarHBondContact O-N 2.65Å; R139-E143 VanDerWaalsContact O-N 3.1Å
144	K	41.5	Very low	44.2	Very low	179 Å²	179	142.1 Å²	142.1	78%	0.778	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-88.8	-2.1	179.3	-159.9	170.2	-176.9	174.9	0	114.4
145	L	46.9	Very low	43.7	Very low	148 Å²	148	138.9 Å²	138.9	78%	0.775	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-95.5	6.2	177.7	-67.6	177	0	0	0	114
146	V	46	Very low	43.4	Very low	123 Å²	123	140.8 Å²	140.8	75%	0.745	71%	0.711	S	S	*	*			trans	-130.6	75.5	176.1	-103.6	0	0	0	0	111.2
147	S	36.8	Very low	43.5	Very low	114 Å²	114	145.5 Å²	145.5	80%	0.797	73%	0.734	S	S	*	*			trans	-162.2	119.4	133.6	-161.7	0	0	0	0	110.9
148	F	38.7	Very low	43.1	Very low	195 Å²	195	143.8 Å²	143.8	86%	0.855	73%	0.733	S	S	*	*			trans	-57.1	148.3	161.7	-90.4	-111.1	0	0	0	111.1
149	D	41.2	Very low	43	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	74%	0.74	S	S	*	*			trans	25.8	103.2	144.9	-127.2	-1.6	0	0	0	116.4
150	N	36	Very low	42.7	Very low	160 Å²	160	142.1 Å²	142.1	86%	0.856	74%	0.738	S	S	*	*			trans	-173.7	137.5	130.9	-93.7	1.4	0	0	0	112.9
151	Q	43.9	Very low	42.6	Very low	154 Å²	154	142.6 Å²	142.6	72%	0.72	75%	0.75	S	S	*	*			trans	-42.3	148	170	177.3	173	13.3	0	0	117.1
152	E	43.5	Very low	42.3	Very low	165 Å²	165	139 Å²	139	77%	0.771	74%	0.742	S	S	*	*			trans	65.8	107.1	157.3	-75.7	159.7	-164.3	0	0	118.9
153	D	39.1	Very low	42.3	Very low	153 Å²	153	141 Å²	141	82%	0.818	75%	0.747	S	S	*	*				168.7	115.5	114.2	-168.8	25	0	0	0	109.7	G155	D153-G155 PolarHBondContact O-N 2.94Å
154	L	49.9	Very low	42.4	Very low	179 Å²	179	139.1 Å²	139.1	94%	0.937	74%	0.74	S	S	*	*			trans	-81.1	74.3	173.5	-75.9	167.8	0	0	0	108.7
155	G	41.1	Very low	43.1	Very low	42 Å²	42	134.1 Å²	134.1	43%	0.433	73%	0.732	S	S	.	*			trans	-72.9	150.4	166.6	0	0	0	0	0	111.4	D153 I157	D153-G155 PolarHBondContact O-N 2.94Å; G155-I157 PolarHBondContact O-N 3.22Å; G155-I157 VanDerWaalsContact O-N 3.16Å
156	P	42.3	Very low	43.9	Very low	118 Å²	118	129.4 Å²	129.4	77%	0.766	71%	0.707	S	S	*	*			trans	-62.3	124.2	-170.9	27.2	-32.7	0	0	0	109.1	T158	P156-T158 PolarHBondContact O-N 3.04Å
157	I	47	Very low	45.2	Very low	162 Å²	162	126.8 Å²	126.8	83%	0.831	69%	0.691	S	S	*	*			trans	-56.8	92.5	164.2	-66.5	164.8	0	0	0	105.4	G155 T159	G155-I157 PolarHBondContact O-N 3.22Å; G155-I157 VanDerWaalsContact O-N 3.16Å; I157-T159 PolarHBondContact O-N 3.46Å
158	T	39.8	Very low	47.2	Very low	93 Å²	93	127.2 Å²	127.2	57%	0.571	68%	0.681	S	S	*	*			trans	-55.8	112.8	164.7	47.5	0	0	0	0	104	P156 Q160	P156-T158 PolarHBondContact O-N 3.04Å; T158-Q160 PolarHBondContact O-N 3.35Å
159	T	42.7	Very low	48.9	Very low	133 Å²	133	124.8 Å²	124.8	82%	0.816	67%	0.672	S	S	*	*			trans	-58.5	72.2	158.8	7.6	0	0	0	0	106	I157 T161	I157-T159 PolarHBondContact O-N 3.46Å; T159-T161 PolarHBondContact O-N 3.46Å
160	Q	38.6	Very low	50.6	Low	136 Å²	136	120 Å²	120	64%	0.636	65%	0.646	S	S	*	*			trans	-66.9	98.3	157.7	-67.8	-172.9	40	0	0	102.4	T158 E162	T158-Q160 PolarHBondContact O-N 3.35Å; Q160-E162 HydrophobicContact CB-CG 4.17Å; Q160-E162 PolarHBondContact O-N 3.3Å
161	T	42.2	Very low	52.7	Low	123 Å²	123	115.1 Å²	115.1	76%	0.755	62%	0.62	S	S	*	*			trans	-54	76.2	146.5	-48.1	0	0	0	0	105.6	T159 E163	T159-T161 PolarHBondContact O-N 3.46Å; T161-E163 PolarHBondContact O-N 3.45Å
162	E	40.7	Very low	54.7	Low	116 Å²	116	113.5 Å²	113.5	54%	0.542	61%	0.612	S	S	.	*			trans	-62.8	92.1	159	-78.8	-178.2	163.3	0	0	103.1	Q160 M164	Q160-E162 HydrophobicContact CB-CG 4.17Å; Q160-E162 PolarHBondContact O-N 3.3Å; E162-M164 PolarHBondContact O-N 3.05Å
163	E	44.6	Very low	56.4	Low	169 Å²	169	109.3 Å²	109.3	79%	0.79	60%	0.595	S	S	*	*			trans	-45.3	111.1	163.7	-74	-175.6	146.8	0	0	105.9	T161 A165	T161-E163 PolarHBondContact O-N 3.45Å; E163-A165 PolarHBondContact O-N 2.91Å
164	M	48.1	Very low	58.6	Low	115 Å²	115	102.6 Å²	102.6	57%	0.567	56%	0.559	S	S	*	*			trans	-43.3	104.7	175.6	-66.9	162.2	50.8	0	0	107.8	C133 E162 I166	C133-M164 WeakPolarHBondContact SG-CE 3.41Å; E162-M164 PolarHBondContact O-N 3.05Å; M164-I166 PolarHBondContact O-N 3.3Å
165	A	56	Low	60.4	Low	74 Å²	74	99.2 Å²	99.2	61%	0.612	54%	0.537	S	S	*	.			trans	-75.7	79.2	-173.9	0	0	0	0	0	108.6	S132 E163 T167	S132-A165 PolarHBondContact OG-O 3.28Å; E163-A165 PolarHBondContact O-N 2.91Å; A165-T167 PolarHBondContact O-N 2.85Å
166	I	62.8	Low	62.5	Low	48 Å²	48	101.2 Å²	101.2	25%	0.246	53%	0.534	C	S	.	.			trans	-51.4	124.5	156.7	-61.8	174.8	0	0	0	105	R129 S132 M164 D170 L171 I174	R129-I166 HydrophobicContact CG-CD1 4.36Å; S132-I166 WeakPolarHBondContact OG-CA 3.5Å; S132-I166 PolarHBondContact OG-N 3.48Å; M164-I166 PolarHBondContact O-N 3.3Å; I166-D170 HydrophobicContact CG2-CB 3.54Å; I166-L171 HydrophobicContact CG2-CB 4.19Å; I166-L171 HydrophobicContact CG2-CD1 4.23Å; I166-I174 HydrophobicContact CD1-CD1 4.46Å; I166-I174 HydrophobicContact CG2-CD1 4.09Å
167	T	75.1	Confident	64.6	Low	69 Å²	69	96.6 Å²	96.6	42%	0.423	50%	0.502	S	S	.	.			trans	-61.5	151.9	179.2	68.7	0	0	0	0	109.2	A165 E169 D170 L171	A165-T167 PolarHBondContact O-N 2.85Å; T167-E169 PolarHBondContact O-N 3.07Å; T167-D170 PolarHBondContact O-N 3.05Å; T167-D170 VanDerWaalsContact O-N 3.08Å; T167-D170 WeakPolarHBondContact OG1-CB 3.46Å; T167-D170 PolarHBondContact OG1-N 3.04Å; T167-D170 VanDerWaalsContact OG1-N 3.09Å; T167-D170 PolarHBondContact OG1-OD2 3.36Å; T167-L171 PolarHBondContact O-N 3.12Å
168	E	77.8	Confident	66.6	Low	123 Å²	123	91.9 Å²	91.9	58%	0.575	48%	0.476	S	S	*	.	H	α-helix	trans	-56.7	-35.6	178.1	-172.7	62.7	-150.8	0	0	111.2	L171 E172	E168-L171 WeakPolarHBondContact O-CB 3.48Å; E168-L171 PolarHBondContact O-N 3.03Å; E168-E172 WeakPolarHBondContact O-CG 3.49Å; E168-E172 PolarHBondContact O-N 3.18Å
169	E	74.6	Confident	69	Low	143 Å²	143	90.5 Å²	90.5	67%	0.668	47%	0.468	S	S	*	.	H	α-helix	trans	-63.6	-46.1	174.8	-174.2	174.8	-173.7	0	0	112.3	T167 L171 E172 L173	T167-E169 PolarHBondContact O-N 3.07Å; E169-L171 VanDerWaalsContact C-N 3.26Å; E169-L171 PolarHBondContact O-N 2.86Å; E169-E172 PolarHBondContact O-N 3.44Å; E169-L173 WeakPolarHBondContact O-CG 3.49Å; E169-L173 PolarHBondContact O-N 2.94Å
170	D	77.1	Confident	71.1	Confident	44 Å²	44	85 Å²	85	24%	0.235	43%	0.433	C	S	.	.	H	α-helix	trans	-62.7	-35.8	174.4	-69.4	-45.6	0	0	0	111.6	I166 T167 L173 I174	I166-D170 HydrophobicContact CG2-CB 3.54Å; T167-D170 PolarHBondContact O-N 3.05Å; T167-D170 VanDerWaalsContact O-N 3.08Å; T167-D170 WeakPolarHBondContact OG1-CB 3.46Å; T167-D170 PolarHBondContact OG1-N 3.04Å; T167-D170 VanDerWaalsContact OG1-N 3.09Å; T167-D170 PolarHBondContact OG1-OD2 3.36Å; D170-L173 PolarHBondContact O-N 3.29Å; D170-I174 WeakPolarHBondContact O-CB 3.32Å; D170-I174 WeakPolarHBondContact O-CD1 3.5Å; D170-I174 WeakPolarHBondContact O-CG1 3.49Å; D170-I174 PolarHBondContact O-N 3.46Å
171	L	80.7	Confident	73.6	Confident	59 Å²	59	79.2 Å²	79.2	31%	0.309	41%	0.407	S	S	.	.	H	α-helix	trans	-66.5	-42.4	179	-162.8	94.9	0	0	0	111.3	I166 T167 E168 E169 I174 K175	I166-L171 HydrophobicContact CG2-CB 4.19Å; I166-L171 HydrophobicContact CG2-CD1 4.23Å; T167-L171 PolarHBondContact O-N 3.12Å; E168-L171 WeakPolarHBondContact O-CB 3.48Å; E168-L171 PolarHBondContact O-N 3.03Å; E169-L171 VanDerWaalsContact C-N 3.26Å; E169-L171 PolarHBondContact O-N 2.86Å; L171-I174 PolarHBondContact O-N 3.21Å; L171-K175 VanDerWaalsContact O-CG 3.3Å; L171-K175 WeakPolarHBondContact O-CG 3.49Å; L171-K175 PolarHBondContact O-N 3.31Å
172	E	84.1	Confident	75.9	Confident	120 Å²	120	80.8 Å²	80.8	56%	0.561	40%	0.399	S	S	*	.	H	α-helix	trans	-62.4	-47.5	174.1	-73.9	-175.9	170.2	0	0	111.6	E168 E169 I174 K175 E176	E168-E172 WeakPolarHBondContact O-CG 3.49Å; E168-E172 PolarHBondContact O-N 3.18Å; E169-E172 PolarHBondContact O-N 3.44Å; E172-I174 VanDerWaalsContact C-N 3.33Å; E172-I174 PolarHBondContact O-N 2.9Å; E172-K175 WeakPolarHBondContact O-CB 3.36Å; E172-K175 PolarHBondContact O-N 2.99Å; E172-E176 PolarHBondContact O-N 3.33Å
173	L	80.9	Confident	78.1	Confident	77 Å²	77	80.5 Å²	80.5	40%	0.403	40%	0.397	S	S	.	.	H	α-helix	trans	-59.3	-43.7	175.5	-71.3	171.9	0	0	0	111.3	E169 D170 K175 E176 R177	E169-L173 WeakPolarHBondContact O-CG 3.49Å; E169-L173 PolarHBondContact O-N 2.94Å; D170-L173 PolarHBondContact O-N 3.29Å; L173-K175 PolarHBondContact O-N 2.86Å; L173-E176 PolarHBondContact O-N 3.48Å; L173-R177 WeakPolarHBondContact O-CG 3.28Å; L173-R177 PolarHBondContact O-N 3.18Å
174	I	85	Confident	80.3	Confident	11 Å²	11	72.9 Å²	72.9	6%	0.056	36%	0.362	C	S	.	.	H	α-helix	trans	-61	-44.2	176.9	-73	164.1	0	0	0	111.1	I125 A128 R129 I166 D170 L171 E172 E176 R177 E178	I125-I174 HydrophobicContact CG2-CG1 4.47Å; I125-I174 HydrophobicContact CG2-CG2 4.04Å; A128-I174 HydrophobicContact CB-CD1 4.03Å; A128-I174 HydrophobicContact CB-CG1 3.95Å; R129-I174 HydrophobicContact CG-CD1 3.87Å; I166-I174 HydrophobicContact CD1-CD1 4.46Å; I166-I174 HydrophobicContact CG2-CD1 4.09Å; D170-I174 WeakPolarHBondContact O-CB 3.32Å; D170-I174 WeakPolarHBondContact O-CD1 3.5Å; D170-I174 WeakPolarHBondContact O-CG1 3.49Å; D170-I174 PolarHBondContact O-N 3.46Å; L171-I174 PolarHBondContact O-N 3.21Å; E172-I174 VanDerWaalsContact C-N 3.33Å; E172-I174 PolarHBondContact O-N 2.9Å; I174-E176 VanDerWaalsContact C-N 3.33Å; I174-E176 PolarHBondContact O-N 3.35Å; I174-R177 PolarHBondContact O-N 2.94Å; I174-E178 HydrophobicContact CG2-CG 4.4Å; I174-E178 WeakPolarHBondContact O-CG 3.18Å; I174-E178 PolarHBondContact O-N 2.8Å
175	K	86.6	Confident	82.2	Confident	109 Å²	109	71.2 Å²	71.2	47%	0.474	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-41.2	178.4	-74	168.7	-174.7	166.5	0	112.1	L171 E172 L173 T179	L171-K175 VanDerWaalsContact O-CG 3.3Å; L171-K175 WeakPolarHBondContact O-CG 3.49Å; L171-K175 PolarHBondContact O-N 3.31Å; E172-K175 WeakPolarHBondContact O-CB 3.36Å; E172-K175 PolarHBondContact O-N 2.99Å; L173-K175 PolarHBondContact O-N 2.86Å; K175-T179 PolarHBondContact O-N 3.41Å; K175-T179 VanDerWaalsContact O-N 3.09Å; K175-T179 PolarHBondContact O-OG1 3.41Å
176	E	85.8	Confident	84	Confident	83 Å²	83	71.9 Å²	71.9	39%	0.388	35%	0.349	S	S	.	.	H	α-helix	trans	-60.9	-48.8	175.8	-173.9	-174.5	176.7	0	0	110.8	E172 L173 I174 E178 T179 N180	E172-E176 PolarHBondContact O-N 3.33Å; L173-E176 PolarHBondContact O-N 3.48Å; I174-E176 VanDerWaalsContact C-N 3.33Å; I174-E176 PolarHBondContact O-N 3.35Å; E176-E178 VanDerWaalsContact C-N 3.35Å; E176-E178 PolarHBondContact O-N 2.89Å; E176-T179 WeakPolarHBondContact O-CB 3.31Å; E176-T179 PolarHBondContact O-N 3.43Å; E176-T179 VanDerWaalsContact O-N 3.09Å; E176-N180 PolarHBondContact O-N 3.47Å
177	R	87.4	Confident	85.3	Confident	22 Å²	22	70.8 Å²	70.8	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-62.7	-40.4	-179.3	-61.3	-77.5	176.7	176.4	11.5	112.1	D48 Q53 E121 I125 L173 I174 T179 N180 I181	D48-R177 IonicContact OD1-NH2 3.83Å; D48-R177 IonicContact OD2-NH2 3.67Å; Q53-R177 VanDerWaalsContact CD-CZ 3.49Å; Q53-R177 VanDerWaalsContact OE1-NH2 3.15Å; E121-R177 IonicContact OE1-NH1 3.93Å; E121-R177 PolarHBondContact OE1-NH1 2.93Å; E121-R177 VanDerWaalsContact OE1-NH1 3.16Å; E121-R177 WeakPolarHBondContact OE2-CD 3.45Å; E121-R177 IonicContact OE2-CZ 3.57Å; E121-R177 IonicContact OE2-NE 3.58Å; E121-R177 IonicContact OE2-NH1 2.76Å; E121-R177 PolarHBondContact OE2-NH1 3.46Å; I125-R177 HydrophobicContact CD1-CB 3.77Å; I125-R177 HydrophobicContact CG1-CB 3.57Å; I125-R177 HydrophobicContact CG1-CG 4.44Å; L173-R177 WeakPolarHBondContact O-CG 3.28Å; L173-R177 PolarHBondContact O-N 3.18Å; I174-R177 PolarHBondContact O-N 2.94Å; R177-T179 VanDerWaalsContact C-N 3.31Å; R177-T179 PolarHBondContact O-N 3.44Å; R177-N180 PolarHBondContact O-N 3.12Å; R177-I181 WeakPolarHBondContact O-CG1 3.43Å; R177-I181 PolarHBondContact O-N 3.2Å
178	E	88.6	Confident	86	Confident	62 Å²	62	68.3 Å²	68.3	29%	0.29	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-37.7	174.3	-74.7	-173.4	171.4	0	0	112.3	I125 R129 I174 E176 I181 R182	I125-E178 HydrophobicContact CD1-CG 3.69Å; R129-E178 IonicContact NH2-OE1 3.76Å; R129-E178 PolarHBondContact NH2-OE1 2.92Å; I174-E178 HydrophobicContact CG2-CG 4.4Å; I174-E178 WeakPolarHBondContact O-CG 3.18Å; I174-E178 PolarHBondContact O-N 2.8Å; E176-E178 VanDerWaalsContact C-N 3.35Å; E176-E178 PolarHBondContact O-N 2.89Å; E178-I181 PolarHBondContact O-N 3.14Å; E178-R182 WeakPolarHBondContact O-CG 3.39Å; E178-R182 PolarHBondContact O-N 3.32Å; E178-R182 VanDerWaalsContact O-N 3.14Å
179	T	89.4	Confident	86.5	Confident	65 Å²	65	66 Å²	66	40%	0.399	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-43.8	175	-58.9	0	0	0	0	110.9	K175 E176 R177 I181 R182 Q183	K175-T179 PolarHBondContact O-N 3.41Å; K175-T179 VanDerWaalsContact O-N 3.09Å; K175-T179 PolarHBondContact O-OG1 3.41Å; E176-T179 WeakPolarHBondContact O-CB 3.31Å; E176-T179 PolarHBondContact O-N 3.43Å; E176-T179 VanDerWaalsContact O-N 3.09Å; R177-T179 VanDerWaalsContact C-N 3.31Å; R177-T179 PolarHBondContact O-N 3.44Å; T179-I181 VanDerWaalsContact C-N 3.34Å; T179-I181 PolarHBondContact O-N 3.01Å; T179-R182 PolarHBondContact O-N 3.34Å; T179-Q183 WeakPolarHBondContact O-CG 3.15Å; T179-Q183 PolarHBondContact O-N 3.4Å; T179-Q183 VanDerWaalsContact O-N 3.11Å
180	N	86.9	Confident	87.2	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-42.3	177	-66.6	-11.6	0	0	0	111.7	Q57 E176 R177 R182 Q183 L184	Q57-N180 PolarHBondContact NE2-ND2 2.97Å; Q57-N180 PolarHBondContact NE2-OD1 3.41Å; Q57-N180 VanDerWaalsContact NE2-OD1 3.14Å; E176-N180 PolarHBondContact O-N 3.47Å; R177-N180 PolarHBondContact O-N 3.12Å; N180-R182 PolarHBondContact O-N 3.48Å; N180-Q183 PolarHBondContact O-N 3.19Å; N180-L184 WeakPolarHBondContact O-CG 3.38Å; N180-L184 PolarHBondContact O-N 2.85Å
181	I	90.3	Very high	87.7	Confident	14 Å²	14	60.7 Å²	60.7	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-58.8	-48	175.7	-69.8	163.7	0	0	0	111.2	E121 R122 I125 R177 E178 T179 Q183 L184 E185	E121-I181 HydrophobicContact CB-CD1 3.87Å; E121-I181 HydrophobicContact CB-CG1 3.51Å; E121-I181 HydrophobicContact CG-CG1 4.37Å; R122-I181 HydrophobicContact CB-CD1 4.47Å; R122-I181 HydrophobicContact CG-CD1 3.61Å; R122-I181 HydrophobicContact CG-CG1 4.41Å; I125-I181 HydrophobicContact CD1-CD1 3.42Å; I125-I181 VanDerWaalsContact CD1-CD1 3.42Å; R177-I181 WeakPolarHBondContact O-CG1 3.43Å; R177-I181 PolarHBondContact O-N 3.2Å; E178-I181 PolarHBondContact O-N 3.14Å; T179-I181 VanDerWaalsContact C-N 3.34Å; T179-I181 PolarHBondContact O-N 3.01Å; I181-Q183 VanDerWaalsContact C-N 3.3Å; I181-Q183 PolarHBondContact O-N 3.11Å; I181-L184 WeakPolarHBondContact O-CB 3.29Å; I181-L184 PolarHBondContact O-N 3.4Å; I181-L184 VanDerWaalsContact O-N 3.15Å; I181-E185 HydrophobicContact CG2-CG 4.3Å; I181-E185 WeakPolarHBondContact CG2-OE1 3.42Å; I181-E185 WeakPolarHBondContact O-CG 3.5Å; I181-E185 PolarHBondContact O-N 3.18Å
182	R	90.4	Very high	87.9	Confident	157 Å²	157	61.4 Å²	61.4	59%	0.592	31%	0.306	S	S	*	.	H	α-helix	trans	-59.8	-41.2	179.6	-68.2	175.9	-166.2	166.3	7.8	111.6	E178 T179 N180 E185 V186	E178-R182 WeakPolarHBondContact O-CG 3.39Å; E178-R182 PolarHBondContact O-N 3.32Å; E178-R182 VanDerWaalsContact O-N 3.14Å; T179-R182 PolarHBondContact O-N 3.34Å; N180-R182 PolarHBondContact O-N 3.48Å; R182-E185 PolarHBondContact O-N 3.34Å; R182-V186 WeakPolarHBondContact O-CG2 3.41Å; R182-V186 PolarHBondContact O-N 3.45Å
183	Q	88.6	Confident	88	Confident	110 Å²	110	59.6 Å²	59.6	51%	0.514	30%	0.3	S	S	.	.	H	α-helix	trans	-64.7	-40	176.7	-67.9	-179.4	13.3	0	0	112.4	T179 N180 I181 S187	T179-Q183 WeakPolarHBondContact O-CG 3.15Å; T179-Q183 PolarHBondContact O-N 3.4Å; T179-Q183 VanDerWaalsContact O-N 3.11Å; N180-Q183 PolarHBondContact O-N 3.19Å; I181-Q183 VanDerWaalsContact C-N 3.3Å; I181-Q183 PolarHBondContact O-N 3.11Å; Q183-S187 WeakPolarHBondContact O-CB 3.24Å; Q183-S187 PolarHBondContact O-N 3.22Å; Q183-S187 PolarHBondContact O-OG 3.41Å
184	L	90.5	Very high	88.2	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-42.2	174.9	-72.9	170.5	0	0	0	111.6	Q114 A117 A118 E121 N180 I181 S187 I188	Q114-L184 HydrophobicContact CG-CD2 4.43Å; A117-L184 HydrophobicContact CB-CD1 3.97Å; A117-L184 HydrophobicContact CB-CD2 4.46Å; A118-L184 HydrophobicContact CB-CB 4.27Å; A118-L184 HydrophobicContact CB-CD1 4.01Å; E121-L184 HydrophobicContact CG-CD1 4.44Å; N180-L184 WeakPolarHBondContact O-CG 3.38Å; N180-L184 PolarHBondContact O-N 2.85Å; I181-L184 WeakPolarHBondContact O-CB 3.29Å; I181-L184 PolarHBondContact O-N 3.4Å; I181-L184 VanDerWaalsContact O-N 3.15Å; L184-S187 PolarHBondContact O-N 3.04Å; L184-I188 WeakPolarHBondContact O-CB 3.43Å; L184-I188 VanDerWaalsContact O-CG1 3.22Å; L184-I188 WeakPolarHBondContact O-CG1 3.46Å; L184-I188 PolarHBondContact O-N 2.93Å
185	E	88.6	Confident	88.2	Confident	80 Å²	80	58 Å²	58	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-45	178	-72.9	173.2	169.4	0	0	111.9	R122 I181 R182 S187 I188 C189	R122-E185 IonicContact CZ-OE1 3.87Å; R122-E185 IonicContact NH2-OE1 2.71Å; R122-E185 PolarHBondContact NH2-OE1 3Å; I181-E185 HydrophobicContact CG2-CG 4.3Å; I181-E185 WeakPolarHBondContact CG2-OE1 3.42Å; I181-E185 WeakPolarHBondContact O-CG 3.5Å; I181-E185 PolarHBondContact O-N 3.18Å; R182-E185 PolarHBondContact O-N 3.34Å; E185-S187 VanDerWaalsContact C-N 3.33Å; E185-S187 PolarHBondContact O-N 2.9Å; E185-I188 PolarHBondContact O-N 2.91Å; E185-C189 WeakPolarHBondContact O-CB 3.16Å; E185-C189 PolarHBondContact O-N 2.95Å; E185-C189 PolarHBondContact O-SG 3.28Å
186	V	93.2	Very high	88	Confident	88 Å²	88	59.2 Å²	59.2	53%	0.533	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-44.9	173.4	172.4	0	0	0	0	110.8	R182 I188 C189 L190	R182-V186 WeakPolarHBondContact O-CG2 3.41Å; R182-V186 PolarHBondContact O-N 3.45Å; V186-I188 PolarHBondContact O-N 3.47Å; V186-C189 PolarHBondContact O-N 2.87Å; V186-L190 HydrophobicContact CG1-CD1 4.12Å; V186-L190 WeakPolarHBondContact O-CG 3.43Å; V186-L190 PolarHBondContact O-N 2.83Å
187	S	89.2	Confident	87.8	Confident	25 Å²	25	59.4 Å²	59.4	18%	0.175	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-44.3	179.1	-59.9	0	0	0	0	112	Q183 L184 E185 C189 L190 L191	Q183-S187 WeakPolarHBondContact O-CB 3.24Å; Q183-S187 PolarHBondContact O-N 3.22Å; Q183-S187 PolarHBondContact O-OG 3.41Å; L184-S187 PolarHBondContact O-N 3.04Å; E185-S187 VanDerWaalsContact C-N 3.33Å; E185-S187 PolarHBondContact O-N 2.9Å; S187-C189 PolarHBondContact O-N 3.41Å; S187-L190 PolarHBondContact O-N 3.4Å; S187-L191 WeakPolarHBondContact O-CG 3.48Å; S187-L191 PolarHBondContact O-N 3.01Å
188	I	89.3	Confident	87.5	Confident	17 Å²	17	59.1 Å²	59.1	9%	0.087	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-43.7	177	-69.8	163.4	0	0	0	110.8	Q111 Q114 R115 L184 E185 V186 L191 L192	Q111-I188 HydrophobicContact CG-CG2 4.04Å; Q114-I188 HydrophobicContact CB-CD1 4.06Å; Q114-I188 HydrophobicContact CB-CG1 3.72Å; Q114-I188 VanDerWaalsContact OE1-CG1 3.3Å; R115-I188 HydrophobicContact CG-CD1 3.91Å; L184-I188 WeakPolarHBondContact O-CB 3.43Å; L184-I188 VanDerWaalsContact O-CG1 3.22Å; L184-I188 WeakPolarHBondContact O-CG1 3.46Å; L184-I188 PolarHBondContact O-N 2.93Å; E185-I188 PolarHBondContact O-N 2.91Å; V186-I188 PolarHBondContact O-N 3.47Å; I188-L191 PolarHBondContact O-N 3.32Å; I188-L192 HydrophobicContact CG2-CD1 4.3Å; I188-L192 WeakPolarHBondContact O-CG 3.4Å; I188-L192 PolarHBondContact O-N 3.39Å
189	C	89.6	Confident	86.7	Confident	74 Å²	74	62 Å²	62	50%	0.5	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-43.6	177.2	-74.2	0	0	0	0	111.7	E185 V186 S187 L192 L193	E185-C189 WeakPolarHBondContact O-CB 3.16Å; E185-C189 PolarHBondContact O-N 2.95Å; E185-C189 PolarHBondContact O-SG 3.28Å; V186-C189 PolarHBondContact O-N 2.87Å; S187-C189 PolarHBondContact O-N 3.41Å; C189-L192 WeakPolarHBondContact O-CB 3.43Å; C189-L192 PolarHBondContact O-N 3.34Å; C189-L193 WeakPolarHBondContact O-CG 3.42Å; C189-L193 PolarHBondContact O-N 3.46Å; C189-L193 VanDerWaalsContact O-N 3.12Å
190	L	89.4	Confident	85.8	Confident	74 Å²	74	64.2 Å²	64.2	39%	0.387	31%	0.313	S	S	.	.	H	α-helix	trans	-63.6	-43.1	175.8	-70.3	174.2	0	0	0	111.9	V186 S187 L192 L193 D194	V186-L190 HydrophobicContact CG1-CD1 4.12Å; V186-L190 WeakPolarHBondContact O-CG 3.43Å; V186-L190 PolarHBondContact O-N 2.83Å; S187-L190 PolarHBondContact O-N 3.4Å; L190-L192 VanDerWaalsContact C-N 3.32Å; L190-L192 PolarHBondContact O-N 3.12Å; L190-L193 WeakPolarHBondContact O-CB 3.26Å; L190-L193 PolarHBondContact O-N 2.87Å; L190-D194 PolarHBondContact O-N 3.38Å
191	L	86.3	Confident	84.4	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-61.9	-38.7	176.3	-73.8	-179.3	0	0	0	112.7	A67 L107 F110 Q111 S187 I188 L193 D194 I195	A67-L191 HydrophobicContact CB-CD2 4.05Å; L107-L191 HydrophobicContact CD2-CD2 3.95Å; F110-L191 HydrophobicContact CD1-CD1 3.46Å; F110-L191 VanDerWaalsContact CD1-CD1 3.46Å; F110-L191 HydrophobicContact CD1-CD2 4.16Å; F110-L191 HydrophobicContact CD1-CG 4.45Å; F110-L191 HydrophobicContact CE1-CD1 3.69Å; F110-L191 HydrophobicContact CE1-CD2 4.32Å; F110-L191 HydrophobicContact CG-CD1 4.27Å; Q111-L191 HydrophobicContact CB-CD1 4.38Å; S187-L191 WeakPolarHBondContact O-CG 3.48Å; S187-L191 PolarHBondContact O-N 3.01Å; I188-L191 PolarHBondContact O-N 3.32Å; L191-L193 VanDerWaalsContact C-N 3.34Å; L191-D194 PolarHBondContact O-N 3.42Å; L191-I195 VanDerWaalsContact O-CG1 3.28Å; L191-I195 WeakPolarHBondContact O-CG1 3.48Å; L191-I195 PolarHBondContact O-N 3.39Å
192	L	85.6	Confident	82.6	Confident	74 Å²	74	72.2 Å²	72.2	39%	0.387	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-44.4	174.9	-81.1	170.9	0	0	0	111.7	I188 C189 L190 I195 Q196	I188-L192 HydrophobicContact CG2-CD1 4.3Å; I188-L192 WeakPolarHBondContact O-CG 3.4Å; I188-L192 PolarHBondContact O-N 3.39Å; C189-L192 WeakPolarHBondContact O-CB 3.43Å; C189-L192 PolarHBondContact O-N 3.34Å; L190-L192 VanDerWaalsContact C-N 3.32Å; L190-L192 PolarHBondContact O-N 3.12Å; L192-I195 PolarHBondContact O-N 2.9Å; L192-Q196 WeakPolarHBondContact O-CB 3.5Å; L192-Q196 PolarHBondContact O-N 3.08Å
193	L	87.1	Confident	80.2	Confident	82 Å²	82	67.2 Å²	67.2	43%	0.429	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-49.5	173.9	-67.2	172.7	0	0	0	109.9	C189 L190 L191 I195 Q196 F197	C189-L193 WeakPolarHBondContact O-CG 3.42Å; C189-L193 PolarHBondContact O-N 3.46Å; C189-L193 VanDerWaalsContact O-N 3.12Å; L190-L193 WeakPolarHBondContact O-CB 3.26Å; L190-L193 PolarHBondContact O-N 2.87Å; L191-L193 VanDerWaalsContact C-N 3.34Å; L193-I195 VanDerWaalsContact C-N 3.31Å; L193-I195 PolarHBondContact O-N 3.4Å; L193-Q196 WeakPolarHBondContact O-CB 3.47Å; L193-Q196 PolarHBondContact O-N 3.39Å; L193-F197 HydrophobicContact CB-CD2 4.16Å; L193-F197 HydrophobicContact CB-CE2 4.2Å; L193-F197 HydrophobicContact CD2-CE2 4.27Å; L193-F197 WeakPolarHBondContact O-CB 3.49Å; L193-F197 WeakPolarHBondContact O-CD2 3.37Å; L193-F197 PolarHBondContact O-N 3.1Å
194	D	84.5	Confident	78	Confident	29 Å²	29	71.9 Å²	71.9	16%	0.155	40%	0.402	C	S	.	.	H	α-helix	trans	-55.3	-45.2	179.3	-75.7	-31.1	0	0	0	111.7	N71 L107 L190 L191 Q196 F197 I198	N71-D194 PolarHBondContact ND2-O 3.33Å; L107-D194 HydrophobicContact CD1-CB 4.18Å; L190-D194 PolarHBondContact O-N 3.38Å; L191-D194 PolarHBondContact O-N 3.42Å; D194-Q196 PolarHBondContact O-N 3.05Å; D194-F197 PolarHBondContact O-N 2.87Å; D194-I198 VanDerWaalsContact O-CG1 3.32Å; D194-I198 WeakPolarHBondContact O-CG1 3.43Å; D194-I198 PolarHBondContact O-N 3.17Å
195	I	84.3	Confident	77.4	Confident	24 Å²	24	75.1 Å²	75.1	12%	0.123	42%	0.42	C	S	.	.	H	α-helix	trans	-60	-45.5	175.8	-68	163.8	0	0	0	111.3	L107 L191 L192 L193 F197 I198	L107-I195 HydrophobicContact CB-CD1 3.85Å; L107-I195 HydrophobicContact CB-CG1 3.68Å; L107-I195 HydrophobicContact CD1-CG1 3.78Å; L107-I195 HydrophobicContact CG-CG1 4.42Å; L191-I195 VanDerWaalsContact O-CG1 3.28Å; L191-I195 WeakPolarHBondContact O-CG1 3.48Å; L191-I195 PolarHBondContact O-N 3.39Å; L192-I195 PolarHBondContact O-N 2.9Å; L193-I195 VanDerWaalsContact C-N 3.31Å; L193-I195 PolarHBondContact O-N 3.4Å; I195-F197 VanDerWaalsContact C-N 3.31Å; I195-F197 PolarHBondContact O-N 2.94Å; I195-I198 PolarHBondContact O-N 3.23Å
196	Q	83.9	Confident	76.8	Confident	136 Å²	136	74.8 Å²	74.8	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-64.4	-37.4	179.2	-173	175.7	-8.5	0	0	111.9	L192 L193 D194	L192-Q196 WeakPolarHBondContact O-CB 3.5Å; L192-Q196 PolarHBondContact O-N 3.08Å; L193-Q196 WeakPolarHBondContact O-CB 3.47Å; L193-Q196 PolarHBondContact O-N 3.39Å; D194-Q196 PolarHBondContact O-N 3.05Å
197	F	81.8	Confident	75.9	Confident	87 Å²	87	74.1 Å²	74.1	38%	0.382	42%	0.417	S	S	.	.	H	α-helix	trans	-77.4	-16.5	179.6	-78.6	-71.4	0	0	0	113.9	L193 D194 I195 Y199 Q200	L193-F197 HydrophobicContact CB-CD2 4.16Å; L193-F197 HydrophobicContact CB-CE2 4.2Å; L193-F197 HydrophobicContact CD2-CE2 4.27Å; L193-F197 WeakPolarHBondContact O-CB 3.49Å; L193-F197 WeakPolarHBondContact O-CD2 3.37Å; L193-F197 PolarHBondContact O-N 3.1Å; D194-F197 PolarHBondContact O-N 2.87Å; I195-F197 VanDerWaalsContact C-N 3.31Å; I195-F197 PolarHBondContact O-N 2.94Å; F197-Y199 PolarHBondContact O-N 3.35Å; F197-Q200 PolarHBondContact O-N 3.26Å
198	I	79.8	Confident	75.1	Confident	16 Å²	16	76.9 Å²	76.9	8%	0.082	43%	0.431	C	S	.	.	H	α-helix	trans	-57.6	-39	176.7	-75.2	164.6	0	0	0	111.5	M100 F103 L107 D194 I195	M100-I198 HydrophobicContact CB-CG2 3.77Å; M100-I198 HydrophobicContact CG-CG2 3.94Å; M100-I198 HydrophobicContact SD-CG2 4.37Å; F103-I198 HydrophobicContact CD1-CD1 3.31Å; F103-I198 HydrophobicContact CD1-CG1 3.78Å; F103-I198 HydrophobicContact CE1-CD1 3.63Å; F103-I198 HydrophobicContact CE1-CG1 3.9Å; F103-I198 HydrophobicContact CG-CD1 4.22Å; L107-I198 HydrophobicContact CD1-CD1 4.07Å; D194-I198 VanDerWaalsContact O-CG1 3.32Å; D194-I198 WeakPolarHBondContact O-CG1 3.43Å; D194-I198 PolarHBondContact O-N 3.17Å; I195-I198 PolarHBondContact O-N 3.23Å
199	Y	71.8	Confident	74.2	Confident	122 Å²	122	80.7 Å²	80.7	48%	0.478	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-0.5	-174.8	-65.9	-82	0	0	0	113.8	N101 F197	N101-Y199 PolarHBondContact OD1-OH 3.08Å; F197-Y199 PolarHBondContact O-N 3.35Å
200	Q	71.4	Confident	73.2	Confident	112 Å²	112	81.1 Å²	81.1	52%	0.523	45%	0.449	S	S	.	.	S	Bend	trans	-72.6	130.9	173.2	-94.9	-170.8	-31.6	0	0	109.5	F197 V202	F197-Q200 PolarHBondContact O-N 3.26Å; Q200-V202 PolarHBondContact O-N 3.06Å
201	P	56.6	Low	72	Confident	112 Å²	112	81.6 Å²	81.6	73%	0.727	45%	0.453	S	S	*	.			trans	-58.1	132.5	174.4	23.4	-30.6	0	0	0	108.4	G203	P201-G203 PolarHBondContact O-N 3.49Å
202	V	52	Low	70.9	Confident	86 Å²	86	87.8 Å²	87.8	52%	0.521	49%	0.488	S	S	.	.			trans	-57.3	111.1	163.1	-158.9	0	0	0	0	104.4	Q200	Q200-V202 PolarHBondContact O-N 3.06Å
203	G	41.8	Very low	69.7	Low	52 Å²	52	88.9 Å²	88.9	54%	0.536	50%	0.496	S	S	.	.			trans	-56.3	163.6	-173.1	0	0	0	0	0	112.4	P201	P201-G203 PolarHBondContact O-N 3.49Å
204	P	41.6	Very low	68.1	Low	209 Å²	209	89.5 Å²	89.5	100%	1.357	50%	0.502	S	S	*	.			trans	-57	0	-170.7	26.6	-35.8	0	0	0	113.9

Retrieved 204 of 204 residues in 204.3 ms (Link to these results)

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