C4QRY1_SCHMA Loading...

Homeobox protein nk-2,putative

AlphaFold DB , UniProt , Accession C4QRY1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 467 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	34.6	Very low	41.3	Very low	214 Å²	214	114.8 Å²	114.8	100%	1.054	62%	0.618	S	S	*	*				0	-50	0	-84.3	-170.3	173.9	0	0	113.3	W3 S4	M1-W3 PolarHBondContact O-N 3.26Å; M1-S4 PolarHBondContact O-N 3.34Å; M1-S4 VanDerWaalsContact O-N 3.09Å
2	L	36.2	Very low	42	Very low	150 Å²	150	113.7 Å²	113.7	79%	0.785	63%	0.625	S	S	*	*	H	α-helix	trans	-52.8	-35.3	174.4	-90.9	132.4	0	0	0	114.3	S4 N5 Q6	L2-S4 VanDerWaalsContact C-N 3.3Å; L2-S4 PolarHBondContact O-N 3.37Å; L2-N5 PolarHBondContact O-N 3.45Å; L2-Q6 PolarHBondContact O-N 3.36Å
3	W	36.7	Very low	43.3	Very low	141 Å²	141	110.1 Å²	110.1	53%	0.534	61%	0.613	S	S	.	*	H	α-helix	trans	-63.7	-30.8	178.8	-153.2	45.5	0	0	0	114	M1 C7 Y22	M1-W3 PolarHBondContact O-N 3.26Å; W3-C7 PolarHBondContact O-SG 3.19Å; W3-Y22 HydrophobicContact CZ2-CG 4.41Å
4	S	36.6	Very low	44.9	Very low	90 Å²	90	108.4 Å²	108.4	63%	0.629	60%	0.598	S	S	*	*	H	α-helix	trans	-75.6	-32.1	-178.8	-166.8	0	0	0	0	112.4	M1 L2	M1-S4 PolarHBondContact O-N 3.34Å; M1-S4 VanDerWaalsContact O-N 3.09Å; L2-S4 VanDerWaalsContact C-N 3.3Å; L2-S4 PolarHBondContact O-N 3.37Å
5	N	38.6	Very low	45.7	Very low	132 Å²	132	105.7 Å²	105.7	71%	0.706	58%	0.582	S	S	*	*	H	α-helix	trans	-79.7	-24.6	-178.2	-82.2	-10.6	0	0	0	113.1	L2 S8	L2-N5 PolarHBondContact O-N 3.45Å; N5-S8 PolarHBondContact O-OG 3.26Å; N5-S8 VanDerWaalsContact O-OG 3.11Å
6	Q	43.7	Very low	46.7	Very low	126 Å²	126	104.4 Å²	104.4	59%	0.589	58%	0.578	S	S	*	*	H	α-helix	trans	-79.7	-30.2	174.5	-78.5	-178	-30.3	0	0	112.8	L2 S8 V9 L10	L2-Q6 PolarHBondContact O-N 3.36Å; Q6-S8 VanDerWaalsContact C-N 3.26Å; Q6-S8 PolarHBondContact O-N 3.18Å; Q6-V9 PolarHBondContact O-N 3.08Å; Q6-L10 WeakPolarHBondContact O-CG 3.48Å
7	C	42.2	Very low	48.2	Very low	39 Å²	39	106.4 Å²	106.4	26%	0.264	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.1	-18.6	-177.3	-73.5	0	0	0	0	114.7	W3 V9 L15	W3-C7 PolarHBondContact O-SG 3.19Å; C7-V9 VanDerWaalsContact C-N 3.34Å; C7-V9 PolarHBondContact O-N 3.19Å; C7-L15 HydrophobicContact CB-CD1 4.2Å
8	S	43.5	Very low	49.1	Very low	100 Å²	100	104.6 Å²	104.6	70%	0.699	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-20.5	-178.4	55.8	0	0	0	0	114.1	N5 Q6	N5-S8 PolarHBondContact O-OG 3.26Å; N5-S8 VanDerWaalsContact O-OG 3.11Å; Q6-S8 VanDerWaalsContact C-N 3.26Å; Q6-S8 PolarHBondContact O-N 3.18Å
9	V	46.4	Very low	49.6	Very low	128 Å²	128	104.4 Å²	104.4	78%	0.776	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-14.9	-178.3	-175.3	0	0	0	0	111.9	Q6 C7	Q6-V9 PolarHBondContact O-N 3.08Å; C7-V9 VanDerWaalsContact C-N 3.34Å; C7-V9 PolarHBondContact O-N 3.19Å
10	L	42.8	Very low	50.7	Low	46 Å²	46	106.5 Å²	106.5	24%	0.241	57%	0.566	C	S	.	*			trans	-86.6	128.7	-173	-63.7	176.1	0	0	0	111.6	Q6 E14 L18	Q6-L10 WeakPolarHBondContact O-CG 3.48Å; L10-E14 HydrophobicContact CB-CB 3.95Å; L10-E14 HydrophobicContact CD2-CB 3.93Å; L10-E14 HydrophobicContact CD2-CG 4.31Å; L10-E14 WeakPolarHBondContact CD2-OE2 3.5Å; L10-E14 HydrophobicContact CG-CB 4.37Å; L10-L18 HydrophobicContact CD1-CD1 3.32Å
11	N	53	Low	51.8	Low	97 Å²	97	108 Å²	108	52%	0.519	57%	0.569	S	S	.	*			trans	-65.2	160.8	169.3	67.9	51.1	0	0	0	110.3	S13 E14 L15	N11-S13 PolarHBondContact O-N 2.95Å; N11-S13 WeakPolarHBondContact OD1-CB 3.29Å; N11-S13 PolarHBondContact OD1-N 3.14Å; N11-S13 VanDerWaalsContact OD1-N 3.13Å; N11-E14 WeakPolarHBondContact O-CB 3.33Å; N11-E14 PolarHBondContact O-N 3.5Å; N11-E14 VanDerWaalsContact O-N 3.07Å; N11-E14 WeakPolarHBondContact OD1-CG 3.36Å; N11-E14 PolarHBondContact OD1-N 2.94Å; N11-L15 PolarHBondContact O-N 3.5Å; N11-L15 VanDerWaalsContact O-N 3.13Å
12	S	49.2	Very low	53.3	Low	101 Å²	101	102.8 Å²	102.8	71%	0.706	54%	0.539	S	S	*	.	H	α-helix	trans	-58.5	-25.1	-174.2	63.1	0	0	0	0	114.4	V16	S12-V16 WeakPolarHBondContact O-CG2 3.27Å; S12-V16 PolarHBondContact O-N 2.97Å
13	S	60	Low	54.5	Low	67 Å²	67	99.3 Å²	99.3	47%	0.469	52%	0.52	S	S	.	.	H	α-helix	trans	-71.2	-46.5	176.9	177.3	0	0	0	0	111.2	N11 L15 V16 K17	N11-S13 PolarHBondContact O-N 2.95Å; N11-S13 WeakPolarHBondContact OD1-CB 3.29Å; N11-S13 PolarHBondContact OD1-N 3.14Å; N11-S13 VanDerWaalsContact OD1-N 3.13Å; S13-L15 VanDerWaalsContact C-N 3.34Å; S13-L15 PolarHBondContact O-N 2.79Å; S13-V16 PolarHBondContact O-N 3.32Å; S13-K17 PolarHBondContact O-N 2.95Å
14	E	65.3	Low	56.1	Low	86 Å²	86	97.3 Å²	97.3	40%	0.402	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-42.9	176.8	-64.1	-98.6	130.3	0	0	111.3	L10 N11 V16 K17 L18	L10-E14 HydrophobicContact CB-CB 3.95Å; L10-E14 HydrophobicContact CD2-CB 3.93Å; L10-E14 HydrophobicContact CD2-CG 4.31Å; L10-E14 WeakPolarHBondContact CD2-OE2 3.5Å; L10-E14 HydrophobicContact CG-CB 4.37Å; N11-E14 WeakPolarHBondContact O-CB 3.33Å; N11-E14 PolarHBondContact O-N 3.5Å; N11-E14 VanDerWaalsContact O-N 3.07Å; N11-E14 WeakPolarHBondContact OD1-CG 3.36Å; N11-E14 PolarHBondContact OD1-N 2.94Å; E14-V16 VanDerWaalsContact C-N 3.34Å; E14-V16 PolarHBondContact O-N 2.67Å; E14-K17 PolarHBondContact O-N 3.41Å; E14-L18 PolarHBondContact O-N 2.87Å
15	L	56.2	Low	57.4	Low	69 Å²	69	95.8 Å²	95.8	36%	0.361	51%	0.506	S	S	.	.	H	α-helix	trans	-64.9	-38.2	178.9	-144.4	155.9	0	0	0	111.4	C7 N11 S13 F19	C7-L15 HydrophobicContact CB-CD1 4.2Å; N11-L15 PolarHBondContact O-N 3.5Å; N11-L15 VanDerWaalsContact O-N 3.13Å; S13-L15 VanDerWaalsContact C-N 3.34Å; S13-L15 PolarHBondContact O-N 2.79Å; L15-F19 VanDerWaalsContact O-CB 3.27Å; L15-F19 WeakPolarHBondContact O-CB 3.35Å; L15-F19 PolarHBondContact O-N 2.74Å
16	V	62.7	Low	58.3	Low	85 Å²	85	96 Å²	96	52%	0.515	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-38.5	173.5	169.2	0	0	0	0	112	S12 S13 E14 F19 K20	S12-V16 WeakPolarHBondContact O-CG2 3.27Å; S12-V16 PolarHBondContact O-N 2.97Å; S13-V16 PolarHBondContact O-N 3.32Å; E14-V16 VanDerWaalsContact C-N 3.34Å; E14-V16 PolarHBondContact O-N 2.67Å; V16-F19 PolarHBondContact O-N 3.28Å; V16-K20 WeakPolarHBondContact O-CB 3.32Å; V16-K20 WeakPolarHBondContact O-CG 3.39Å; V16-K20 PolarHBondContact O-N 3.12Å
17	K	71.8	Confident	59.1	Low	137 Å²	137	97.7 Å²	97.7	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-62.5	-48.8	175.1	-74.1	-178.7	-179.4	-177.8	0	111.2	S13 E14 F19 K20 Q21	S13-K17 PolarHBondContact O-N 2.95Å; E14-K17 PolarHBondContact O-N 3.41Å; K17-F19 VanDerWaalsContact C-N 3.31Å; K17-F19 PolarHBondContact O-N 3.31Å; K17-K20 PolarHBondContact O-N 3.42Å; K17-Q21 PolarHBondContact O-N 2.84Å
18	L	64.1	Low	59.8	Low	74 Å²	74	102 Å²	102	39%	0.387	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-39.4	176.3	-72.7	178.4	0	0	0	111.9	L10 E14 Q21 Y22	L10-L18 HydrophobicContact CD1-CD1 3.32Å; E14-L18 PolarHBondContact O-N 2.87Å; L18-Q21 PolarHBondContact O-N 3.46Å; L18-Y22 VanDerWaalsContact O-CB 3.32Å; L18-Y22 WeakPolarHBondContact O-CB 3.5Å; L18-Y22 PolarHBondContact O-N 3.17Å
19	F	59.2	Low	60.2	Low	101 Å²	101	102.2 Å²	102.2	44%	0.443	51%	0.508	S	S	.	.	H	α-helix	trans	-68.3	-38.9	177.8	-163.9	-106.1	0	0	0	112.5	L15 V16 K17 Y22 I23	L15-F19 VanDerWaalsContact O-CB 3.27Å; L15-F19 WeakPolarHBondContact O-CB 3.35Å; L15-F19 PolarHBondContact O-N 2.74Å; V16-F19 PolarHBondContact O-N 3.28Å; K17-F19 VanDerWaalsContact C-N 3.31Å; K17-F19 PolarHBondContact O-N 3.31Å; F19-Y22 PolarHBondContact O-N 2.72Å; F19-I23 HydrophobicContact CD1-CD1 3.77Å; F19-I23 HydrophobicContact CD1-CG1 4.29Å; F19-I23 HydrophobicContact CE1-CD1 3.35Å; F19-I23 HydrophobicContact CE1-CG1 4.07Å; F19-I23 HydrophobicContact CZ-CD1 4Å; F19-I23 HydrophobicContact CZ-CG1 4.4Å; F19-I23 WeakPolarHBondContact O-CG1 3.24Å; F19-I23 PolarHBondContact O-N 3.24Å
20	K	70.8	Confident	60.5	Low	147 Å²	147	98.8 Å²	98.8	64%	0.639	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-45.3	171.8	-80.6	-173.1	175.7	-172.4	0	111.5	V16 K17 Y22 I23 E24	V16-K20 WeakPolarHBondContact O-CB 3.32Å; V16-K20 WeakPolarHBondContact O-CG 3.39Å; V16-K20 PolarHBondContact O-N 3.12Å; K17-K20 PolarHBondContact O-N 3.42Å; K20-Y22 VanDerWaalsContact C-N 3.32Å; K20-Y22 PolarHBondContact O-N 2.75Å; K20-I23 PolarHBondContact O-N 2.9Å; K20-E24 PolarHBondContact O-N 3.5Å
21	Q	73.6	Confident	60.9	Low	137 Å²	137	100.2 Å²	100.2	64%	0.64	50%	0.502	S	S	*	.	H	α-helix	trans	-64.4	-38.3	178.3	-166.9	170.9	10.6	0	0	111.8	K17 L18 S25	K17-Q21 PolarHBondContact O-N 2.84Å; L18-Q21 PolarHBondContact O-N 3.46Å; Q21-S25 PolarHBondContact O-N 2.98Å
22	Y	67.2	Low	60.6	Low	105 Å²	105	100.8 Å²	100.8	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-44.8	172.9	178.6	-97.9	0	0	0	112.1	W3 L18 F19 K20 S25 Y26	W3-Y22 HydrophobicContact CZ2-CG 4.41Å; L18-Y22 VanDerWaalsContact O-CB 3.32Å; L18-Y22 WeakPolarHBondContact O-CB 3.5Å; L18-Y22 PolarHBondContact O-N 3.17Å; F19-Y22 PolarHBondContact O-N 2.72Å; K20-Y22 VanDerWaalsContact C-N 3.32Å; K20-Y22 PolarHBondContact O-N 2.75Å; Y22-S25 PolarHBondContact O-N 3.28Å; Y22-S25 PolarHBondContact O-OG 2.9Å; Y22-Y26 HydrophobicContact CE1-CD2 4.5Å; Y22-Y26 WeakPolarHBondContact O-CB 3.35Å; Y22-Y26 PolarHBondContact O-N 3.25Å
23	I	61.5	Low	60.6	Low	78 Å²	78	100.6 Å²	100.6	40%	0.4	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-44.1	176	-74.2	-176.1	0	0	0	110.9	F19 K20 Y26 R27	F19-I23 HydrophobicContact CD1-CD1 3.77Å; F19-I23 HydrophobicContact CD1-CG1 4.29Å; F19-I23 HydrophobicContact CE1-CD1 3.35Å; F19-I23 HydrophobicContact CE1-CG1 4.07Å; F19-I23 HydrophobicContact CZ-CD1 4Å; F19-I23 HydrophobicContact CZ-CG1 4.4Å; F19-I23 WeakPolarHBondContact O-CG1 3.24Å; F19-I23 PolarHBondContact O-N 3.24Å; K20-I23 PolarHBondContact O-N 2.9Å; I23-Y26 CarbonylContact O-C 3.43Å; I23-Y26 PolarHBondContact O-N 3.03Å; I23-R27 WeakPolarHBondContact O-CB 3.35Å; I23-R27 PolarHBondContact O-N 3.44Å
24	E	69.8	Low	59.9	Low	99 Å²	99	106.2 Å²	106.2	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-38.6	178.7	-73.7	-57.4	153.8	0	0	112.3	K20 Y26 R27 H28	K20-E24 PolarHBondContact O-N 3.5Å; E24-Y26 VanDerWaalsContact C-N 3.34Å; E24-Y26 PolarHBondContact O-N 2.85Å; E24-R27 PolarHBondContact O-N 3.17Å; E24-H28 PolarHBondContact O-N 3.15Å
25	S	64.5	Low	58.6	Low	58 Å²	58	106.5 Å²	106.5	41%	0.406	53%	0.527	S	S	.	.	H	α-helix	trans	-66.3	-38.3	173.6	90.3	0	0	0	0	111.8	Q21 Y22 R27 H28 N29	Q21-S25 PolarHBondContact O-N 2.98Å; Y22-S25 PolarHBondContact O-N 3.28Å; Y22-S25 PolarHBondContact O-OG 2.9Å; S25-R27 VanDerWaalsContact C-N 3.35Å; S25-H28 PolarHBondContact O-N 3.43Å; S25-N29 WeakPolarHBondContact O-CB 2.92Å; S25-N29 PolarHBondContact O-N 3.2Å; S25-N29 PolarHBondContact O-ND2 3.04Å
26	Y	57.1	Low	57.5	Low	137 Å²	137	109.9 Å²	109.9	54%	0.537	54%	0.544	S	S	.	.	H	α-helix	trans	-67.5	-36.8	175	-151	-91.5	0	0	0	111.3	Y22 I23 E24 N29 V30	Y22-Y26 HydrophobicContact CE1-CD2 4.5Å; Y22-Y26 WeakPolarHBondContact O-CB 3.35Å; Y22-Y26 PolarHBondContact O-N 3.25Å; I23-Y26 CarbonylContact O-C 3.43Å; I23-Y26 PolarHBondContact O-N 3.03Å; E24-Y26 VanDerWaalsContact C-N 3.34Å; E24-Y26 PolarHBondContact O-N 2.85Å; Y26-N29 PolarHBondContact O-N 2.92Å; Y26-V30 HydrophobicContact CD1-CG2 3.51Å; Y26-V30 HydrophobicContact CE1-CG2 3.43Å; Y26-V30 VanDerWaalsContact CE1-CG2 3.43Å; Y26-V30 HydrophobicContact CG-CG2 4.49Å; Y26-V30 WeakPolarHBondContact O-CB 3.36Å; Y26-V30 VanDerWaalsContact O-CG2 3.24Å; Y26-V30 WeakPolarHBondContact O-CG2 3.29Å; Y26-V30 PolarHBondContact O-N 3.01Å
27	R	61	Low	56.2	Low	161 Å²	161	110.8 Å²	110.8	61%	0.608	55%	0.554	S	S	*	*	H	α-helix	trans	-66	-40.1	176.4	-138.1	177.4	176.3	-170	-4	111.2	I23 E24 S25 S31	I23-R27 WeakPolarHBondContact O-CB 3.35Å; I23-R27 PolarHBondContact O-N 3.44Å; E24-R27 PolarHBondContact O-N 3.17Å; S25-R27 VanDerWaalsContact C-N 3.35Å; R27-S31 VanDerWaalsContact O-CB 3.27Å; R27-S31 WeakPolarHBondContact O-CB 3.45Å; R27-S31 PolarHBondContact O-N 2.63Å; R27-S31 PolarHBondContact O-OG 3.21Å
28	H	55.2	Low	54.2	Low	130 Å²	130	111.9 Å²	111.9	60%	0.602	57%	0.565	S	S	*	*	H	α-helix	trans	-65.7	-41.8	173	-108.1	-73	0	0	0	112.2	E24 S25 N32	E24-H28 PolarHBondContact O-N 3.15Å; S25-H28 PolarHBondContact O-N 3.43Å; H28-N32 WeakPolarHBondContact O-CB 3.3Å; H28-N32 PolarHBondContact O-N 3.27Å; H28-N32 VanDerWaalsContact O-N 3.08Å
29	N	52.7	Low	52.8	Low	103 Å²	103	113.2 Å²	113.2	55%	0.551	58%	0.578	S	S	*	*	H	α-helix	trans	-72	-33.6	177.7	-80.5	-32.7	0	0	0	113.5	S25 Y26 N32 T33	S25-N29 WeakPolarHBondContact O-CB 2.92Å; S25-N29 PolarHBondContact O-N 3.2Å; S25-N29 PolarHBondContact O-ND2 3.04Å; Y26-N29 PolarHBondContact O-N 2.92Å; N29-N32 PolarHBondContact O-N 3Å; N29-T33 WeakPolarHBondContact O-CG2 3.31Å; N29-T33 PolarHBondContact O-N 3.31Å; N29-T33 PolarHBondContact O-OG1 2.79Å
30	V	52.6	Low	51.6	Low	57 Å²	57	114.5 Å²	114.5	35%	0.345	60%	0.595	S	S	.	*	H	α-helix	trans	-75.2	-33.7	175.5	174.8	0	0	0	0	111.5	Y26 N32 T33 K34	Y26-V30 HydrophobicContact CD1-CG2 3.51Å; Y26-V30 HydrophobicContact CE1-CG2 3.43Å; Y26-V30 VanDerWaalsContact CE1-CG2 3.43Å; Y26-V30 HydrophobicContact CG-CG2 4.49Å; Y26-V30 WeakPolarHBondContact O-CB 3.36Å; Y26-V30 VanDerWaalsContact O-CG2 3.24Å; Y26-V30 WeakPolarHBondContact O-CG2 3.29Å; Y26-V30 PolarHBondContact O-N 3.01Å; V30-N32 VanDerWaalsContact C-N 3.3Å; V30-N32 PolarHBondContact O-N 3.5Å; V30-T33 VanDerWaalsContact CA-OG1 3.29Å; V30-T33 WeakPolarHBondContact CA-OG1 3.33Å; V30-T33 PolarHBondContact O-N 2.99Å; V30-T33 PolarHBondContact O-OG1 3.11Å; V30-K34 PolarHBondContact O-N 3.03Å
31	S	51.9	Low	49.8	Very low	76 Å²	76	111.8 Å²	111.8	53%	0.531	59%	0.594	S	S	.	*	H	α-helix	trans	-68.7	-32.2	174	-55	0	0	0	0	111.7	R27 T33	R27-S31 VanDerWaalsContact O-CB 3.27Å; R27-S31 WeakPolarHBondContact O-CB 3.45Å; R27-S31 PolarHBondContact O-N 2.63Å; R27-S31 PolarHBondContact O-OG 3.21Å; S31-T33 VanDerWaalsContact C-N 3.35Å
32	N	46.4	Very low	47.9	Very low	109 Å²	109	112 Å²	112	58%	0.583	60%	0.598	S	S	*	*	H	α-helix	trans	-78.8	-12.1	173.7	-78.1	-0.5	0	0	0	114.4	H28 N29 V30 S35	H28-N32 WeakPolarHBondContact O-CB 3.3Å; H28-N32 PolarHBondContact O-N 3.27Å; H28-N32 VanDerWaalsContact O-N 3.08Å; N29-N32 PolarHBondContact O-N 3Å; V30-N32 VanDerWaalsContact C-N 3.3Å; V30-N32 PolarHBondContact O-N 3.5Å; N32-S35 PolarHBondContact O-OG 3.28Å
33	T	49.3	Very low	46.3	Very low	96 Å²	96	112.8 Å²	112.8	59%	0.589	61%	0.614	S	S	*	*	H	α-helix	trans	-101.8	-10.6	178.5	47	0	0	0	0	113.8	N29 V30 S31 S35	N29-T33 WeakPolarHBondContact O-CG2 3.31Å; N29-T33 PolarHBondContact O-N 3.31Å; N29-T33 PolarHBondContact O-OG1 2.79Å; V30-T33 VanDerWaalsContact CA-OG1 3.29Å; V30-T33 WeakPolarHBondContact CA-OG1 3.33Å; V30-T33 PolarHBondContact O-N 2.99Å; V30-T33 PolarHBondContact O-OG1 3.11Å; S31-T33 VanDerWaalsContact C-N 3.35Å; T33-S35 PolarHBondContact O-N 3.38Å
34	K	45.4	Very low	45.1	Very low	186 Å²	186	114.2 Å²	114.2	81%	0.809	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-3	171.5	-82.4	-172.7	175.5	-175.3	0	114.6	V30	V30-K34 PolarHBondContact O-N 3.03Å
35	S	36.9	Very low	43.3	Very low	92 Å²	92	116.5 Å²	116.5	64%	0.643	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	12.2	-178.7	54.2	0	0	0	0	114.6	N32 T33	N32-S35 PolarHBondContact O-OG 3.28Å; T33-S35 PolarHBondContact O-N 3.38Å
36	L	33.2	Very low	42	Very low	139 Å²	139	119.1 Å²	119.1	73%	0.728	66%	0.656	S	S	*	*			trans	-121.9	119	-176.6	-129.1	71.8	0	0	0	112.9
37	S	35.1	Very low	41	Very low	104 Å²	104	118.1 Å²	118.1	73%	0.727	66%	0.664	S	S	*	*			trans	79.5	136.4	156.1	69.1	0	0	0	0	118.9
38	I	31.7	Very low	39.7	Very low	161 Å²	161	117.8 Å²	117.8	83%	0.826	67%	0.674	S	S	*	*			cis	173	161.2	-13.8	-107.3	155.8	0	0	0	104.6
39	P	34.2	Very low	38.7	Very low	102 Å²	102	117.6 Å²	117.6	66%	0.662	68%	0.683	S	S	*	*				-116.7	-151.5	-115.6	32.7	-10.2	0	0	0	112.6
40	T	33.5	Very low	38	Very low	128 Å²	128	118 Å²	118	79%	0.785	69%	0.693	S	S	*	*			trans	78.5	133.3	163.9	16.8	0	0	0	0	114.5
41	S	32.5	Very low	37.2	Very low	89 Å²	89	122.2 Å²	122.2	62%	0.622	71%	0.714	S	S	*	*			cis	174.8	153.9	27.9	46.1	0	0	0	0	111.3
42	I	34.9	Very low	36.3	Very low	142 Å²	142	124.4 Å²	124.4	73%	0.728	72%	0.724	S	S	*	*			trans	90.8	100.9	140.4	-65.9	152.9	0	0	0	120.7
43	T	32.5	Very low	35.8	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	73%	0.733	S	S	*	*				42.1	151.6	128.7	73.2	0	0	0	0	122.6
44	P	37	Very low	35.2	Very low	108 Å²	108	125 Å²	125	70%	0.701	74%	0.737	S	S	*	*				-151.2	142.7	85.9	28	-4.3	0	0	0	119.3
45	I	30.9	Very low	34.8	Very low	147 Å²	147	123.2 Å²	123.2	75%	0.754	73%	0.734	S	S	*	*				68.2	140.3	127.8	-45.6	165.4	0	0	0	121.4
46	T	37.7	Very low	34.5	Very low	114 Å²	114	125.1 Å²	125.1	70%	0.699	74%	0.737	S	S	*	*			trans	95.6	96.5	155.5	60.2	0	0	0	0	118.3
47	T	36.3	Very low	34.7	Very low	115 Å²	115	126.5 Å²	126.5	71%	0.706	75%	0.745	S	S	*	*				67.3	102.3	90.5	60.8	0	0	0	0	115.5
48	N	34.7	Very low	34.7	Very low	154 Å²	154	126.5 Å²	126.5	82%	0.824	74%	0.737	S	S	*	*				170.2	147.6	96.8	-98.4	-12	0	0	0	112.7
49	T	33.5	Very low	34.6	Very low	127 Å²	127	127.9 Å²	127.9	78%	0.779	74%	0.738	S	S	*	*			trans	-65.1	137.1	-174.1	42.3	0	0	0	0	116.3
50	S	38.5	Very low	34.6	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	74%	0.743	S	S	*	*			trans	-179.3	106.2	131.2	44.6	0	0	0	0	112.7
51	N	34.2	Very low	34.5	Very low	146 Å²	146	133.1 Å²	133.1	78%	0.781	75%	0.745	S	S	*	*				44.3	116.8	129.4	-65.6	-7.2	0	0	0	122.5
52	T	34.2	Very low	34.7	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	75%	0.753	S	S	*	*				79.1	134.9	122.9	60.1	0	0	0	0	121.9
53	S	34.9	Very low	34.7	Very low	109 Å²	109	135 Å²	135	76%	0.762	75%	0.754	S	S	*	*			trans	78.3	123.9	160.6	77.3	0	0	0	0	114.2
54	T	38.1	Very low	34.8	Very low	109 Å²	109	137.9 Å²	137.9	67%	0.669	76%	0.759	S	S	*	*				-176.3	130.5	62	-65.5	0	0	0	0	110.1
55	I	35.7	Very low	34.4	Very low	148 Å²	148	135.9 Å²	135.9	76%	0.759	76%	0.759	S	S	*	*			trans	75.9	103	149.5	-62.9	166.7	0	0	0	120.1
56	N	31	Very low	34.2	Very low	131 Å²	131	136.4 Å²	136.4	70%	0.701	76%	0.762	S	S	*	*			trans	-62.5	139.4	153.3	-84.6	-29	0	0	0	111.9
57	N	38.7	Very low	33.8	Very low	168 Å²	168	137.6 Å²	137.6	90%	0.898	76%	0.763	S	S	*	*			trans	-121	118.7	141.8	-92.5	-28.2	0	0	0	108.7
58	N	33.4	Very low	33.5	Very low	105 Å²	105	143 Å²	143	56%	0.561	77%	0.77	S	S	*	*			trans	-86	165.2	-175.1	-68.4	-53.3	0	0	0	112.4
59	F	30.7	Very low	33.2	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.833	77%	0.766	S	S	*	*			trans	75	124.8	158.7	-58.3	-74	0	0	0	114.6
60	I	32.7	Very low	33.3	Very low	150 Å²	150	145.7 Å²	145.7	77%	0.769	77%	0.773	S	S	*	*			cis	-156.9	135.9	49.9	-73.2	176	0	0	0	109.9
61	K	33.4	Very low	32.9	Very low	190 Å²	190	147.6 Å²	147.6	83%	0.826	77%	0.774	S	S	*	*			trans	14.2	139.9	142.1	-78.3	168.9	172.1	176.5	0	118.2
62	T	36.3	Very low	33	Very low	130 Å²	130	145.8 Å²	145.8	80%	0.798	77%	0.771	S	S	*	*			cis	-163.4	156.9	22.7	25	0	0	0	0	109.5
63	N	33.7	Very low	33	Very low	140 Å²	140	145 Å²	145	75%	0.749	77%	0.766	S	S	*	*			trans	-53.3	144.5	176.2	-65.9	-18.9	0	0	0	115.9
64	E	34.3	Very low	32.9	Very low	181 Å²	181	148.2 Å²	148.2	85%	0.846	78%	0.775	S	S	*	*				51.2	123.5	123.7	-55.5	177.6	152.7	0	0	119.4
65	G	28.9	Very low	32.6	Very low	67 Å²	67	148.3 Å²	148.3	69%	0.691	78%	0.775	S	S	*	*			trans	-75.1	158.9	168.7	0	0	0	0	0	113.7
66	L	27.8	Very low	32.3	Very low	158 Å²	158	146.7 Å²	146.7	83%	0.827	78%	0.776	S	S	*	*				177	133.8	126.4	-113.1	92	0	0	0	109.7
67	I	29.3	Very low	32.3	Very low	139 Å²	139	147.4 Å²	147.4	71%	0.713	77%	0.774	S	S	*	*			trans	66.5	115.9	151.1	-45.4	159.3	0	0	0	119.2
68	R	30.2	Very low	31.7	Very low	227 Å²	227	147 Å²	147	86%	0.857	77%	0.771	S	S	*	*				178	127.6	113.5	-96.9	180	-148.1	-142.1	1.3	113.2
69	N	28.9	Very low	31.6	Very low	139 Å²	139	151.6 Å²	151.6	74%	0.743	78%	0.782	S	S	*	*			trans	34.2	125	140.8	-70.3	-10.7	0	0	0	120.2
70	H	35.2	Very low	31.4	Very low	199 Å²	199	150.6 Å²	150.6	92%	0.921	78%	0.78	S	S	*	*				-160	123.5	116.4	-94.5	-65.8	0	0	0	110.1
71	N	29.7	Very low	31.5	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	78%	0.778	S	S	*	*			trans	-101.5	144.8	170.8	-155.6	7.3	0	0	0	107.3
72	P	36.9	Very low	31.4	Very low	109 Å²	109	148.7 Å²	148.7	71%	0.708	78%	0.775	S	S	*	*			trans	-134.3	121.8	135.4	32	-17.1	0	0	0	112
73	T	32.7	Very low	31.1	Very low	106 Å²	106	151 Å²	151	65%	0.65	78%	0.777	S	S	*	*			trans	8.9	119.2	138.3	44.2	0	0	0	0	118
74	N	33.6	Very low	30.8	Very low	176 Å²	176	149.8 Å²	149.8	94%	0.941	78%	0.779	S	S	*	*			trans	-125.5	103.7	138.1	-100.5	-17.3	0	0	0	108.8
75	T	31.4	Very low	30.7	Very low	110 Å²	110	147.5 Å²	147.5	68%	0.675	78%	0.782	S	S	*	*			trans	-81.8	136.3	176.3	-49.2	0	0	0	0	109.2
76	C	30.3	Very low	30.6	Very low	115 Å²	115	151.5 Å²	151.5	78%	0.777	79%	0.787	S	S	*	*			trans	-168	99.9	137.8	-109.3	0	0	0	0	111.6
77	H	29.7	Very low	30.6	Very low	145 Å²	145	152.5 Å²	152.5	67%	0.671	79%	0.787	S	S	*	*			trans	63.7	98.3	143.8	-67	-65.7	0	0	0	122.3	Y79	H77-Y79 AromaticContact ND1-CD2 3.95Å
78	L	27	Very low	30.7	Very low	159 Å²	159	152.3 Å²	152.3	83%	0.832	79%	0.793	S	S	*	*				-60.3	142.1	126.4	-83.9	106.6	0	0	0	110.6
79	Y	31	Very low	30.5	Very low	202 Å²	202	148.1 Å²	148.1	79%	0.792	79%	0.786	S	S	*	*			trans	-152.2	98.8	144.3	-110.7	-79.4	0	0	0	109.6	H77	H77-Y79 AromaticContact ND1-CD2 3.95Å
80	E	27	Very low	30.7	Very low	170 Å²	170	147.7 Å²	147.7	79%	0.794	79%	0.791	S	S	*	*			trans	-75.1	124	138.6	-98.1	175.9	144	0	0	106.5
81	H	33.6	Very low	30.5	Very low	156 Å²	156	143 Å²	143	72%	0.722	78%	0.78	S	S	*	*			trans	177.5	142.6	135.9	-114.3	-86.5	0	0	0	112.4
82	N	31.6	Very low	30.8	Very low	144 Å²	144	143 Å²	143	77%	0.77	78%	0.78	S	S	*	*			trans	101.5	112.4	144.8	-68	-23.3	0	0	0	120.8
83	Q	30.2	Very low	30.6	Very low	179 Å²	179	144.7 Å²	144.7	84%	0.836	78%	0.782	S	S	*	*			trans	-56.9	160.8	155.8	-61.2	-178.6	-3.3	0	0	112.8
84	S	28.4	Very low	30.7	Very low	113 Å²	113	147 Å²	147	79%	0.79	79%	0.789	S	S	*	*			trans	61.6	110	148.1	59.2	0	0	0	0	119.3
85	C	30.8	Very low	30.6	Very low	133 Å²	133	145.6 Å²	145.6	90%	0.899	78%	0.782	S	S	*	*			trans	-163.7	130.7	135.3	-166.4	0	0	0	0	111
86	L	27	Very low	30.6	Very low	152 Å²	152	148.8 Å²	148.8	80%	0.796	79%	0.794	S	S	*	*			trans	-80.7	169.7	171	-77.2	159.7	0	0	0	111.2
87	Q	29	Very low	30.7	Very low	178 Å²	178	152.6 Å²	152.6	83%	0.832	80%	0.797	S	S	*	*			trans	75.1	133.8	165.6	-64.7	168.5	-23.5	0	0	114.2
88	T	30.5	Very low	31	Very low	135 Å²	135	151.2 Å²	151.2	83%	0.828	80%	0.804	S	S	*	*				-168.1	149.5	53.2	-31.7	0	0	0	0	110.8
89	I	26.7	Very low	31.2	Very low	140 Å²	140	150.2 Å²	150.2	72%	0.718	80%	0.8	S	S	*	*			trans	-73.5	157.3	177.2	-61.6	157	0	0	0	111.6
90	P	33	Very low	31.4	Very low	130 Å²	130	148.9 Å²	148.9	84%	0.844	81%	0.806	S	S	*	*			trans	-110.9	121.5	147.6	20.4	-3	0	0	0	112.1
91	S	30.4	Very low	31.6	Very low	100 Å²	100	149.1 Å²	149.1	70%	0.699	81%	0.807	S	S	*	*			trans	-95.1	138.1	169.2	-56.5	0	0	0	0	110.3
92	N	35.5	Very low	31.7	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	81%	0.806	S	S	*	*			trans	-175.2	136.3	160	-86.2	-21.4	0	0	0	104
93	L	33.8	Very low	32	Very low	143 Å²	143	149 Å²	149	75%	0.749	80%	0.802	S	S	*	*			cis	-175.1	152.4	7.3	-120.6	152.4	0	0	0	105.6
94	I	34.5	Very low	32.3	Very low	155 Å²	155	148.1 Å²	148.1	80%	0.795	80%	0.798	S	S	*	*			trans	103.2	109.7	155.7	-56.8	148.6	0	0	0	118.8
95	N	30.6	Very low	32.5	Very low	147 Å²	147	147 Å²	147	79%	0.786	79%	0.79	S	S	*	*			trans	-46.8	148.8	167.2	-81	-37	0	0	0	115.9
96	L	33.1	Very low	32.5	Very low	177 Å²	177	145 Å²	145	93%	0.927	78%	0.778	S	S	*	*				-173.1	111.7	117.7	-96.2	141.5	0	0	0	109.9
97	K	32.1	Very low	32.7	Very low	194 Å²	194	144 Å²	144	84%	0.843	77%	0.773	S	S	*	*			trans	-82.8	143.6	167.3	-93.5	174.6	169.3	178.6	0	109.3
98	S	34.9	Very low	33	Very low	117 Å²	117	145.5 Å²	145.5	82%	0.818	78%	0.778	S	S	*	*				-173.8	127.1	128.9	53	0	0	0	0	110.9
99	D	30.6	Very low	33.1	Very low	138 Å²	138	145.5 Å²	145.5	74%	0.738	77%	0.771	S	S	*	*			trans	-66.7	158.6	179.9	-52.5	-68.9	0	0	0	113.8
100	N	37.2	Very low	33.5	Very low	173 Å²	173	145.6 Å²	145.6	93%	0.925	77%	0.773	S	S	*	*			trans	-164.8	127.7	133.9	-96.6	-23.9	0	0	0	112.4
101	E	30.3	Very low	33.4	Very low	176 Å²	176	145.2 Å²	145.2	82%	0.822	76%	0.764	S	S	*	*			trans	-72.3	167.7	177.3	-64.5	174.6	134.5	0	0	113.3
102	I	36.2	Very low	33.7	Very low	134 Å²	134	148.4 Å²	148.4	69%	0.687	77%	0.773	S	S	*	*				146.2	103.6	125	-71.1	171.6	0	0	0	113.5
103	K	37.4	Very low	33.5	Very low	162 Å²	162	145.8 Å²	145.8	70%	0.704	77%	0.767	S	S	*	*				57.9	147.5	126.3	-50.4	-178.9	-172.8	176.1	0	125
104	H	35.5	Very low	33.7	Very low	161 Å²	161	146.3 Å²	146.3	75%	0.745	77%	0.77	S	S	*	*			trans	80.4	141.2	148	-64.3	-51.9	0	0	0	117.8
105	S	32.9	Very low	33.8	Very low	89 Å²	89	145 Å²	145	62%	0.622	77%	0.765	S	S	*	*			cis	-170.6	136.3	-6.6	-90.3	0	0	0	0	108.9
106	S	31.3	Very low	34.2	Very low	93 Å²	93	144.1 Å²	144.1	65%	0.65	76%	0.759	S	S	*	*			trans	40.8	138.2	137.4	69	0	0	0	0	125.3
107	N	31.9	Very low	34.4	Very low	130 Å²	130	144.5 Å²	144.5	70%	0.695	75%	0.753	S	S	*	*			trans	89.5	117.6	140.9	-60.4	-22.3	0	0	0	119.6
108	F	33.8	Very low	34.3	Very low	210 Å²	210	143.3 Å²	143.3	92%	0.921	76%	0.755	S	S	*	*				-166.9	136	98.5	-107.2	-82.3	0	0	0	112.2
109	I	34	Very low	34.1	Very low	134 Å²	134	146.7 Å²	146.7	69%	0.687	76%	0.758	S	S	*	*			trans	-88.5	138.8	-180	-67.8	160.4	0	0	0	108.4
110	N	33.6	Very low	34.1	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	76%	0.758	S	S	*	*				-178.3	147	112.1	-127.4	-17.2	0	0	0	116.2
111	N	32.5	Very low	33.8	Very low	122 Å²	122	147.1 Å²	147.1	65%	0.652	75%	0.754	S	S	*	*			trans	-54.9	149.6	179.9	-61.4	-56.7	0	0	0	116.9
112	N	35.7	Very low	34	Very low	167 Å²	167	144.5 Å²	144.5	89%	0.893	75%	0.746	S	S	*	*				-166.5	132	106.1	-112	-15.8	0	0	0	113.9
113	S	32.5	Very low	33.9	Very low	96 Å²	96	146.7 Å²	146.7	67%	0.671	75%	0.753	S	S	*	*			trans	-82.2	153.8	-179	-55.9	0	0	0	0	113
114	N	37.1	Very low	33.8	Very low	154 Å²	154	147.1 Å²	147.1	82%	0.824	76%	0.757	S	S	*	*			trans	158.9	133.4	143	-79.2	-24	0	0	0	108.3
115	N	37.1	Very low	33.8	Very low	129 Å²	129	147 Å²	147	69%	0.69	76%	0.756	S	S	*	*			cis	-174.3	145.9	-11.6	-143.1	-6.9	0	0	0	106.6
116	I	37.8	Very low	33.7	Very low	127 Å²	127	149.8 Å²	149.8	65%	0.651	76%	0.763	S	S	*	*			trans	70.7	131.3	146	-63.5	157.7	0	0	0	118.4
117	K	37.1	Very low	33.8	Very low	185 Å²	185	151.2 Å²	151.2	80%	0.804	77%	0.769	S	S	*	*			cis	-162.7	131.3	-1.7	-114.9	173.4	-170	172.8	0	106.9
118	L	30.8	Very low	34.1	Very low	170 Å²	170	152.6 Å²	152.6	89%	0.89	77%	0.77	S	S	*	*			trans	-126.7	129.8	160.7	-158.6	80	0	0	0	106.2
119	H	31.1	Very low	34	Very low	188 Å²	188	149.4 Å²	149.4	87%	0.87	76%	0.763	S	S	*	*			trans	-128.1	118.2	172.9	-110.2	47.2	0	0	0	109.2
120	S	29.7	Very low	33.9	Very low	108 Å²	108	146.4 Å²	146.4	76%	0.755	77%	0.765	S	S	*	*			trans	-125.8	128.4	159.8	175.7	0	0	0	0	105.2
121	Y	32.3	Very low	33.9	Very low	212 Å²	212	146.1 Å²	146.1	83%	0.831	77%	0.768	S	S	*	*			trans	-154.5	109.8	162.5	-133.8	-102.3	0	0	0	111.2
122	N	34.3	Very low	33.9	Very low	121 Å²	121	148.4 Å²	148.4	65%	0.647	78%	0.775	S	S	*	*			trans	55.8	128	133.6	-63.1	-26.7	0	0	0	123.2
123	Q	33.8	Very low	33.7	Very low	179 Å²	179	147.2 Å²	147.2	84%	0.836	76%	0.764	S	S	*	*			trans	-62.2	149	156.7	-73	168.8	-30	0	0	111.7
124	H	34.6	Very low	33.9	Very low	171 Å²	171	150.1 Å²	150.1	79%	0.792	76%	0.764	S	S	*	*				-175.5	135.7	128.1	-97.5	-71.1	0	0	0	112.7
125	H	35.2	Very low	33.6	Very low	158 Å²	158	147.9 Å²	147.9	73%	0.731	76%	0.761	S	S	*	*			trans	67.9	109.8	148.8	-73.8	-71.2	0	0	0	125
126	L	30.9	Very low	33.5	Very low	148 Å²	148	149.8 Å²	149.8	78%	0.775	77%	0.77	S	S	*	*			trans	-0.9	131.9	133	-91	69.2	0	0	0	119.3
127	T	34.6	Very low	33.1	Very low	124 Å²	124	151 Å²	151	76%	0.761	78%	0.778	S	S	*	*				166.2	145.3	98.6	40.5	0	0	0	0	113.3
128	H	36.6	Very low	32.9	Very low	158 Å²	158	149.8 Å²	149.8	73%	0.731	78%	0.78	S	S	*	*			trans	77.9	115.9	147.3	-97.8	-94.3	0	0	0	123.4
129	N	32.7	Very low	33	Very low	144 Å²	144	152.6 Å²	152.6	77%	0.77	78%	0.779	S	S	*	*			trans	72	119.9	135.5	-70.8	1	0	0	0	123
130	G	31.6	Very low	33.3	Very low	70 Å²	70	149.4 Å²	149.4	72%	0.722	78%	0.778	S	S	*	*				119.6	117.4	121.6	0	0	0	0	0	117.7
131	V	34.4	Very low	33.6	Very low	137 Å²	137	152.6 Å²	152.6	83%	0.83	78%	0.781	S	S	*	*			trans	88.5	102.5	149.7	-164.7	0	0	0	0	118.7
132	E	31.6	Very low	34	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.794	77%	0.767	S	S	*	*			trans	20.5	121.1	135.7	-56.8	179.7	153.4	0	0	120.2
133	E	31.6	Very low	34.2	Very low	143 Å²	143	147.8 Å²	147.8	67%	0.668	77%	0.772	S	S	*	*				167.6	130.2	99.6	-89.1	-154	154.4	0	0	112.7
134	K	36.8	Very low	34.3	Very low	156 Å²	156	145.4 Å²	145.4	68%	0.678	77%	0.765	S	S	*	*			trans	61.9	111.1	137.6	-61.9	172.5	-173.8	153.2	0	121.3
135	S	31.7	Very low	34.5	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	75%	0.751	S	S	*	*			trans	74	116.7	135.4	76.8	0	0	0	0	118.8
136	L	33.9	Very low	34.7	Very low	169 Å²	169	139 Å²	139	89%	0.885	74%	0.744	S	S	*	*				177.6	99.4	118.7	-89.3	159.6	0	0	0	109.1
137	N	30.7	Very low	35.2	Very low	152 Å²	152	137 Å²	137	81%	0.813	74%	0.737	S	S	*	*			trans	-59.4	130.5	159.5	-88.8	-12.7	0	0	0	109
138	N	32.1	Very low	35.5	Very low	160 Å²	160	138.3 Å²	138.3	86%	0.856	74%	0.735	S	S	*	*			trans	172.3	63.2	147	-88.1	-9.7	0	0	0	112.7
139	R	33.9	Very low	35.6	Very low	230 Å²	230	136.9 Å²	136.9	87%	0.868	73%	0.729	S	S	*	*			trans	-119.2	19.8	175.8	-101.9	177	84.9	135.4	-1.4	116.1
140	S	35.9	Very low	35.9	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	73%	0.725	S	S	*	*	S	Bend	trans	-94.1	1.4	-179.2	-57.1	0	0	0	0	115.3
141	E	36.4	Very low	36.2	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	72%	0.723	S	S	*	*	S	Bend	trans	-101	-5.2	-176.9	-72.6	-174.3	157.2	0	0	115.3
142	T	40.5	Very low	36.5	Very low	90 Å²	90	140.5 Å²	140.5	55%	0.552	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-4.5	-170.9	-20.7	0	0	0	0	115
143	L	38.1	Very low	36.8	Very low	142 Å²	142	139.9 Å²	139.9	74%	0.743	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-12	-176.7	-70.3	175.4	0	0	0	114.9
144	N	36.7	Very low	37.1	Very low	129 Å²	129	137.7 Å²	137.7	69%	0.69	72%	0.718	S	S	*	*	S	Bend	trans	-91.3	-11.8	179.1	-73.6	-25.2	0	0	0	114
145	T	39.3	Very low	37.1	Very low	81 Å²	81	134.9 Å²	134.9	50%	0.497	72%	0.718	S	S	.	*	S	Bend	trans	-88.6	-24.9	-177.6	-51.9	0	0	0	0	112.9
146	I	38.7	Very low	37.6	Very low	115 Å²	115	137.1 Å²	137.1	59%	0.59	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-78.7	-24.1	-177.4	-61.7	173.4	0	0	0	111.9	Q148	I146-Q148 VanDerWaalsContact C-N 3.31Å; I146-Q148 PolarHBondContact O-N 2.86Å
147	V	42.1	Very low	38	Very low	104 Å²	104	135.3 Å²	135.3	63%	0.63	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-77.8	-15	178.3	-179.8	0	0	0	0	112.8
148	Q	40.7	Very low	38.3	Very low	152 Å²	152	134.5 Å²	134.5	71%	0.71	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-88.7	-13.7	178.8	-65.8	-174.2	15.5	0	0	113.7	I146	I146-Q148 VanDerWaalsContact C-N 3.31Å; I146-Q148 PolarHBondContact O-N 2.86Å
149	Q	39.4	Very low	38.5	Very low	129 Å²	129	132.5 Å²	132.5	60%	0.603	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-18.3	-173.1	-67.6	-179.7	-2.4	0	0	114	N151	Q149-N151 PolarHBondContact O-N 3.39Å
150	S	38.4	Very low	38.8	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	9.1	-179.3	68.9	0	0	0	0	115.2
151	N	37.9	Very low	39.1	Very low	128 Å²	128	128.9 Å²	128.9	68%	0.684	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	17.7	-178.8	-75.6	-24.8	0	0	0	113.1	Q149	Q149-N151 PolarHBondContact O-N 3.39Å
152	R	40	Very low	39	Very low	201 Å²	201	126.8 Å²	126.8	76%	0.758	71%	0.705	S	S	*	*			trans	-88	-4.7	-171.8	-86	-174.5	170.9	-177.5	-3.3	116.4
153	D	37.5	Very low	39	Very low	157 Å²	157	128.6 Å²	128.6	84%	0.84	72%	0.716	S	S	*	*			trans	-114.7	68.3	-176.6	-56.2	-31.8	0	0	0	112.2
154	T	38.8	Very low	39.3	Very low	96 Å²	96	129 Å²	129	59%	0.589	72%	0.719	S	S	*	*			trans	-157.8	72.5	163.1	42.2	0	0	0	0	111.7	K201	T154-K201 PolarHBondContact O-NZ 3.15Å; T154-K201 PolarHBondContact OG1-NZ 3.04Å
155	S	37.6	Very low	39.4	Very low	97 Å²	97	129 Å²	129	68%	0.678	72%	0.724	S	S	*	*			trans	-152.1	103.4	156.1	41	0	0	0	0	105.6
156	D	41.6	Very low	39.4	Very low	154 Å²	154	130.7 Å²	130.7	82%	0.824	73%	0.734	S	S	*	*			trans	173.4	142.5	132.1	-79.3	-18.8	0	0	0	110.8
157	T	41.5	Very low	39.6	Very low	132 Å²	132	130.8 Å²	130.8	81%	0.81	74%	0.74	S	S	*	*			trans	89.7	78.8	163	-26.9	0	0	0	0	117.8
158	T	37.5	Very low	39.5	Very low	134 Å²	134	131.5 Å²	131.5	82%	0.822	75%	0.745	S	S	*	*			trans	-103.2	137.7	135.6	35.6	0	0	0	0	108.3
159	T	36.6	Very low	39.6	Very low	119 Å²	119	129.7 Å²	129.7	73%	0.73	74%	0.744	S	S	*	*			trans	107.3	102.6	161.8	-37.5	0	0	0	0	115.6
160	T	40.4	Very low	39.8	Very low	127 Å²	127	129.3 Å²	129.3	78%	0.779	75%	0.751	S	S	*	*			trans	-162	109.3	131.7	43.2	0	0	0	0	111.4
161	N	41.7	Very low	40	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	75%	0.753	S	S	*	*			trans	60.3	112.2	130.2	-57.5	-6.5	0	0	0	122.5
162	T	34.1	Very low	40.3	Very low	132 Å²	132	131.1 Å²	131.1	81%	0.81	76%	0.757	S	S	*	*			trans	-44.8	134.9	145.8	-44.3	0	0	0	0	113.3
163	T	39.6	Very low	40.5	Very low	128 Å²	128	125.8 Å²	125.8	79%	0.785	75%	0.751	S	S	*	*				179.8	130.2	127.4	20.8	0	0	0	0	110.7
164	N	44.7	Very low	40.9	Very low	150 Å²	150	125 Å²	125	80%	0.802	75%	0.747	S	S	*	*			trans	-136.5	123	156.2	-93.5	-10.8	0	0	0	107.1
165	T	39.1	Very low	41.2	Very low	129 Å²	129	126.1 Å²	126.1	79%	0.791	75%	0.749	S	S	*	*			trans	61.5	125.6	146.9	39	0	0	0	0	117.8
166	T	40.1	Very low	41.6	Very low	117 Å²	117	127.5 Å²	127.5	72%	0.718	75%	0.749	S	S	*	*			cis	-167.4	169.3	25.7	-46	0	0	0	0	108.6
167	T	41.4	Very low	41.7	Very low	116 Å²	116	125.8 Å²	125.8	71%	0.712	74%	0.74	S	S	*	*			trans	90.4	106	152.3	25.7	0	0	0	0	120.6
168	T	41.4	Very low	41.8	Very low	119 Å²	119	125.4 Å²	125.4	73%	0.73	73%	0.733	S	S	*	*			trans	60.9	127.8	132.6	50.5	0	0	0	0	118
169	T	42.7	Very low	42.1	Very low	114 Å²	114	126.9 Å²	126.9	70%	0.699	74%	0.736	S	S	*	*			cis	-179.6	144.3	38.3	13.5	0	0	0	0	109.2
170	T	42.6	Very low	42.4	Very low	122 Å²	122	126 Å²	126	75%	0.748	74%	0.735	S	S	*	*			trans	54.6	141.8	143.9	54.5	0	0	0	0	121.1
171	T	43	Very low	42.8	Very low	117 Å²	117	124.4 Å²	124.4	72%	0.718	73%	0.729	S	S	*	*			cis	-179.4	161.8	-7.9	18.5	0	0	0	0	106.7
172	N	44.6	Very low	42.8	Very low	146 Å²	146	124 Å²	124	78%	0.781	73%	0.726	S	S	*	*			trans	84.1	142.5	159.5	-67.3	-1.7	0	0	0	119.4
173	S	43.6	Very low	43.4	Very low	90 Å²	90	124.5 Å²	124.5	63%	0.629	72%	0.724	S	S	*	*			cis	174.8	153.2	-24.4	-100.7	0	0	0	0	107.5
174	N	45.7	Very low	43.5	Very low	140 Å²	140	125.1 Å²	125.1	75%	0.749	72%	0.723	S	S	*	*			trans	77.5	141.1	154.2	-66.3	-4.7	0	0	0	119.1
175	N	46.2	Very low	43.7	Very low	120 Å²	120	125 Å²	125	64%	0.642	72%	0.722	S	S	*	*			cis	-173	147	-8.9	-127.5	-9.2	0	0	0	108.9
176	N	44.8	Very low	44.2	Very low	125 Å²	125	125.6 Å²	125.6	67%	0.668	72%	0.721	S	S	*	*			trans	48.5	151.1	133.4	-68.6	-9	0	0	0	122.1
177	N	43.8	Very low	44.7	Very low	119 Å²	119	125.9 Å²	125.9	64%	0.636	72%	0.717	S	S	*	*			cis	-178	152	-16.8	-118.9	-8.6	0	0	0	106.6
178	N	44.1	Very low	44.7	Very low	124 Å²	124	130 Å²	130	66%	0.663	72%	0.72	S	S	*	*			trans	57.5	124.5	142.9	-56.1	-14.8	0	0	0	121.7
179	N	45.1	Very low	44.9	Very low	164 Å²	164	132 Å²	132	88%	0.877	72%	0.723	S	S	*	*				177.1	157.7	89.6	-105.8	-18.7	0	0	0	113.7
180	S	42	Very low	45.1	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	73%	0.726	S	S	*	*			trans	-90.1	162.4	-164.8	-174.5	0	0	0	0	115.2
181	S	48.8	Very low	45.1	Very low	93 Å²	93	130.8 Å²	130.8	65%	0.65	72%	0.724	S	S	*	*			trans	103	132.4	140.6	-61.8	0	0	0	0	120.5
182	N	42	Very low	45.1	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	73%	0.728	S	S	*	*			trans	75.8	136.8	146.6	-74	21.8	0	0	0	116.7
183	D	47.4	Very low	45.1	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	73%	0.732	S	S	*	*			cis	-154.4	166.5	27.1	-87.3	-46.6	0	0	0	111.8
184	N	40.9	Very low	45.5	Very low	142 Å²	142	136.6 Å²	136.6	76%	0.759	74%	0.738	S	S	*	*			trans	-73.4	169.5	177.9	-64.6	-64.5	0	0	0	113.9
185	D	49.6	Very low	45.7	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	74%	0.735	S	S	*	*			trans	110.6	135.5	147.1	-58.8	-36.8	0	0	0	118.8
186	D	49.6	Very low	46.4	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	74%	0.74	S	S	*	*			trans	93	104.7	154.5	-63.3	-24	0	0	0	121.9
187	D	50	Low	47.2	Very low	122 Å²	122	136.4 Å²	136.4	65%	0.652	74%	0.743	S	S	*	*				84.1	107.9	122.8	-90.1	-20	0	0	0	122
188	R	41.5	Very low	48.2	Very low	204 Å²	204	141.5 Å²	141.5	77%	0.77	75%	0.754	S	S	*	*				63.4	122.3	116.9	-81.7	-178.9	169.1	-177.1	-2.7	120.3
189	M	44.5	Very low	49.6	Very low	159 Å²	159	146.7 Å²	146.7	78%	0.783	76%	0.764	S	S	*	*			trans	80.3	104.5	146.6	-56.4	-66	128.8	0	0	118.3
190	S	48.6	Very low	51.2	Low	109 Å²	109	150.6 Å²	150.6	76%	0.762	77%	0.766	S	S	*	*				165	123.1	114.3	-81.6	0	0	0	0	113.6
191	S	41.5	Very low	53.1	Low	102 Å²	102	153.3 Å²	153.3	71%	0.713	77%	0.765	S	S	*	*			trans	39.4	109.5	141.8	64	0	0	0	0	119.7
192	N	43.5	Very low	54.9	Low	151 Å²	151	159.6 Å²	159.6	81%	0.807	78%	0.775	S	S	*	*			trans	-145.1	90.6	139.3	-107	-21.2	0	0	0	111.9	H194	N192-H194 VanDerWaalsContact C-N 3.26Å; N192-H194 PolarHBondContact O-N 3.4Å
193	L	43.9	Very low	57.2	Low	164 Å²	164	163.2 Å²	163.2	86%	0.859	78%	0.778	S	S	*	*			trans	-70	78	168.1	-166.5	78.5	0	0	0	108.8	T195	L193-T195 PolarHBondContact O-N 2.85Å
194	H	51.7	Low	59.3	Low	161 Å²	161	162.6 Å²	162.6	75%	0.745	77%	0.773	S	S	*	*			trans	-83.9	100.1	170.8	-103.4	28.7	0	0	0	110	N192 V196	N192-H194 VanDerWaalsContact C-N 3.26Å; N192-H194 PolarHBondContact O-N 3.4Å; H194-V196 PolarHBondContact O-N 3.47Å
195	T	51.2	Low	61.9	Low	115 Å²	115	162.2 Å²	162.2	71%	0.706	77%	0.771	S	S	*	*			trans	-54.6	99.7	169.4	44.2	0	0	0	0	110.1	L193 I197	L193-T195 PolarHBondContact O-N 2.85Å; T195-I197 VanDerWaalsContact C-N 3.28Å; T195-I197 PolarHBondContact O-N 3.37Å
196	V	59.4	Low	64.1	Low	123 Å²	123	158.1 Å²	158.1	75%	0.745	75%	0.746	S	S	*	*			trans	-68.8	88	172.9	-176.8	0	0	0	0	108.5	H194 R198	H194-V196 PolarHBondContact O-N 3.47Å; V196-R198 VanDerWaalsContact C-N 3.26Å; V196-R198 HydrophobicContact CG1-CG 4.08Å; V196-R198 PolarHBondContact O-N 2.89Å
197	I	61.8	Low	66.4	Low	142 Å²	142	154.1 Å²	154.1	73%	0.728	73%	0.729	S	S	*	*			trans	-62.5	93.9	163.4	-60	175	0	0	0	106.3	T195 R199	T195-I197 VanDerWaalsContact C-N 3.28Å; T195-I197 PolarHBondContact O-N 3.37Å; I197-R199 PolarHBondContact O-N 2.96Å
198	R	65.1	Low	68.7	Low	226 Å²	226	157.6 Å²	157.6	85%	0.853	74%	0.738	S	S	*	*			trans	-63.7	96.2	176.2	-67.8	-172	-179.1	-168.5	2.1	109	V196 R200	V196-R198 VanDerWaalsContact C-N 3.26Å; V196-R198 HydrophobicContact CG1-CG 4.08Å; V196-R198 PolarHBondContact O-N 2.89Å; R198-R200 PolarHBondContact O-N 3.3Å
199	R	73.2	Confident	71.4	Confident	234 Å²	234	154.6 Å²	154.6	88%	0.883	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-58.5	129.3	173.8	-67.2	-173.6	172.2	104.3	-1.7	109.3	I197 K201	I197-R199 PolarHBondContact O-N 2.96Å; R199-K201 PolarHBondContact O-N 3.37Å
200	R	79.2	Confident	73.9	Confident	245 Å²	245	148.9 Å²	148.9	93%	0.925	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-63	133.3	176	-73.1	-178.1	167.8	96.6	-1.6	109.7	R198 R202	R198-R200 PolarHBondContact O-N 3.3Å; R200-R202 PolarHBondContact O-N 3.18Å
201	K	80.9	Confident	76.3	Confident	160 Å²	160	145.8 Å²	145.8	70%	0.696	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.4	177	-167.6	163.5	-176.4	166.4	0	109.8	T154 R199 R203	T154-K201 PolarHBondContact O-NZ 3.15Å; T154-K201 PolarHBondContact OG1-NZ 3.04Å; R199-K201 PolarHBondContact O-N 3.37Å; K201-R203 PolarHBondContact O-N 3.21Å
202	R	88	Confident	79	Confident	224 Å²	224	143.3 Å²	143.3	85%	0.845	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-59.9	134	177.5	-178.4	175.5	176	161.2	-1	109.9	R200 I204	R200-R202 PolarHBondContact O-N 3.18Å; R202-I204 PolarHBondContact O-N 3.47Å
203	R	90.6	Very high	81.6	Confident	213 Å²	213	139.5 Å²	139.5	80%	0.804	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-68.2	126.5	173.5	-173.9	175	-178.8	166.3	-0.5	109.4	K201	K201-R203 PolarHBondContact O-N 3.21Å
204	I	90.4	Very high	84.2	Confident	129 Å²	129	131.7 Å²	131.7	66%	0.662	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-96.4	135.4	174.2	-57.4	173.2	0	0	0	107.8	R202	R202-I204 PolarHBondContact O-N 3.47Å
205	L	95.4	Very high	86.4	Confident	134 Å²	134	128.3 Å²	128.3	70%	0.702	59%	0.591	S	S	*	*			trans	-107.7	147.5	174.2	-62.5	175.4	0	0	0	109
206	F	97.2	Very high	88.6	Confident	62 Å²	62	127 Å²	127	27%	0.272	58%	0.576	S	S	.	*			trans	-73	148.2	170.9	-58.9	-42.2	0	0	0	110.4	Q210 L214 L238 Q242 W246	F206-Q210 HydrophobicContact CB-CB 4.07Å; F206-L214 HydrophobicContact CD2-CD1 4.17Å; F206-L214 HydrophobicContact CE2-CD1 4.47Å; F206-L238 HydrophobicContact CD1-CD1 4.12Å; F206-L238 HydrophobicContact CD1-CD2 3.76Å; F206-L238 HydrophobicContact CE1-CD1 3.99Å; F206-L238 HydrophobicContact CE1-CD2 3.64Å; F206-L238 HydrophobicContact CE1-CG 4.47Å; F206-L238 HydrophobicContact CZ-CD1 4.4Å; F206-Q242 HydrophobicContact CE1-CB 4.34Å; F206-Q242 HydrophobicContact CE1-CG 4.45Å; F206-Q242 HydrophobicContact CZ-CB 4.07Å; F206-Q242 HydrophobicContact CZ-CG 4.41Å; F206-W246 AromaticContact CD2-CD1 3.73Å; F206-W246 HydrophobicContact CE2-CB 4.16Å; F206-W246 AromaticContact CE2-CD1 3.55Å; F206-W246 HydrophobicContact CE2-CG 4.15Å
207	S	97.8	Very high	90.4	Very high	57 Å²	57	122.1 Å²	122.1	40%	0.399	55%	0.548	S	S	.	.			trans	-66.4	163.5	173.3	78.7	0	0	0	0	111	L209 Q210 T211	S207-L209 VanDerWaalsContact C-N 3.3Å; S207-L209 PolarHBondContact O-N 3.28Å; S207-Q210 PolarHBondContact O-N 3.37Å; S207-Q210 WeakPolarHBondContact OG-CB 3.38Å; S207-Q210 VanDerWaalsContact OG-CG 3.32Å; S207-Q210 WeakPolarHBondContact OG-CG 3.24Å; S207-Q210 PolarHBondContact OG-N 3.07Å; S207-Q210 VanDerWaalsContact OG-N 3.11Å; S207-T211 PolarHBondContact O-N 3.32Å; S207-T211 PolarHBondContact O-OG1 3.44Å
208	K	97.7	Very high	92.2	Very high	195 Å²	195	115.5 Å²	115.5	85%	0.848	51%	0.514	S	S	*	.	H	α-helix	trans	-59.6	-41.9	175.5	-69.2	-173.9	179	-178.4	0	111.6	T211 A212	K208-T211 PolarHBondContact O-N 3.43Å; K208-A212 WeakPolarHBondContact O-CB 3.18Å; K208-A212 PolarHBondContact O-N 2.99Å
209	L	97.5	Very high	93.7	Very high	142 Å²	142	110.8 Å²	110.8	74%	0.743	51%	0.505	S	S	*	.	H	α-helix	trans	-63	-44.6	176.9	-179.1	64	0	0	0	111.8	S207 T211 A212 K213	S207-L209 VanDerWaalsContact C-N 3.3Å; S207-L209 PolarHBondContact O-N 3.28Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-T211 PolarHBondContact O-N 2.99Å; L209-A212 PolarHBondContact O-N 3.16Å; L209-K213 PolarHBondContact O-N 3.03Å; L209-K213 VanDerWaalsContact O-N 3.1Å
210	Q	98.2	Very high	94.8	Very high	39 Å²	39	106.7 Å²	106.7	18%	0.182	50%	0.496	C	S	.	.	H	α-helix	trans	-60.2	-45.4	175.6	-75.2	172.3	-27.7	0	0	111.3	F206 S207 L214 L236	F206-Q210 HydrophobicContact CB-CB 4.07Å; S207-Q210 PolarHBondContact O-N 3.37Å; S207-Q210 WeakPolarHBondContact OG-CB 3.38Å; S207-Q210 VanDerWaalsContact OG-CG 3.32Å; S207-Q210 WeakPolarHBondContact OG-CG 3.24Å; S207-Q210 PolarHBondContact OG-N 3.07Å; S207-Q210 VanDerWaalsContact OG-N 3.11Å; Q210-L214 WeakPolarHBondContact O-CB 3.06Å; Q210-L214 WeakPolarHBondContact O-CD1 3.42Å; Q210-L214 WeakPolarHBondContact O-CG 3.32Å; Q210-L214 PolarHBondContact O-N 3.37Å; Q210-L236 HydrophobicContact CG-CB 4.45Å; Q210-L236 PolarHBondContact NE2-O 3Å
211	T	98	Very high	95.7	Very high	43 Å²	43	98.6 Å²	98.6	26%	0.264	47%	0.469	S	S	.	.	H	α-helix	trans	-64.8	-44.4	179.9	-52.7	0	0	0	0	111.4	S207 K208 L209 K213 L214 E215	S207-T211 PolarHBondContact O-N 3.32Å; S207-T211 PolarHBondContact O-OG1 3.44Å; K208-T211 PolarHBondContact O-N 3.43Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-T211 PolarHBondContact O-N 2.99Å; T211-K213 PolarHBondContact O-N 3.3Å; T211-L214 PolarHBondContact O-N 3.11Å; T211-E215 HydrophobicContact CG2-CG 4.49Å; T211-E215 WeakPolarHBondContact O-CG 3.48Å; T211-E215 PolarHBondContact O-N 3.28Å
212	A	98	Very high	96.4	Very high	51 Å²	51	97.7 Å²	97.7	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-59.7	-45.9	178.7	0	0	0	0	0	112.2	K208 L209 E215 E216	K208-A212 WeakPolarHBondContact O-CB 3.18Å; K208-A212 PolarHBondContact O-N 2.99Å; L209-A212 PolarHBondContact O-N 3.16Å; A212-E215 PolarHBondContact O-N 2.95Å; A212-E216 WeakPolarHBondContact O-CB 3.5Å; A212-E216 PolarHBondContact O-N 3.45Å
213	K	98	Very high	96.9	Very high	71 Å²	71	94.3 Å²	94.3	31%	0.309	45%	0.45	S	S	.	.	H	α-helix	trans	-71	-33.1	179.5	-170.1	57	175	-177.1	0	113	L209 T211 E215 E216 C217 L232 L236	L209-K213 PolarHBondContact O-N 3.03Å; L209-K213 VanDerWaalsContact O-N 3.1Å; T211-K213 PolarHBondContact O-N 3.3Å; K213-E215 VanDerWaalsContact C-N 3.35Å; K213-E216 HydrophobicContact CD-CB 4.48Å; K213-E216 WeakPolarHBondContact CD-OE2 3.17Å; K213-E216 WeakPolarHBondContact CE-OE2 3.21Å; K213-E216 IonicContact NZ-OE1 2.8Å; K213-E216 PolarHBondContact NZ-OE1 3.21Å; K213-E216 IonicContact NZ-OE2 2.86Å; K213-E216 PolarHBondContact NZ-OE2 2.87Å; K213-C217 WeakPolarHBondContact O-CB 3.49Å; K213-C217 PolarHBondContact O-N 3.37Å; K213-L232 HydrophobicContact CG-CD1 4.41Å; K213-L236 HydrophobicContact CB-CD2 3.7Å; K213-L236 HydrophobicContact CG-CD2 3.78Å
214	L	98.6	Very high	97.3	Very high	0 Å²	0	85.4 Å²	85.4	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-62.8	-42.3	171	-74.7	165.1	0	0	0	111.2	F206 Q210 T211 F218 L232 L236 L238 V243 W246 F247	F206-L214 HydrophobicContact CD2-CD1 4.17Å; F206-L214 HydrophobicContact CE2-CD1 4.47Å; Q210-L214 WeakPolarHBondContact O-CB 3.06Å; Q210-L214 WeakPolarHBondContact O-CD1 3.42Å; Q210-L214 WeakPolarHBondContact O-CG 3.32Å; Q210-L214 PolarHBondContact O-N 3.37Å; T211-L214 PolarHBondContact O-N 3.11Å; L214-F218 VanDerWaalsContact O-CB 3.25Å; L214-F218 WeakPolarHBondContact O-CB 3.22Å; L214-F218 PolarHBondContact O-N 3.28Å; L214-L232 HydrophobicContact CD2-CD2 4.03Å; L214-L236 HydrophobicContact CD1-CD1 4.38Å; L214-L236 HydrophobicContact CD2-CD1 3.71Å; L214-L236 HydrophobicContact CG-CD1 3.61Å; L214-L238 HydrophobicContact CD1-CD1 4.22Å; L214-V243 HydrophobicContact CD2-CG1 4.35Å; L214-W246 VanDerWaalsContact C-CH2 3.42Å; L214-W246 HydrophobicContact CB-CD2 3.88Å; L214-W246 HydrophobicContact CB-CE3 3.9Å; L214-W246 HydrophobicContact CB-CH2 3.64Å; L214-W246 HydrophobicContact CB-CZ2 3.59Å; L214-W246 HydrophobicContact CB-CZ3 3.79Å; L214-W246 HydrophobicContact CD1-CD2 3.87Å; L214-W246 HydrophobicContact CD1-CG 3.85Å; L214-W246 HydrophobicContact CD2-CD2 4.2Å; L214-W246 HydrophobicContact CD2-CE3 4.07Å; L214-W246 HydrophobicContact CG-CD2 4.2Å; L214-W246 HydrophobicContact CG-CE3 4.38Å; L214-W246 WeakPolarHBondContact O-CH2 3.36Å; L214-W246 WeakPolarHBondContact O-CZ3 3.32Å; L214-F247 HydrophobicContact CD2-CE2 4.08Å
215	E	98.3	Very high	97.6	Very high	89 Å²	89	82.6 Å²	82.6	42%	0.416	41%	0.407	S	S	.	.	H	α-helix	trans	-67.1	-43.3	176.8	-72.2	177.1	174.9	0	0	112.4	T211 A212 K213 F218 N219 W246	T211-E215 HydrophobicContact CG2-CG 4.49Å; T211-E215 WeakPolarHBondContact O-CG 3.48Å; T211-E215 PolarHBondContact O-N 3.28Å; A212-E215 PolarHBondContact O-N 2.95Å; K213-E215 VanDerWaalsContact C-N 3.35Å; E215-F218 PolarHBondContact O-N 2.93Å; E215-N219 PolarHBondContact O-N 3.39Å; E215-N219 PolarHBondContact O-ND2 3.43Å; E215-W246 HydrophobicContact CG-CH2 3.95Å; E215-W246 HydrophobicContact CG-CZ2 3.79Å
216	E	97.9	Very high	97.7	Very high	87 Å²	87	79.2 Å²	79.2	41%	0.407	40%	0.398	S	S	.	.	H	α-helix	trans	-55.4	-54.8	174	-172.9	-169.6	159.8	0	0	111.1	A212 K213 F218 N219 E220	A212-E216 WeakPolarHBondContact O-CB 3.5Å; A212-E216 PolarHBondContact O-N 3.45Å; K213-E216 HydrophobicContact CD-CB 4.48Å; K213-E216 WeakPolarHBondContact CD-OE2 3.17Å; K213-E216 WeakPolarHBondContact CE-OE2 3.21Å; K213-E216 IonicContact NZ-OE1 2.8Å; K213-E216 PolarHBondContact NZ-OE1 3.21Å; K213-E216 IonicContact NZ-OE2 2.86Å; K213-E216 PolarHBondContact NZ-OE2 2.87Å; E216-F218 VanDerWaalsContact C-N 3.3Å; E216-F218 PolarHBondContact O-N 3.03Å; E216-N219 PolarHBondContact O-N 3.36Å; E216-E220 PolarHBondContact O-N 3.31Å
217	C	97.4	Very high	97.8	Very high	21 Å²	21	80.4 Å²	80.4	14%	0.142	41%	0.414	C	S	.	.	H	α-helix	trans	-64	-34.2	178.7	-174.9	0	0	0	0	112.5	K213 N219 E220 Q221 L232 F247	K213-C217 WeakPolarHBondContact O-CB 3.49Å; K213-C217 PolarHBondContact O-N 3.37Å; C217-N219 VanDerWaalsContact C-N 3.35Å; C217-E220 PolarHBondContact O-N 2.95Å; C217-Q221 PolarHBondContact O-N 3.42Å; C217-L232 HydrophobicContact CB-CD2 4.18Å; C217-F247 HydrophobicContact CB-CZ 4.45Å
218	F	98.2	Very high	97.8	Very high	3 Å²	3	80.8 Å²	80.8	1%	0.013	41%	0.409	C	S	.	.	H	α-helix	trans	-65.7	-37.6	176	-173.5	-91.4	0	0	0	113	L214 E215 E216 E220 Q221 R222 W246 F247 H250 R251 M254	L214-F218 VanDerWaalsContact O-CB 3.25Å; L214-F218 WeakPolarHBondContact O-CB 3.22Å; L214-F218 PolarHBondContact O-N 3.28Å; E215-F218 PolarHBondContact O-N 2.93Å; E216-F218 VanDerWaalsContact C-N 3.3Å; E216-F218 PolarHBondContact O-N 3.03Å; F218-E220 VanDerWaalsContact C-N 3.32Å; F218-Q221 CarbonylContact O-C 3.56Å; F218-R222 HydrophobicContact CE1-CG 3.98Å; F218-R222 HydrophobicContact CE2-CB 4.26Å; F218-R222 HydrophobicContact CE2-CG 4.42Å; F218-R222 HydrophobicContact CZ-CB 4.12Å; F218-R222 HydrophobicContact CZ-CG 3.89Å; F218-W246 HydrophobicContact CB-CH2 4.01Å; F218-W246 HydrophobicContact CB-CZ3 3.85Å; F218-W246 HydrophobicContact CD2-CZ3 4.04Å; F218-W246 HydrophobicContact CG-CH2 4.42Å; F218-W246 HydrophobicContact CG-CZ3 4.17Å; F218-F247 HydrophobicContact CB-CE1 4.22Å; F218-F247 HydrophobicContact CB-CZ 4.33Å; F218-F247 AromaticContact CD2-CD1 3.62Å; F218-F247 HydrophobicContact CD2-CD1 3.62Å; F218-F247 AromaticContact CD2-CE1 3.68Å; F218-F247 HydrophobicContact CD2-CE1 3.68Å; F218-F247 HydrophobicContact CD2-CG 4.35Å; F218-F247 HydrophobicContact CD2-CZ 4.43Å; F218-F247 HydrophobicContact CE2-CD1 4.15Å; F218-F247 HydrophobicContact CG-CE1 4.43Å; F218-H250 AromaticContact CD1-CD2 3.28Å; F218-H250 WeakPolarHBondContact CD1-CD2 3.34Å; F218-H250 AromaticContact CD1-NE2 3.32Å; F218-H250 VanDerWaalsContact CD1-NE2 3.32Å; F218-H250 WeakPolarHBondContact CD1-NE2 3.13Å; F218-H250 HydrophobicContact CD2-CB 4.21Å; F218-H250 AromaticContact CD2-CD2 3.85Å; F218-H250 AromaticContact CE1-CD2 3.04Å; F218-H250 WeakPolarHBondContact CE1-CD2 3.41Å; F218-H250 AromaticContact CE1-NE2 3.39Å; F218-H250 WeakPolarHBondContact CE1-NE2 3.46Å; F218-H250 HydrophobicContact CE2-CB 4.05Å; F218-H250 AromaticContact CE2-CD2 3.65Å; F218-H250 AromaticContact CG-CD2 3.69Å; F218-H250 AromaticContact CG-NE2 3.98Å; F218-H250 HydrophobicContact CZ-CB 4.42Å; F218-H250 AromaticContact CZ-CD2 3.25Å; F218-H250 WeakPolarHBondContact CZ-CD2 3.21Å; F218-R251 HydrophobicContact CE2-CG 3.75Å; F218-R251 HydrophobicContact CZ-CG 3.86Å; F218-M254 HydrophobicContact CE1-SD 4.28Å
219	N	97.1	Very high	97.8	Very high	128 Å²	128	74.7 Å²	74.7	68%	0.684	38%	0.381	S	S	*	.	H	α-helix	trans	-69	-33.6	178.2	-70	-24.5	0	0	0	111.5	E215 E216 C217	E215-N219 PolarHBondContact O-N 3.39Å; E215-N219 PolarHBondContact O-ND2 3.43Å; E216-N219 PolarHBondContact O-N 3.36Å; C217-N219 VanDerWaalsContact C-N 3.35Å
220	E	97.3	Very high	97.9	Very high	147 Å²	147	73.1 Å²	73.1	69%	0.687	37%	0.37	S	S	*	.	H	α-helix	trans	-71.6	-48.5	172	-66.7	173.7	177.7	0	0	111.8	E216 C217 F218	E216-E220 PolarHBondContact O-N 3.31Å; C217-E220 PolarHBondContact O-N 2.95Å; F218-E220 VanDerWaalsContact C-N 3.32Å
221	Q	96.8	Very high	97.9	Very high	75 Å²	75	75.7 Å²	75.7	35%	0.35	38%	0.382	S	S	.	.			trans	-144.1	109.6	-174.4	-173.4	177.9	-19.8	0	0	112.2	C217 F218 Y223 L224 E228 F247	C217-Q221 PolarHBondContact O-N 3.42Å; F218-Q221 CarbonylContact O-C 3.56Å; Q221-Y223 WeakPolarHBondContact CG-O 3.37Å; Q221-Y223 PolarHBondContact NE2-O 2.96Å; Q221-Y223 PolarHBondContact O-N 2.9Å; Q221-L224 HydrophobicContact CB-CD2 4.49Å; Q221-L224 HydrophobicContact CG-CD2 4.42Å; Q221-E228 PolarHBondContact NE2-OE2 3.4Å; Q221-F247 WeakPolarHBondContact O-CE1 3.39Å
222	R	97	Very high	97.9	Very high	141 Å²	141	74.1 Å²	74.1	53%	0.532	37%	0.372	S	S	.	.	S	Bend	trans	-69.9	-14	-176.8	-65.5	-176.9	171.4	126.3	-1.4	115.1	F218 R251	F218-R222 HydrophobicContact CE1-CG 3.98Å; F218-R222 HydrophobicContact CE2-CB 4.26Å; F218-R222 HydrophobicContact CE2-CG 4.42Å; F218-R222 HydrophobicContact CZ-CB 4.12Å; F218-R222 HydrophobicContact CZ-CG 3.89Å; R222-R251 WeakPolarHBondContact O-CD 3.49Å
223	Y	98.2	Very high	97.9	Very high	154 Å²	154	71.8 Å²	71.8	60%	0.604	35%	0.353	S	S	*	.	S	Bend	trans	-138.8	112	-175.4	-67.1	-100.8	0	0	0	110.2	Q221	Q221-Y223 WeakPolarHBondContact CG-O 3.37Å; Q221-Y223 PolarHBondContact NE2-O 2.96Å; Q221-Y223 PolarHBondContact O-N 2.9Å
224	L	97.8	Very high	97.9	Very high	26 Å²	26	76.1 Å²	76.1	14%	0.136	37%	0.367	C	S	.	.			trans	-90.3	141.5	179.2	-58.9	179.6	0	0	0	112.9	Q221 E228 R229 L232 V243 F247	Q221-L224 HydrophobicContact CB-CD2 4.49Å; Q221-L224 HydrophobicContact CG-CD2 4.42Å; L224-E228 WeakPolarHBondContact CA-OE2 3.5Å; L224-E228 HydrophobicContact CB-CB 4.22Å; L224-E228 HydrophobicContact CD2-CB 4.2Å; L224-R229 HydrophobicContact CB-CB 4.45Å; L224-L232 HydrophobicContact CD1-CD2 3.83Å; L224-V243 HydrophobicContact CD1-CG1 4.02Å; L224-F247 HydrophobicContact CD1-CD1 4.27Å; L224-F247 HydrophobicContact CD1-CD2 3.98Å; L224-F247 HydrophobicContact CD1-CE1 3.8Å; L224-F247 HydrophobicContact CD1-CE2 3.49Å; L224-F247 VanDerWaalsContact CD1-CE2 3.49Å; L224-F247 HydrophobicContact CD1-CG 4.36Å; L224-F247 HydrophobicContact CD1-CZ 3.4Å; L224-F247 HydrophobicContact CD2-CE1 4.08Å; L224-F247 HydrophobicContact CD2-CZ 4.14Å; L224-F247 HydrophobicContact CG-CD1 4.02Å; L224-F247 HydrophobicContact CG-CE1 3.58Å; L224-F247 HydrophobicContact CG-CE2 4.23Å; L224-F247 HydrophobicContact CG-CZ 3.71Å
225	T	98	Very high	97.9	Very high	70 Å²	70	80.5 Å²	80.5	43%	0.429	39%	0.39	S	S	.	.			trans	-68.2	172	165	69.9	0	0	0	0	111.2	E228 R229	T225-E228 PolarHBondContact N-OE2 2.99Å; T225-E228 VanDerWaalsContact OG1-CG 3.29Å; T225-E228 WeakPolarHBondContact OG1-CG 3.35Å; T225-E228 PolarHBondContact OG1-N 3.39Å; T225-E228 PolarHBondContact OG1-OE1 2.85Å; T225-E228 PolarHBondContact OG1-OE2 3.43Å; T225-R229 WeakPolarHBondContact O-CB 3.38Å; T225-R229 PolarHBondContact O-N 3.19Å
226	A	97.7	Very high	97.8	Very high	62 Å²	62	77 Å²	77	51%	0.512	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-45.4	178.3	0	0	0	0	0	111.9	R229 E230	A226-R229 PolarHBondContact O-N 3.42Å; A226-E230 WeakPolarHBondContact O-CG 3.43Å; A226-E230 PolarHBondContact O-N 3.26Å; A226-E230 VanDerWaalsContact O-N 3.07Å
227	S	97.9	Very high	97.8	Very high	87 Å²	87	79.8 Å²	79.8	61%	0.608	39%	0.391	S	S	*	.	H	α-helix	trans	-65.3	-44.8	-179.3	-175.3	0	0	0	0	112.5	R229 E230 H231	S227-R229 VanDerWaalsContact C-N 3.31Å; S227-R229 PolarHBondContact O-N 3.3Å; S227-E230 PolarHBondContact O-N 2.89Å; S227-H231 PolarHBondContact O-N 3.04Å
228	E	98.1	Very high	97.8	Very high	66 Å²	66	79.9 Å²	79.9	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-60.8	-41.6	176.9	-71.7	157.8	-167.8	0	0	111.9	Q221 L224 T225 H231 L232	Q221-E228 PolarHBondContact NE2-OE2 3.4Å; L224-E228 WeakPolarHBondContact CA-OE2 3.5Å; L224-E228 HydrophobicContact CB-CB 4.22Å; L224-E228 HydrophobicContact CD2-CB 4.2Å; T225-E228 PolarHBondContact N-OE2 2.99Å; T225-E228 VanDerWaalsContact OG1-CG 3.29Å; T225-E228 WeakPolarHBondContact OG1-CG 3.35Å; T225-E228 PolarHBondContact OG1-N 3.39Å; T225-E228 PolarHBondContact OG1-OE1 2.85Å; T225-E228 PolarHBondContact OG1-OE2 3.43Å; E228-H231 PolarHBondContact O-N 2.92Å; E228-L232 WeakPolarHBondContact O-CB 3.46Å; E228-L232 PolarHBondContact O-N 3.43Å
229	R	98.4	Very high	97.8	Very high	66 Å²	66	82.8 Å²	82.8	25%	0.249	41%	0.408	C	S	.	.	H	α-helix	trans	-63.3	-42.5	177.2	-176.1	-166.4	-58	154.1	11.8	111.9	L224 T225 A226 S227 H231 A233 P240 V243	L224-R229 HydrophobicContact CB-CB 4.45Å; T225-R229 WeakPolarHBondContact O-CB 3.38Å; T225-R229 PolarHBondContact O-N 3.19Å; A226-R229 PolarHBondContact O-N 3.42Å; S227-R229 VanDerWaalsContact C-N 3.31Å; S227-R229 PolarHBondContact O-N 3.3Å; R229-H231 VanDerWaalsContact C-N 3.34Å; R229-A233 WeakPolarHBondContact O-CB 3.4Å; R229-A233 PolarHBondContact O-N 2.85Å; R229-P240 VanDerWaalsContact CD-O 3.22Å; R229-P240 WeakPolarHBondContact CD-O 3.36Å; R229-P240 HydrophobicContact CG-CB 4.16Å; R229-V243 HydrophobicContact CG-CB 3.98Å; R229-V243 HydrophobicContact CG-CG1 3.91Å
230	E	98.4	Very high	97.9	Very high	110 Å²	110	79.2 Å²	79.2	51%	0.514	39%	0.392	S	S	.	.	H	α-helix	trans	-64.3	-39.8	175.6	-74.3	173.5	-168.8	0	0	111.7	A226 S227 R234 P240	A226-E230 WeakPolarHBondContact O-CG 3.43Å; A226-E230 PolarHBondContact O-N 3.26Å; A226-E230 VanDerWaalsContact O-N 3.07Å; S227-E230 PolarHBondContact O-N 2.89Å; E230-R234 WeakPolarHBondContact O-CG 3.47Å; E230-R234 PolarHBondContact O-N 3.3Å; E230-R234 VanDerWaalsContact O-N 3.1Å; E230-P240 HydrophobicContact CG-CG 4.17Å
231	H	98.3	Very high	97.9	Very high	92 Å²	92	76.4 Å²	76.4	43%	0.426	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-49.5	176.2	-175.8	47.2	0	0	0	112.5	S227 E228 R229 A233 R234 I235	S227-H231 PolarHBondContact O-N 3.04Å; E228-H231 PolarHBondContact O-N 2.92Å; R229-H231 VanDerWaalsContact C-N 3.34Å; H231-A233 VanDerWaalsContact C-N 3.31Å; H231-A233 PolarHBondContact O-N 2.93Å; H231-R234 PolarHBondContact ND1-NH1 3.45Å; H231-R234 PolarHBondContact ND1-NH2 3.39Å; H231-R234 PolarHBondContact O-N 3.36Å; H231-I235 WeakPolarHBondContact O-CG1 3.27Å; H231-I235 PolarHBondContact O-N 3.38Å; H231-I235 VanDerWaalsContact O-N 3.09Å
232	L	98.3	Very high	98	Very high	10 Å²	10	75.9 Å²	75.9	5%	0.052	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-39.2	178.3	-174	59.5	0	0	0	111.8	K213 L214 C217 L224 E228 R234 I235 L236 V243 F247	K213-L232 HydrophobicContact CG-CD1 4.41Å; L214-L232 HydrophobicContact CD2-CD2 4.03Å; C217-L232 HydrophobicContact CB-CD2 4.18Å; L224-L232 HydrophobicContact CD1-CD2 3.83Å; E228-L232 WeakPolarHBondContact O-CB 3.46Å; E228-L232 PolarHBondContact O-N 3.43Å; L232-R234 VanDerWaalsContact C-N 3.34Å; L232-R234 PolarHBondContact O-N 3.38Å; L232-I235 PolarHBondContact O-N 3.12Å; L232-L236 HydrophobicContact CD1-CD1 3.75Å; L232-L236 HydrophobicContact CD1-CG 4.04Å; L232-L236 HydrophobicContact CG-CD1 3.91Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CB 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.27Å; L232-L236 PolarHBondContact O-N 3.05Å; L232-V243 HydrophobicContact CD2-CG1 3.9Å; L232-V243 HydrophobicContact CG-CG1 4.45Å; L232-F247 HydrophobicContact CD2-CE2 3.84Å; L232-F247 HydrophobicContact CD2-CZ 4.21Å
233	A	98.5	Very high	98.1	Very high	3 Å²	3	69.2 Å²	69.2	3%	0.025	36%	0.357	C	S	.	.	H	α-helix	trans	-57.7	-44.7	174.7	0	0	0	0	0	111.9	R229 H231 L236 N237 L238 P240 V243	R229-A233 WeakPolarHBondContact O-CB 3.4Å; R229-A233 PolarHBondContact O-N 2.85Å; H231-A233 VanDerWaalsContact C-N 3.31Å; H231-A233 PolarHBondContact O-N 2.93Å; A233-L236 PolarHBondContact O-N 3.26Å; A233-N237 PolarHBondContact O-N 3.25Å; A233-N237 VanDerWaalsContact O-N 3.08Å; A233-L238 CarbonylContact C-O 3.58Å; A233-L238 WeakPolarHBondContact CB-O 3.46Å; A233-L238 PolarHBondContact O-N 2.72Å; A233-L238 VanDerWaalsContact O-O 3.11Å; A233-P240 HydrophobicContact CB-CG 4.08Å; A233-V243 HydrophobicContact CB-CG2 4.01Å
234	R	98.1	Very high	98.1	Very high	161 Å²	161	67 Å²	67	61%	0.608	35%	0.351	S	S	*	.	H	α-helix	trans	-63.6	-44.3	175.9	-73.3	-178.1	-69.5	105.8	-11.7	112.8	E230 H231 L232 L236 N237	E230-R234 WeakPolarHBondContact O-CG 3.47Å; E230-R234 PolarHBondContact O-N 3.3Å; E230-R234 VanDerWaalsContact O-N 3.1Å; H231-R234 PolarHBondContact ND1-NH1 3.45Å; H231-R234 PolarHBondContact ND1-NH2 3.39Å; H231-R234 PolarHBondContact O-N 3.36Å; L232-R234 VanDerWaalsContact C-N 3.34Å; L232-R234 PolarHBondContact O-N 3.38Å; R234-L236 VanDerWaalsContact C-N 3.29Å; R234-L236 PolarHBondContact O-N 3.35Å; R234-N237 PolarHBondContact O-N 3.49Å; R234-N237 PolarHBondContact O-OD1 2.92Å
235	I	97.5	Very high	98.1	Very high	93 Å²	93	69.7 Å²	69.7	48%	0.477	37%	0.365	S	S	.	.	H	α-helix	trans	-62.6	-39.6	179.6	-64.8	170.6	0	0	0	111	H231 L232	H231-I235 WeakPolarHBondContact O-CG1 3.27Å; H231-I235 PolarHBondContact O-N 3.38Å; H231-I235 VanDerWaalsContact O-N 3.09Å; L232-I235 PolarHBondContact O-N 3.12Å
236	L	97.7	Very high	98.1	Very high	15 Å²	15	67.8 Å²	67.8	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-91.2	-0	-174.2	-60.1	-177	0	0	0	114.4	Q210 K213 L214 L232 A233 R234 L238	Q210-L236 HydrophobicContact CG-CB 4.45Å; Q210-L236 PolarHBondContact NE2-O 3Å; K213-L236 HydrophobicContact CB-CD2 3.7Å; K213-L236 HydrophobicContact CG-CD2 3.78Å; L214-L236 HydrophobicContact CD1-CD1 4.38Å; L214-L236 HydrophobicContact CD2-CD1 3.71Å; L214-L236 HydrophobicContact CG-CD1 3.61Å; L232-L236 HydrophobicContact CD1-CD1 3.75Å; L232-L236 HydrophobicContact CD1-CG 4.04Å; L232-L236 HydrophobicContact CG-CD1 3.91Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CB 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.27Å; L232-L236 PolarHBondContact O-N 3.05Å; A233-L236 PolarHBondContact O-N 3.26Å; R234-L236 VanDerWaalsContact C-N 3.29Å; R234-L236 PolarHBondContact O-N 3.35Å; L236-L238 HydrophobicContact CB-CB 4.48Å; L236-L238 HydrophobicContact CB-CD1 4.02Å; L236-L238 HydrophobicContact CB-CG 3.96Å; L236-L238 HydrophobicContact CD1-CD1 4.31Å; L236-L238 PolarHBondContact O-N 3.32Å
237	N	98	Very high	98.1	Very high	146 Å²	146	65.3 Å²	65.3	78%	0.781	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	45.9	-170.2	-62.3	-23.6	0	0	0	112	A233 R234	A233-N237 PolarHBondContact O-N 3.25Å; A233-N237 VanDerWaalsContact O-N 3.08Å; R234-N237 PolarHBondContact O-N 3.49Å; R234-N237 PolarHBondContact O-OD1 2.92Å
238	L	97.6	Very high	98.1	Very high	22 Å²	22	66 Å²	66	12%	0.115	32%	0.321	C	S	.	.			trans	-116.8	164.8	175.3	-63.9	-179.6	0	0	0	109.9	F206 L214 A233 L236 Q242 V243	F206-L238 HydrophobicContact CD1-CD1 4.12Å; F206-L238 HydrophobicContact CD1-CD2 3.76Å; F206-L238 HydrophobicContact CE1-CD1 3.99Å; F206-L238 HydrophobicContact CE1-CD2 3.64Å; F206-L238 HydrophobicContact CE1-CG 4.47Å; F206-L238 HydrophobicContact CZ-CD1 4.4Å; L214-L238 HydrophobicContact CD1-CD1 4.22Å; A233-L238 CarbonylContact C-O 3.58Å; A233-L238 WeakPolarHBondContact CB-O 3.46Å; A233-L238 PolarHBondContact O-N 2.72Å; A233-L238 VanDerWaalsContact O-O 3.11Å; L236-L238 HydrophobicContact CB-CB 4.48Å; L236-L238 HydrophobicContact CB-CD1 4.02Å; L236-L238 HydrophobicContact CB-CG 3.96Å; L236-L238 HydrophobicContact CD1-CD1 4.31Å; L236-L238 PolarHBondContact O-N 3.32Å; L238-Q242 HydrophobicContact CB-CB 4.38Å; L238-V243 HydrophobicContact CB-CG2 4.24Å; L238-V243 HydrophobicContact CD1-CG2 4.47Å
239	T	98	Very high	98.1	Very high	65 Å²	65	67.5 Å²	67.5	40%	0.399	33%	0.331	S	S	.	.			trans	-80.8	149.6	169.4	61.5	0	0	0	0	110.7	T241 Q242 V243	T239-T241 PolarHBondContact O-N 3.18Å; T239-T241 VanDerWaalsContact O-N 3.12Å; T239-Q242 WeakPolarHBondContact O-CB 3.28Å; T239-Q242 PolarHBondContact O-N 2.89Å; T239-Q242 WeakPolarHBondContact OG1-CB 3.29Å; T239-Q242 VanDerWaalsContact OG1-CG 3.23Å; T239-Q242 WeakPolarHBondContact OG1-CG 3.41Å; T239-Q242 PolarHBondContact OG1-N 3.21Å; T239-Q242 VanDerWaalsContact OG1-N 3.17Å; T239-Q242 PolarHBondContact OG1-OE1 2.95Å; T239-V243 PolarHBondContact O-N 3.5Å
240	P	98.4	Very high	98.1	Very high	53 Å²	53	66.4 Å²	66.4	34%	0.344	33%	0.329	S	S	.	.	H	α-helix	trans	-53.1	-35.7	173.1	-27.2	35	0	0	0	112.2	R229 E230 A233 V243 K244	R229-P240 VanDerWaalsContact CD-O 3.22Å; R229-P240 WeakPolarHBondContact CD-O 3.36Å; R229-P240 HydrophobicContact CG-CB 4.16Å; E230-P240 HydrophobicContact CG-CG 4.17Å; A233-P240 HydrophobicContact CB-CG 4.08Å; P240-V243 PolarHBondContact O-N 3.35Å; P240-K244 WeakPolarHBondContact O-CB 3.43Å; P240-K244 PolarHBondContact O-N 2.83Å
241	T	98	Very high	98.1	Very high	88 Å²	88	64.7 Å²	64.7	54%	0.54	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-41.4	176	-56.7	0	0	0	0	112.9	T239 K244 I245	T239-T241 PolarHBondContact O-N 3.18Å; T239-T241 VanDerWaalsContact O-N 3.12Å; T241-K244 WeakPolarHBondContact O-CB 3.3Å; T241-K244 PolarHBondContact O-N 3.09Å; T241-I245 HydrophobicContact CG2-CD1 3.92Å; T241-I245 HydrophobicContact CG2-CG1 4.46Å; T241-I245 WeakPolarHBondContact O-CG1 3.33Å; T241-I245 PolarHBondContact O-N 3.44Å
242	Q	98	Very high	98	Very high	63 Å²	63	67.4 Å²	67.4	29%	0.294	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-43.9	175.3	-78.6	166.2	-43.5	0	0	111.5	F206 L238 T239 I245 W246	F206-Q242 HydrophobicContact CE1-CB 4.34Å; F206-Q242 HydrophobicContact CE1-CG 4.45Å; F206-Q242 HydrophobicContact CZ-CB 4.07Å; F206-Q242 HydrophobicContact CZ-CG 4.41Å; L238-Q242 HydrophobicContact CB-CB 4.38Å; T239-Q242 WeakPolarHBondContact O-CB 3.28Å; T239-Q242 PolarHBondContact O-N 2.89Å; T239-Q242 WeakPolarHBondContact OG1-CB 3.29Å; T239-Q242 VanDerWaalsContact OG1-CG 3.23Å; T239-Q242 WeakPolarHBondContact OG1-CG 3.41Å; T239-Q242 PolarHBondContact OG1-N 3.21Å; T239-Q242 VanDerWaalsContact OG1-N 3.17Å; T239-Q242 PolarHBondContact OG1-OE1 2.95Å; Q242-I245 PolarHBondContact O-N 3.04Å; Q242-W246 WeakPolarHBondContact O-CB 3.42Å; Q242-W246 PolarHBondContact O-N 3.48Å
243	V	98.5	Very high	97.8	Very high	1 Å²	1	74.5 Å²	74.5	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-61.8	-46.4	175.1	179.1	0	0	0	0	110.5	L214 L224 R229 L232 A233 L238 T239 P240 I245 W246 F247	L214-V243 HydrophobicContact CD2-CG1 4.35Å; L224-V243 HydrophobicContact CD1-CG1 4.02Å; R229-V243 HydrophobicContact CG-CB 3.98Å; R229-V243 HydrophobicContact CG-CG1 3.91Å; L232-V243 HydrophobicContact CD2-CG1 3.9Å; L232-V243 HydrophobicContact CG-CG1 4.45Å; A233-V243 HydrophobicContact CB-CG2 4.01Å; L238-V243 HydrophobicContact CB-CG2 4.24Å; L238-V243 HydrophobicContact CD1-CG2 4.47Å; T239-V243 PolarHBondContact O-N 3.5Å; P240-V243 PolarHBondContact O-N 3.35Å; V243-I245 PolarHBondContact O-N 3.01Å; V243-W246 PolarHBondContact O-N 3.47Å; V243-F247 HydrophobicContact CG1-CD2 3.84Å; V243-F247 HydrophobicContact CG1-CE2 3.93Å; V243-F247 WeakPolarHBondContact O-CD2 3.49Å; V243-F247 PolarHBondContact O-N 3.18Å
244	K	98.2	Very high	97.5	Very high	108 Å²	108	77.7 Å²	77.7	47%	0.47	37%	0.371	S	S	.	.	H	α-helix	trans	-55.6	-49.6	176.4	-179.1	-174	174.9	-175.5	0	112.1	P240 T241 F247 Q248	P240-K244 WeakPolarHBondContact O-CB 3.43Å; P240-K244 PolarHBondContact O-N 2.83Å; T241-K244 WeakPolarHBondContact O-CB 3.3Å; T241-K244 PolarHBondContact O-N 3.09Å; K244-F247 PolarHBondContact O-N 3.13Å; K244-Q248 WeakPolarHBondContact O-CB 3.35Å; K244-Q248 PolarHBondContact O-N 3.26Å
245	I	97.9	Very high	97.3	Very high	82 Å²	82	76.1 Å²	76.1	42%	0.421	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-40.8	-179.9	-69.7	170.9	0	0	0	110.5	T241 Q242 V243 Q248 N249	T241-I245 HydrophobicContact CG2-CD1 3.92Å; T241-I245 HydrophobicContact CG2-CG1 4.46Å; T241-I245 WeakPolarHBondContact O-CG1 3.33Å; T241-I245 PolarHBondContact O-N 3.44Å; Q242-I245 PolarHBondContact O-N 3.04Å; V243-I245 PolarHBondContact O-N 3.01Å; I245-Q248 PolarHBondContact O-N 3.09Å; I245-N249 WeakPolarHBondContact CG2-ND2 3.37Å; I245-N249 WeakPolarHBondContact O-CB 3.35Å; I245-N249 VanDerWaalsContact O-CG 3.24Å; I245-N249 PolarHBondContact O-N 3.49Å; I245-N249 PolarHBondContact O-ND2 3.29Å
246	W	98.5	Very high	96.9	Very high	31 Å²	31	76.8 Å²	76.8	12%	0.117	37%	0.365	C	S	.	.	H	α-helix	trans	-62	-48.6	177.3	-172.6	95.4	0	0	0	111.2	F206 L214 E215 F218 Q242 V243 Q248 N249 H250	F206-W246 AromaticContact CD2-CD1 3.73Å; F206-W246 HydrophobicContact CE2-CB 4.16Å; F206-W246 AromaticContact CE2-CD1 3.55Å; F206-W246 HydrophobicContact CE2-CG 4.15Å; L214-W246 VanDerWaalsContact C-CH2 3.42Å; L214-W246 HydrophobicContact CB-CD2 3.88Å; L214-W246 HydrophobicContact CB-CE3 3.9Å; L214-W246 HydrophobicContact CB-CH2 3.64Å; L214-W246 HydrophobicContact CB-CZ2 3.59Å; L214-W246 HydrophobicContact CB-CZ3 3.79Å; L214-W246 HydrophobicContact CD1-CD2 3.87Å; L214-W246 HydrophobicContact CD1-CG 3.85Å; L214-W246 HydrophobicContact CD2-CD2 4.2Å; L214-W246 HydrophobicContact CD2-CE3 4.07Å; L214-W246 HydrophobicContact CG-CD2 4.2Å; L214-W246 HydrophobicContact CG-CE3 4.38Å; L214-W246 WeakPolarHBondContact O-CH2 3.36Å; L214-W246 WeakPolarHBondContact O-CZ3 3.32Å; E215-W246 HydrophobicContact CG-CH2 3.95Å; E215-W246 HydrophobicContact CG-CZ2 3.79Å; F218-W246 HydrophobicContact CB-CH2 4.01Å; F218-W246 HydrophobicContact CB-CZ3 3.85Å; F218-W246 HydrophobicContact CD2-CZ3 4.04Å; F218-W246 HydrophobicContact CG-CH2 4.42Å; F218-W246 HydrophobicContact CG-CZ3 4.17Å; Q242-W246 WeakPolarHBondContact O-CB 3.42Å; Q242-W246 PolarHBondContact O-N 3.48Å; V243-W246 PolarHBondContact O-N 3.47Å; W246-Q248 VanDerWaalsContact C-N 3.29Å; W246-Q248 PolarHBondContact O-N 3.37Å; W246-N249 PolarHBondContact O-N 3.34Å; W246-H250 HydrophobicContact CE3-CB 4.21Å; W246-H250 HydrophobicContact CH2-CB 4.19Å; W246-H250 AromaticContact CH2-CE1 3.89Å; W246-H250 AromaticContact CH2-CG 3.8Å; W246-H250 AromaticContact CH2-ND1 3.2Å; W246-H250 WeakPolarHBondContact CH2-ND1 3.45Å; W246-H250 AromaticContact CZ2-ND1 3.43Å; W246-H250 WeakPolarHBondContact CZ2-ND1 3.41Å; W246-H250 HydrophobicContact CZ3-CB 3.99Å; W246-H250 AromaticContact CZ3-ND1 3.88Å; W246-H250 VanDerWaalsContact O-CB 3.29Å; W246-H250 WeakPolarHBondContact O-CB 3.29Å; W246-H250 PolarHBondContact O-N 3.09Å
247	F	98.6	Very high	96.2	Very high	9 Å²	9	78.3 Å²	78.3	4%	0.039	38%	0.38	C	S	.	.	H	α-helix	trans	-61.7	-35.1	176.4	-90.2	-104.2	0	0	0	112.5	L214 C217 F218 Q221 L224 L232 V243 K244 R251	L214-F247 HydrophobicContact CD2-CE2 4.08Å; C217-F247 HydrophobicContact CB-CZ 4.45Å; F218-F247 HydrophobicContact CB-CE1 4.22Å; F218-F247 HydrophobicContact CB-CZ 4.33Å; F218-F247 AromaticContact CD2-CD1 3.62Å; F218-F247 HydrophobicContact CD2-CD1 3.62Å; F218-F247 AromaticContact CD2-CE1 3.68Å; F218-F247 HydrophobicContact CD2-CE1 3.68Å; F218-F247 HydrophobicContact CD2-CG 4.35Å; F218-F247 HydrophobicContact CD2-CZ 4.43Å; F218-F247 HydrophobicContact CE2-CD1 4.15Å; F218-F247 HydrophobicContact CG-CE1 4.43Å; Q221-F247 WeakPolarHBondContact O-CE1 3.39Å; L224-F247 HydrophobicContact CD1-CD1 4.27Å; L224-F247 HydrophobicContact CD1-CD2 3.98Å; L224-F247 HydrophobicContact CD1-CE1 3.8Å; L224-F247 HydrophobicContact CD1-CE2 3.49Å; L224-F247 VanDerWaalsContact CD1-CE2 3.49Å; L224-F247 HydrophobicContact CD1-CG 4.36Å; L224-F247 HydrophobicContact CD1-CZ 3.4Å; L224-F247 HydrophobicContact CD2-CE1 4.08Å; L224-F247 HydrophobicContact CD2-CZ 4.14Å; L224-F247 HydrophobicContact CG-CD1 4.02Å; L224-F247 HydrophobicContact CG-CE1 3.58Å; L224-F247 HydrophobicContact CG-CE2 4.23Å; L224-F247 HydrophobicContact CG-CZ 3.71Å; L232-F247 HydrophobicContact CD2-CE2 3.84Å; L232-F247 HydrophobicContact CD2-CZ 4.21Å; V243-F247 HydrophobicContact CG1-CD2 3.84Å; V243-F247 HydrophobicContact CG1-CE2 3.93Å; V243-F247 WeakPolarHBondContact O-CD2 3.49Å; V243-F247 PolarHBondContact O-N 3.18Å; K244-F247 PolarHBondContact O-N 3.13Å; F247-R251 VanDerWaalsContact O-CG 3.32Å; F247-R251 WeakPolarHBondContact O-CG 3.33Å; F247-R251 PolarHBondContact O-N 2.92Å; F247-R251 VanDerWaalsContact O-N 3.08Å; F247-R251 PolarHBondContact O-NE 3.03Å
248	Q	98	Very high	95.3	Very high	103 Å²	103	75.2 Å²	75.2	48%	0.481	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-48.6	174.5	-176.4	175.9	4.2	0	0	111.9	K244 I245 W246 H250 R251 Y252	K244-Q248 WeakPolarHBondContact O-CB 3.35Å; K244-Q248 PolarHBondContact O-N 3.26Å; I245-Q248 PolarHBondContact O-N 3.09Å; W246-Q248 VanDerWaalsContact C-N 3.29Å; W246-Q248 PolarHBondContact O-N 3.37Å; Q248-H250 VanDerWaalsContact C-N 3.31Å; Q248-H250 PolarHBondContact O-N 3.2Å; Q248-R251 PolarHBondContact O-N 3.43Å; Q248-Y252 PolarHBondContact O-N 3.03Å
249	N	98.1	Very high	94.2	Very high	96 Å²	96	77.8 Å²	77.8	51%	0.513	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-39	178.3	-72	-18.8	0	0	0	111.5	I245 W246 Y252 K253	I245-N249 WeakPolarHBondContact CG2-ND2 3.37Å; I245-N249 WeakPolarHBondContact O-CB 3.35Å; I245-N249 VanDerWaalsContact O-CG 3.24Å; I245-N249 PolarHBondContact O-N 3.49Å; I245-N249 PolarHBondContact O-ND2 3.29Å; W246-N249 PolarHBondContact O-N 3.34Å; N249-Y252 PolarHBondContact O-N 2.83Å; N249-K253 WeakPolarHBondContact O-CB 3.48Å; N249-K253 PolarHBondContact O-N 2.83Å
250	H	97.5	Very high	92.6	Very high	43 Å²	43	77.8 Å²	77.8	20%	0.199	38%	0.377	C	S	.	.	H	α-helix	trans	-64.2	-47.4	177.5	-162.2	106	0	0	0	111.1	F218 W246 Q248 Y252 K253 M254	F218-H250 AromaticContact CD1-CD2 3.28Å; F218-H250 WeakPolarHBondContact CD1-CD2 3.34Å; F218-H250 AromaticContact CD1-NE2 3.32Å; F218-H250 VanDerWaalsContact CD1-NE2 3.32Å; F218-H250 WeakPolarHBondContact CD1-NE2 3.13Å; F218-H250 HydrophobicContact CD2-CB 4.21Å; F218-H250 AromaticContact CD2-CD2 3.85Å; F218-H250 AromaticContact CE1-CD2 3.04Å; F218-H250 WeakPolarHBondContact CE1-CD2 3.41Å; F218-H250 AromaticContact CE1-NE2 3.39Å; F218-H250 WeakPolarHBondContact CE1-NE2 3.46Å; F218-H250 HydrophobicContact CE2-CB 4.05Å; F218-H250 AromaticContact CE2-CD2 3.65Å; F218-H250 AromaticContact CG-CD2 3.69Å; F218-H250 AromaticContact CG-NE2 3.98Å; F218-H250 HydrophobicContact CZ-CB 4.42Å; F218-H250 AromaticContact CZ-CD2 3.25Å; F218-H250 WeakPolarHBondContact CZ-CD2 3.21Å; W246-H250 HydrophobicContact CE3-CB 4.21Å; W246-H250 HydrophobicContact CH2-CB 4.19Å; W246-H250 AromaticContact CH2-CE1 3.89Å; W246-H250 AromaticContact CH2-CG 3.8Å; W246-H250 AromaticContact CH2-ND1 3.2Å; W246-H250 WeakPolarHBondContact CH2-ND1 3.45Å; W246-H250 AromaticContact CZ2-ND1 3.43Å; W246-H250 WeakPolarHBondContact CZ2-ND1 3.41Å; W246-H250 HydrophobicContact CZ3-CB 3.99Å; W246-H250 AromaticContact CZ3-ND1 3.88Å; W246-H250 VanDerWaalsContact O-CB 3.29Å; W246-H250 WeakPolarHBondContact O-CB 3.29Å; W246-H250 PolarHBondContact O-N 3.09Å; Q248-H250 VanDerWaalsContact C-N 3.31Å; Q248-H250 PolarHBondContact O-N 3.2Å; H250-Y252 VanDerWaalsContact C-N 3.3Å; H250-Y252 PolarHBondContact O-N 3.13Å; H250-K253 PolarHBondContact O-N 3.07Å; H250-M254 PolarHBondContact O-N 2.82Å
251	R	97.8	Very high	90.7	Very high	75 Å²	75	81.5 Å²	81.5	28%	0.283	39%	0.394	S	S	.	.	H	α-helix	trans	-59	-40.2	172.6	-74.1	-179.5	-68.9	150	-4	112.6	F218 R222 F247 Q248 M254 K255	F218-R251 HydrophobicContact CE2-CG 3.75Å; F218-R251 HydrophobicContact CZ-CG 3.86Å; R222-R251 WeakPolarHBondContact O-CD 3.49Å; F247-R251 VanDerWaalsContact O-CG 3.32Å; F247-R251 WeakPolarHBondContact O-CG 3.33Å; F247-R251 PolarHBondContact O-N 2.92Å; F247-R251 VanDerWaalsContact O-N 3.08Å; F247-R251 PolarHBondContact O-NE 3.03Å; Q248-R251 PolarHBondContact O-N 3.43Å; R251-M254 PolarHBondContact O-N 3.05Å; R251-K255 WeakPolarHBondContact O-CB 3.33Å; R251-K255 PolarHBondContact O-N 3.18Å
252	Y	96.6	Very high	88.6	Confident	149 Å²	149	85.4 Å²	85.4	58%	0.584	41%	0.407	S	S	*	.	H	α-helix	trans	-63.9	-43.1	176.3	-177.7	-103.3	0	0	0	111.8	Q248 N249 H250 K255 R256	Q248-Y252 PolarHBondContact O-N 3.03Å; N249-Y252 PolarHBondContact O-N 2.83Å; H250-Y252 VanDerWaalsContact C-N 3.3Å; H250-Y252 PolarHBondContact O-N 3.13Å; Y252-K255 PolarHBondContact O-N 3.5Å; Y252-R256 HydrophobicContact CD1-CG 4.07Å; Y252-R256 HydrophobicContact CE1-CG 3.76Å; Y252-R256 HydrophobicContact CE2-CG 4.28Å; Y252-R256 HydrophobicContact CG-CG 4.47Å; Y252-R256 WeakPolarHBondContact O-CB 2.81Å; Y252-R256 WeakPolarHBondContact O-CG 3.07Å; Y252-R256 PolarHBondContact O-N 3.29Å
253	K	94.3	Very high	86.3	Confident	159 Å²	159	85.8 Å²	85.8	69%	0.691	41%	0.41	S	S	*	.	H	α-helix	trans	-61.8	-45.8	176	-170.8	-176.8	176.9	-168.8	0	111.4	N249 H250 R256 A257	N249-K253 WeakPolarHBondContact O-CB 3.48Å; N249-K253 PolarHBondContact O-N 2.83Å; H250-K253 PolarHBondContact O-N 3.07Å; K253-R256 PolarHBondContact O-N 3.44Å; K253-A257 PolarHBondContact O-N 3.13Å
254	M	93.2	Very high	83.5	Confident	69 Å²	69	89.1 Å²	89.1	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-46.3	176.1	-171.8	-175.9	73.1	0	0	111.7	F218 H250 R251 R256 A257 T258	F218-M254 HydrophobicContact CE1-SD 4.28Å; H250-M254 PolarHBondContact O-N 2.82Å; R251-M254 PolarHBondContact O-N 3.05Å; M254-R256 VanDerWaalsContact C-N 3.29Å; M254-R256 PolarHBondContact O-N 3.47Å; M254-A257 PolarHBondContact O-N 3.26Å; M254-T258 PolarHBondContact O-N 3.28Å; M254-T258 VanDerWaalsContact O-N 3.09Å
255	K	92.3	Very high	80.9	Confident	128 Å²	128	86.6 Å²	86.6	56%	0.557	43%	0.428	S	S	*	.	H	α-helix	trans	-63.5	-33.2	175.9	-176.8	177.2	179.5	177.3	0	112.8	R251 Y252 T258 Q259	R251-K255 WeakPolarHBondContact O-CB 3.33Å; R251-K255 PolarHBondContact O-N 3.18Å; Y252-K255 PolarHBondContact O-N 3.5Å; K255-T258 PolarHBondContact O-OG1 2.94Å; K255-Q259 VanDerWaalsContact O-CG 3.31Å; K255-Q259 WeakPolarHBondContact O-CG 3.08Å; K255-Q259 PolarHBondContact O-N 3.07Å
256	R	88.8	Confident	78.1	Confident	108 Å²	108	87.3 Å²	87.3	41%	0.408	43%	0.433	S	S	.	.	H	α-helix	trans	-70.3	-38.7	175.7	-71.5	-108	76.1	-166.8	1.6	111.4	Y252 K253 M254 Q259 T260	Y252-R256 HydrophobicContact CD1-CG 4.07Å; Y252-R256 HydrophobicContact CE1-CG 3.76Å; Y252-R256 HydrophobicContact CE2-CG 4.28Å; Y252-R256 HydrophobicContact CG-CG 4.47Å; Y252-R256 WeakPolarHBondContact O-CB 2.81Å; Y252-R256 WeakPolarHBondContact O-CG 3.07Å; Y252-R256 PolarHBondContact O-N 3.29Å; K253-R256 PolarHBondContact O-N 3.44Å; M254-R256 VanDerWaalsContact C-N 3.29Å; M254-R256 PolarHBondContact O-N 3.47Å; R256-Q259 PolarHBondContact O-N 3.06Å; R256-T260 PolarHBondContact O-N 3.13Å; R256-T260 VanDerWaalsContact O-N 3.16Å; R256-T260 PolarHBondContact O-OG1 2.94Å
257	A	84.5	Confident	75.5	Confident	47 Å²	47	89.7 Å²	89.7	39%	0.388	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-46.5	176.9	0	0	0	0	0	111.7	K253 M254 Q259 T260 D261	K253-A257 PolarHBondContact O-N 3.13Å; M254-A257 PolarHBondContact O-N 3.26Å; A257-Q259 VanDerWaalsContact C-N 3.26Å; A257-Q259 PolarHBondContact O-N 3.02Å; A257-T260 WeakPolarHBondContact CA-OG1 3.47Å; A257-T260 PolarHBondContact O-N 2.69Å; A257-T260 PolarHBondContact O-OG1 3.16Å; A257-D261 PolarHBondContact O-N 3Å
258	T	79.5	Confident	73.1	Confident	81 Å²	81	94.6 Å²	94.6	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-30.2	177.9	58.2	0	0	0	0	113.1	M254 K255 E262	M254-T258 PolarHBondContact O-N 3.28Å; M254-T258 VanDerWaalsContact O-N 3.09Å; K255-T258 PolarHBondContact O-OG1 2.94Å; T258-E262 WeakPolarHBondContact O-CG 3.4Å; T258-E262 PolarHBondContact O-N 2.9Å
259	Q	73.8	Confident	70.6	Confident	76 Å²	76	95.3 Å²	95.3	36%	0.355	48%	0.482	S	S	.	.	H	α-helix	trans	-72.6	-27.3	173	-74.5	178.8	5.7	0	0	113.3	K255 R256 A257 I263	K255-Q259 VanDerWaalsContact O-CG 3.31Å; K255-Q259 WeakPolarHBondContact O-CG 3.08Å; K255-Q259 PolarHBondContact O-N 3.07Å; R256-Q259 PolarHBondContact O-N 3.06Å; A257-Q259 VanDerWaalsContact C-N 3.26Å; A257-Q259 PolarHBondContact O-N 3.02Å; Q259-I263 WeakPolarHBondContact O-CB 3.46Å; Q259-I263 WeakPolarHBondContact O-CD1 3.4Å; Q259-I263 WeakPolarHBondContact O-CG1 3.38Å
260	T	64.6	Low	68	Low	65 Å²	65	98.8 Å²	98.8	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-78.5	-27.9	177.6	46.5	0	0	0	0	112.2	R256 A257 I263	R256-T260 PolarHBondContact O-N 3.13Å; R256-T260 VanDerWaalsContact O-N 3.16Å; R256-T260 PolarHBondContact O-OG1 2.94Å; A257-T260 WeakPolarHBondContact CA-OG1 3.47Å; A257-T260 PolarHBondContact O-N 2.69Å; A257-T260 PolarHBondContact O-OG1 3.16Å; T260-I263 PolarHBondContact O-N 3.39Å; T260-I263 VanDerWaalsContact O-O 3.12Å
261	D	57.5	Low	65.3	Low	130 Å²	130	106.8 Å²	106.8	70%	0.695	52%	0.521	S	S	*	.	H	α-helix	trans	-77.1	-33.7	-179.7	-58	-23.5	0	0	0	112.1	A257 I263	A257-D261 PolarHBondContact O-N 3Å; D261-I263 PolarHBondContact O-N 3.29Å
262	E	53.8	Low	62.6	Low	171 Å²	171	107.9 Å²	107.9	80%	0.799	54%	0.541	S	S	*	.	S	Bend	trans	-74.7	-12.2	173.3	-66.9	-70.3	155.7	0	0	113.1	T258	T258-E262 WeakPolarHBondContact O-CG 3.4Å; T258-E262 PolarHBondContact O-N 2.9Å
263	I	50.1	Low	59.7	Low	70 Å²	70	106.9 Å²	106.9	36%	0.359	55%	0.545	S	S	.	.	S	Bend	trans	-106.7	89	-179	-63.6	172	0	0	0	107.3	Q259 T260 D261 T267	Q259-I263 WeakPolarHBondContact O-CB 3.46Å; Q259-I263 WeakPolarHBondContact O-CD1 3.4Å; Q259-I263 WeakPolarHBondContact O-CG1 3.38Å; T260-I263 PolarHBondContact O-N 3.39Å; T260-I263 VanDerWaalsContact O-O 3.12Å; D261-I263 PolarHBondContact O-N 3.29Å; I263-T267 WeakPolarHBondContact CG2-OG1 3.43Å
264	S	39.5	Very low	57.4	Low	72 Å²	72	108.8 Å²	108.8	50%	0.503	55%	0.554	S	S	.	*			trans	-32.1	125.5	161.4	175.6	0	0	0	0	109.2	N266 T267	S264-N266 PolarHBondContact O-N 3.42Å; S264-T267 PolarHBondContact O-N 3.28Å
265	P	43.3	Very low	54.8	Low	55 Å²	55	113 Å²	113	36%	0.357	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	6.8	-164.6	26.7	-38.4	0	0	0	114.8	T267 F365	P265-T267 VanDerWaalsContact C-N 3.33Å; P265-T267 PolarHBondContact O-N 3.26Å; P265-F365 HydrophobicContact CB-CD2 3.73Å; P265-F365 HydrophobicContact CB-CE1 4.25Å; P265-F365 HydrophobicContact CB-CE2 3.2Å; P265-F365 HydrophobicContact CB-CG 4.44Å; P265-F365 HydrophobicContact CB-CZ 3.48Å; P265-F365 VanDerWaalsContact CB-CZ 3.48Å; P265-F365 HydrophobicContact CG-CB 4.39Å; P265-F365 HydrophobicContact CG-CD1 3.86Å; P265-F365 HydrophobicContact CG-CD2 3.2Å; P265-F365 HydrophobicContact CG-CE1 3.85Å; P265-F365 HydrophobicContact CG-CE2 3.22Å; P265-F365 HydrophobicContact CG-CG 3.53Å; P265-F365 HydrophobicContact CG-CZ 3.53Å
266	N	39.2	Very low	52.5	Low	97 Å²	97	114 Å²	114	52%	0.519	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74	-5.4	170.9	-75.4	-28.2	0	0	0	115.7	S264	S264-N266 PolarHBondContact O-N 3.42Å
267	T	45.3	Very low	50.2	Low	80 Å²	80	114.1 Å²	114.1	49%	0.491	60%	0.601	S	S	.	*	S	Bend	trans	-110.9	-9	-179.6	69.4	0	0	0	0	116.2	I263 S264 P265 I269 K270	I263-T267 WeakPolarHBondContact CG2-OG1 3.43Å; S264-T267 PolarHBondContact O-N 3.28Å; P265-T267 VanDerWaalsContact C-N 3.33Å; P265-T267 PolarHBondContact O-N 3.26Å; T267-I269 VanDerWaalsContact C-N 3.26Å; T267-I269 PolarHBondContact O-N 3.15Å; T267-K270 PolarHBondContact O-N 3.09Å
268	L	46.6	Very low	48.1	Very low	113 Å²	113	117.7 Å²	117.7	59%	0.592	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-73.2	-13.7	-177.9	-80	165.6	0	0	0	114.4
269	I	46.6	Very low	46.1	Very low	117 Å²	117	119.6 Å²	119.6	60%	0.6	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-81.5	-16.9	175.2	-61.9	175.2	0	0	0	112.3	T267 R271	T267-I269 VanDerWaalsContact C-N 3.26Å; T267-I269 PolarHBondContact O-N 3.15Å; I269-R271 PolarHBondContact O-N 3.18Å
270	K	42.9	Very low	44.3	Very low	170 Å²	170	123.7 Å²	123.7	74%	0.739	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-81.4	-7.6	-174.1	-74.4	-172.3	177.8	-178.7	0	115.2	T267	T267-K270 PolarHBondContact O-N 3.09Å
271	R	41.3	Very low	42.9	Very low	210 Å²	210	127.5 Å²	127.5	79%	0.792	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-85.8	-9.2	-175.2	-99.4	179.6	163.5	154.9	-3.4	115.7	I269	I269-R271 PolarHBondContact O-N 3.18Å
272	S	40.7	Very low	41.7	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	68%	0.677	S	S	*	*	S	Bend	trans	-96.4	-7.8	177.4	66	0	0	0	0	115
273	N	36.5	Very low	40.6	Very low	128 Å²	128	126.3 Å²	126.3	68%	0.684	68%	0.68	S	S	*	*			trans	-124.7	46.9	-173.8	-64	0.6	0	0	0	112.2	L275	N273-L275 PolarHBondContact O-N 2.76Å
274	K	44.6	Very low	39.8	Very low	200 Å²	200	128.5 Å²	128.5	87%	0.87	70%	0.702	S	S	*	*			trans	-86.2	89.8	165.4	-151.7	165.4	-171.9	-179.3	0	108.2	I276	K274-I276 PolarHBondContact O-N 3.35Å
275	L	39.3	Very low	39.3	Very low	157 Å²	157	130.9 Å²	130.9	82%	0.822	72%	0.718	S	S	*	*			trans	-40.8	122.6	162.6	-68.4	157.4	0	0	0	108.8	N273 P277	N273-L275 PolarHBondContact O-N 2.76Å; L275-P277 VanDerWaalsContact O-CD 3.32Å; L275-P277 WeakPolarHBondContact O-CD 3.45Å
276	I	44.6	Very low	39	Very low	150 Å²	150	132.9 Å²	132.9	77%	0.769	73%	0.733	S	S	*	*			trans	-62.3	119.2	170.3	-61.7	162.7	0	0	0	106.3	K274 V278	K274-I276 PolarHBondContact O-N 3.35Å; I276-V278 PolarHBondContact O-N 3.34Å; I276-V278 VanDerWaalsContact O-N 3.1Å
277	P	39.8	Very low	38.7	Very low	110 Å²	110	138.7 Å²	138.7	71%	0.714	75%	0.748	S	S	*	*			trans	-69.8	107.9	171.3	-10	26.1	0	0	0	108.1	L275 T279	L275-P277 VanDerWaalsContact O-CD 3.32Å; L275-P277 WeakPolarHBondContact O-CD 3.45Å; P277-T279 PolarHBondContact O-N 2.96Å
278	V	39.8	Very low	38.3	Very low	122 Å²	122	139.9 Å²	139.9	74%	0.739	75%	0.751	S	S	*	*			trans	-75.2	91.1	166	-88.9	0	0	0	0	108.5	I276	I276-V278 PolarHBondContact O-N 3.34Å; I276-V278 VanDerWaalsContact O-N 3.1Å
279	T	38.7	Very low	37.6	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	75%	0.753	S	S	*	*			trans	-147.1	128.2	161.5	52.4	0	0	0	0	109.7	P277	P277-T279 PolarHBondContact O-N 2.96Å
280	N	34.8	Very low	37.3	Very low	161 Å²	161	140.4 Å²	140.4	86%	0.861	76%	0.758	S	S	*	*			trans	72.8	63.1	179.1	-68.3	-10.8	0	0	0	117.4	N282	N280-N282 PolarHBondContact O-N 3.4Å
281	L	36.6	Very low	37	Very low	146 Å²	146	141.1 Å²	141.1	76%	0.764	76%	0.758	S	S	*	*			trans	-83.2	85.1	148.7	-79.5	145.1	0	0	0	108.3
282	N	32.3	Very low	36.7	Very low	153 Å²	153	134.3 Å²	134.3	82%	0.818	74%	0.743	S	S	*	*			trans	-145.5	133	157.7	-131.1	4.4	0	0	0	106.5	N280	N280-N282 PolarHBondContact O-N 3.4Å
283	S	30.8	Very low	36.7	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	73%	0.733	S	S	*	*	S	Bend	trans	92	71.8	-174.6	-45.9	0	0	0	0	115.9
284	S	33.2	Very low	36.9	Very low	116 Å²	116	132 Å²	132	81%	0.811	73%	0.725	S	S	*	*			trans	171.4	80.5	133.4	179.1	0	0	0	0	109.2	S286	S284-S286 PolarHBondContact O-N 2.87Å
285	S	27.7	Very low	36.7	Very low	121 Å²	121	128 Å²	128	85%	0.846	71%	0.709	S	S	*	*			trans	-58.5	112.3	172.8	45.9	0	0	0	0	112.7
286	S	37.7	Very low	37.2	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	70%	0.697	S	S	*	*	S	Bend	trans	-173.7	-39.5	147.6	-168.6	0	0	0	0	111.8	S284	S284-S286 PolarHBondContact O-N 2.87Å
287	W	33.8	Very low	37.5	Very low	219 Å²	219	124.8 Å²	124.8	83%	0.83	69%	0.691	S	S	*	*	S	Bend	trans	-91.1	-13.8	-168.1	-65.8	86.5	0	0	0	116.2
288	N	36.4	Very low	38	Very low	105 Å²	105	126.4 Å²	126.4	56%	0.561	68%	0.683	S	S	*	*	S	Bend	trans	-94.9	-9.4	-173.6	-92.5	-7.6	0	0	0	115.7	S292	N288-S292 PolarHBondContact O-N 2.81Å; N288-S292 PolarHBondContact O-OG 3.11Å
289	S	32.3	Very low	38.6	Very low	90 Å²	90	127.2 Å²	127.2	63%	0.629	68%	0.679	S	S	*	*	H	α-helix	trans	-70.6	-36.7	-173.5	-155.3	0	0	0	0	112.3	T293	S289-T293 WeakPolarHBondContact O-CG2 3.35Å; S289-T293 PolarHBondContact O-N 3.49Å; S289-T293 VanDerWaalsContact O-N 3.16Å; S289-T293 PolarHBondContact O-OG1 3.37Å
290	Q	39.8	Very low	39.2	Very low	152 Å²	152	125.7 Å²	125.7	71%	0.71	67%	0.673	S	S	*	*	H	α-helix	trans	-81.9	-25.7	-172.3	-137.2	157.6	1.9	0	0	114.1	T293 N294	Q290-T293 PolarHBondContact O-OG1 3.37Å; Q290-N294 PolarHBondContact O-ND2 3.2Å
291	Y	36.9	Very low	39.9	Very low	184 Å²	184	119.9 Å²	119.9	72%	0.722	64%	0.642	S	S	*	*	H	α-helix	trans	-81	-31.7	172.8	-69.8	-81.7	0	0	0	111.9	H295	Y291-H295 WeakPolarHBondContact O-CB 3.48Å; Y291-H295 PolarHBondContact O-N 2.86Å; Y291-H295 VanDerWaalsContact O-N 3.17Å
292	S	34.5	Very low	41.4	Very low	68 Å²	68	116.7 Å²	116.7	48%	0.476	63%	0.628	S	S	.	*	H	α-helix	trans	-70.8	-43.8	175.3	-71	0	0	0	0	111.9	N288 N294 H295 T296	N288-S292 PolarHBondContact O-N 2.81Å; N288-S292 PolarHBondContact O-OG 3.11Å; S292-N294 VanDerWaalsContact C-N 3.31Å; S292-N294 PolarHBondContact O-N 3.21Å; S292-H295 PolarHBondContact O-N 3.25Å; S292-T296 WeakPolarHBondContact O-CB 3.31Å; S292-T296 PolarHBondContact O-N 3.49Å; S292-T296 PolarHBondContact O-OG1 3.24Å
293	T	41.6	Very low	42.5	Very low	79 Å²	79	115.1 Å²	115.1	49%	0.485	62%	0.616	S	S	.	*	H	α-helix	trans	-62.6	-36.1	-179	50.9	0	0	0	0	113.2	S289 Q290 K297	S289-T293 WeakPolarHBondContact O-CG2 3.35Å; S289-T293 PolarHBondContact O-N 3.49Å; S289-T293 VanDerWaalsContact O-N 3.16Å; S289-T293 PolarHBondContact O-OG1 3.37Å; Q290-T293 PolarHBondContact O-OG1 3.37Å; T293-K297 WeakPolarHBondContact O-CB 3.19Å; T293-K297 PolarHBondContact O-N 3.24Å
294	N	39.7	Very low	44.3	Very low	98 Å²	98	116.6 Å²	116.6	52%	0.524	61%	0.609	S	S	.	*	H	α-helix	trans	-74.5	-37	175.9	-72.3	-33.5	0	0	0	112.7	Q290 S292 W298	Q290-N294 PolarHBondContact O-ND2 3.2Å; S292-N294 VanDerWaalsContact C-N 3.31Å; S292-N294 PolarHBondContact O-N 3.21Å; N294-W298 WeakPolarHBondContact O-CB 3.49Å; N294-W298 PolarHBondContact O-N 2.93Å; N294-W298 VanDerWaalsContact O-N 3.11Å
295	H	41.6	Very low	45.7	Very low	115 Å²	115	115.4 Å²	115.4	53%	0.532	59%	0.591	S	S	.	*	H	α-helix	trans	-71.9	-39.6	177.9	-170.9	-95.6	0	0	0	112.2	Y291 S292 W298 Q299	Y291-H295 WeakPolarHBondContact O-CB 3.48Å; Y291-H295 PolarHBondContact O-N 2.86Å; Y291-H295 VanDerWaalsContact O-N 3.17Å; S292-H295 PolarHBondContact O-N 3.25Å; H295-W298 PolarHBondContact O-N 3.46Å; H295-Q299 PolarHBondContact CE1-NE2 2.98Å; H295-Q299 WeakPolarHBondContact O-CG 3.47Å; H295-Q299 PolarHBondContact O-N 2.99Å
296	T	48.7	Very low	47	Very low	93 Å²	93	113.8 Å²	113.8	57%	0.571	57%	0.566	S	S	*	*	H	α-helix	trans	-68.2	-37.3	177.6	-41.4	0	0	0	0	111.7	S292 Q299 S300	S292-T296 WeakPolarHBondContact O-CB 3.31Å; S292-T296 PolarHBondContact O-N 3.49Å; S292-T296 PolarHBondContact O-OG1 3.24Å; T296-Q299 PolarHBondContact O-N 3.49Å; T296-S300 PolarHBondContact O-N 3.01Å; T296-S300 PolarHBondContact O-OG 2.82Å
297	K	51.8	Low	47.6	Very low	148 Å²	148	112.5 Å²	112.5	64%	0.643	55%	0.552	S	S	*	*	H	α-helix	trans	-68	-36.1	174.5	-170.3	175.4	-178	-179.8	0	112.6	T293 Q299 S300	T293-K297 WeakPolarHBondContact O-CB 3.19Å; T293-K297 PolarHBondContact O-N 3.24Å; K297-Q299 VanDerWaalsContact C-N 3.35Å; K297-S300 WeakPolarHBondContact CA-OG 3.4Å; K297-S300 PolarHBondContact O-OG 3.47Å
298	W	49.3	Very low	48.7	Very low	143 Å²	143	105.8 Å²	105.8	54%	0.542	54%	0.538	S	S	.	.	H	α-helix	trans	-68	-33.5	174.2	-99	100.6	0	0	0	113	N294 H295 R306	N294-W298 WeakPolarHBondContact O-CB 3.49Å; N294-W298 PolarHBondContact O-N 2.93Å; N294-W298 VanDerWaalsContact O-N 3.11Å; H295-W298 PolarHBondContact O-N 3.46Å; W298-R306 HydrophobicContact CE3-CG 4.24Å; W298-R306 HydrophobicContact CZ3-CG 4.07Å
299	Q	52.9	Low	49.4	Very low	140 Å²	140	105.2 Å²	105.2	65%	0.654	54%	0.535	S	S	*	.	H	α-helix	trans	-81.1	-22	177.4	-69.6	-158.6	-8.4	0	0	114.1	H295 T296 K297 L301	H295-Q299 PolarHBondContact CE1-NE2 2.98Å; H295-Q299 WeakPolarHBondContact O-CG 3.47Å; H295-Q299 PolarHBondContact O-N 2.99Å; T296-Q299 PolarHBondContact O-N 3.49Å; K297-Q299 VanDerWaalsContact C-N 3.35Å; Q299-L301 VanDerWaalsContact C-N 3.29Å; Q299-L301 PolarHBondContact O-N 3.48Å
300	S	50.9	Low	50	Low	88 Å²	88	105.7 Å²	105.7	62%	0.615	53%	0.53	S	S	*	.	S	Bend	trans	-77.7	-10	176.6	58.1	0	0	0	0	114.4	T296 K297	T296-S300 PolarHBondContact O-N 3.01Å; T296-S300 PolarHBondContact O-OG 2.82Å; K297-S300 WeakPolarHBondContact CA-OG 3.4Å; K297-S300 PolarHBondContact O-OG 3.47Å
301	L	50.5	Low	50.1	Low	40 Å²	40	104 Å²	104	21%	0.209	53%	0.526	C	S	.	.	S	Bend	trans	-81.3	128.4	178.1	-68.4	161.4	0	0	0	110.8	Q299 E305 R306 L309	Q299-L301 VanDerWaalsContact C-N 3.29Å; Q299-L301 PolarHBondContact O-N 3.48Å; L301-E305 WeakPolarHBondContact CA-OE2 3.39Å; L301-E305 HydrophobicContact CB-CB 4.1Å; L301-E305 HydrophobicContact CD2-CB 3.83Å; L301-E305 HydrophobicContact CD2-CG 4.39Å; L301-R306 HydrophobicContact CB-CG 3.81Å; L301-R306 PolarHBondContact O-NE 2.78Å; L301-R306 VanDerWaalsContact O-NE 3.14Å; L301-L309 HydrophobicContact CD1-CD1 3.75Å; L301-L309 HydrophobicContact CD2-CD1 4.45Å
302	T	67.2	Low	50.1	Low	78 Å²	78	98.6 Å²	98.6	48%	0.479	53%	0.525	S	S	.	.			trans	-54.8	155.1	170.4	62.4	0	0	0	0	110.4	Q304 E305 R306	T302-Q304 PolarHBondContact O-N 2.97Å; T302-E305 WeakPolarHBondContact CB-OE2 3.35Å; T302-E305 WeakPolarHBondContact CG2-OE2 3.32Å; T302-E305 PolarHBondContact N-OE2 2.96Å; T302-E305 PolarHBondContact O-N 3.22Å; T302-E305 WeakPolarHBondContact OG1-CB 3.38Å; T302-E305 VanDerWaalsContact OG1-CD 3.23Å; T302-E305 WeakPolarHBondContact OG1-CG 3.39Å; T302-E305 PolarHBondContact OG1-N 2.9Å; T302-E305 PolarHBondContact OG1-OE2 3.38Å; T302-R306 PolarHBondContact O-N 3.2Å
303	H	55.1	Low	50.3	Low	121 Å²	121	101.9 Å²	101.9	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-58.3	-33.1	179.8	-165.2	11.5	0	0	0	112	N307	H303-N307 WeakPolarHBondContact O-CB 3.32Å; H303-N307 VanDerWaalsContact O-CG 3.28Å; H303-N307 PolarHBondContact O-N 2.94Å; H303-N307 PolarHBondContact O-ND2 3.24Å
304	Q	68.1	Low	49.7	Very low	154 Å²	154	105.7 Å²	105.7	72%	0.72	54%	0.543	S	S	*	.	H	α-helix	trans	-66.8	-43.4	174.7	-168.7	172.8	-4.6	0	0	112	T302 N307 S308	T302-Q304 PolarHBondContact O-N 2.97Å; Q304-N307 PolarHBondContact O-N 3.47Å; Q304-S308 WeakPolarHBondContact O-CB 3.48Å; Q304-S308 PolarHBondContact O-N 3.19Å; Q304-S308 PolarHBondContact O-OG 2.94Å
305	E	63.6	Low	49.2	Very low	90 Å²	90	106.1 Å²	106.1	42%	0.421	55%	0.554	S	S	.	*	H	α-helix	trans	-66	-39	175.2	-72.6	164.1	140.4	0	0	112.4	L301 T302 N307 S308 L309	L301-E305 WeakPolarHBondContact CA-OE2 3.39Å; L301-E305 HydrophobicContact CB-CB 4.1Å; L301-E305 HydrophobicContact CD2-CB 3.83Å; L301-E305 HydrophobicContact CD2-CG 4.39Å; T302-E305 WeakPolarHBondContact CB-OE2 3.35Å; T302-E305 WeakPolarHBondContact CG2-OE2 3.32Å; T302-E305 PolarHBondContact N-OE2 2.96Å; T302-E305 PolarHBondContact O-N 3.22Å; T302-E305 WeakPolarHBondContact OG1-CB 3.38Å; T302-E305 VanDerWaalsContact OG1-CD 3.23Å; T302-E305 WeakPolarHBondContact OG1-CG 3.39Å; T302-E305 PolarHBondContact OG1-N 2.9Å; T302-E305 PolarHBondContact OG1-OE2 3.38Å; E305-N307 VanDerWaalsContact C-N 3.34Å; E305-N307 PolarHBondContact O-N 2.88Å; E305-S308 PolarHBondContact O-N 3.1Å; E305-L309 WeakPolarHBondContact O-CB 3.45Å; E305-L309 VanDerWaalsContact O-CG 3.32Å; E305-L309 WeakPolarHBondContact O-CG 3.04Å; E305-L309 PolarHBondContact O-N 3.19Å
306	R	54.6	Low	48.8	Very low	87 Å²	87	106.7 Å²	106.7	33%	0.328	57%	0.568	S	S	.	*	H	α-helix	trans	-61.4	-42.9	173.1	-76.9	-175.8	-83.4	119.9	-5.7	111.4	W298 L301 T302 L309 L310	W298-R306 HydrophobicContact CE3-CG 4.24Å; W298-R306 HydrophobicContact CZ3-CG 4.07Å; L301-R306 HydrophobicContact CB-CG 3.81Å; L301-R306 PolarHBondContact O-NE 2.78Å; L301-R306 VanDerWaalsContact O-NE 3.14Å; T302-R306 PolarHBondContact O-N 3.2Å; R306-L309 PolarHBondContact O-N 3.29Å; R306-L310 WeakPolarHBondContact O-CB 3.47Å; R306-L310 WeakPolarHBondContact O-CD1 3.16Å; R306-L310 PolarHBondContact O-N 3.11Å; R306-L310 VanDerWaalsContact O-N 3.07Å
307	N	51.4	Low	47.8	Very low	70 Å²	70	109.7 Å²	109.7	37%	0.374	58%	0.58	S	S	.	*	H	α-helix	trans	-71.3	-36.2	177.9	-71.9	-14.8	0	0	0	112.6	H303 Q304 E305 L310 N311	H303-N307 WeakPolarHBondContact O-CB 3.32Å; H303-N307 VanDerWaalsContact O-CG 3.28Å; H303-N307 PolarHBondContact O-N 2.94Å; H303-N307 PolarHBondContact O-ND2 3.24Å; Q304-N307 PolarHBondContact O-N 3.47Å; E305-N307 VanDerWaalsContact C-N 3.34Å; E305-N307 PolarHBondContact O-N 2.88Å; N307-L310 PolarHBondContact O-N 3.4Å; N307-N311 WeakPolarHBondContact O-CB 3.49Å; N307-N311 PolarHBondContact O-N 2.9Å; N307-N311 PolarHBondContact O-ND2 3.4Å; N307-N311 PolarHBondContact O-OD1 3.38Å
308	S	55.8	Low	46.8	Very low	78 Å²	78	111.4 Å²	111.4	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-65.6	-36.9	173.1	-81	0	0	0	0	112.9	Q304 E305 N311 G312	Q304-S308 WeakPolarHBondContact O-CB 3.48Å; Q304-S308 PolarHBondContact O-N 3.19Å; Q304-S308 PolarHBondContact O-OG 2.94Å; E305-S308 PolarHBondContact O-N 3.1Å; S308-N311 PolarHBondContact O-N 2.84Å; S308-G312 PolarHBondContact O-N 3.1Å; S308-G312 VanDerWaalsContact O-N 3.13Å
309	L	50.8	Low	46.1	Very low	94 Å²	94	110.8 Å²	110.8	49%	0.492	60%	0.602	S	S	.	*	H	α-helix	trans	-71	-31.9	174.6	-71.1	171	0	0	0	112.7	L301 E305 R306	L301-L309 HydrophobicContact CD1-CD1 3.75Å; L301-L309 HydrophobicContact CD2-CD1 4.45Å; E305-L309 WeakPolarHBondContact O-CB 3.45Å; E305-L309 VanDerWaalsContact O-CG 3.32Å; E305-L309 WeakPolarHBondContact O-CG 3.04Å; E305-L309 PolarHBondContact O-N 3.19Å; R306-L309 PolarHBondContact O-N 3.29Å
310	L	45.4	Very low	45	Very low	99 Å²	99	112.9 Å²	112.9	52%	0.518	61%	0.609	S	S	.	*	H	α-helix	trans	-72.7	-37.3	173.1	-97.3	138.3	0	0	0	112.4	R306 N307 G312 I313	R306-L310 WeakPolarHBondContact O-CB 3.47Å; R306-L310 WeakPolarHBondContact O-CD1 3.16Å; R306-L310 PolarHBondContact O-N 3.11Å; R306-L310 VanDerWaalsContact O-N 3.07Å; N307-L310 PolarHBondContact O-N 3.4Å; L310-G312 VanDerWaalsContact C-N 3.35Å; L310-I313 PolarHBondContact O-N 3.23Å
311	N	41.8	Very low	43.9	Very low	118 Å²	118	117.4 Å²	117.4	63%	0.631	62%	0.62	S	S	*	*	H	α-helix	trans	-75.7	-20.7	178.7	-68.5	-10.2	0	0	0	113.2	N307 S308 I313	N307-N311 WeakPolarHBondContact O-CB 3.49Å; N307-N311 PolarHBondContact O-N 2.9Å; N307-N311 PolarHBondContact O-ND2 3.4Å; N307-N311 PolarHBondContact O-OD1 3.38Å; S308-N311 PolarHBondContact O-N 2.84Å; N311-I313 VanDerWaalsContact C-N 3.31Å
312	G	36.1	Very low	42.8	Very low	69 Å²	69	120.7 Å²	120.7	71%	0.711	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-10.6	175	0	0	0	0	0	115.1	S308 L310	S308-G312 PolarHBondContact O-N 3.1Å; S308-G312 VanDerWaalsContact O-N 3.13Å; L310-G312 VanDerWaalsContact C-N 3.35Å
313	I	39	Very low	41	Very low	138 Å²	138	121.6 Å²	121.6	71%	0.708	66%	0.656	S	S	*	*	S	Bend	trans	-103.6	-12.6	-177.3	-60.4	173.6	0	0	0	111.4	L310 N311	L310-I313 PolarHBondContact O-N 3.23Å; N311-I313 VanDerWaalsContact C-N 3.31Å
314	Y	30.5	Very low	40	Very low	159 Å²	159	122.4 Å²	122.4	62%	0.624	67%	0.665	S	S	*	*			trans	-128.3	85.6	-178.9	-89.3	-91.2	0	0	0	111
315	S	28.2	Very low	38.3	Very low	107 Å²	107	122.1 Å²	122.1	75%	0.748	66%	0.663	S	S	*	*			trans	-150.4	110.7	161.9	-156.9	0	0	0	0	108.4
316	P	32.9	Very low	36.7	Very low	127 Å²	127	123.6 Å²	123.6	83%	0.825	67%	0.674	S	S	*	*				-144.5	103.4	126.6	28.6	-8.9	0	0	0	112.2
317	D	27.3	Very low	35.6	Very low	156 Å²	156	129 Å²	129	83%	0.834	70%	0.696	S	S	*	*			trans	-87.7	124.2	148.1	-84.7	-38.4	0	0	0	107.4
318	E	32.5	Very low	34.8	Very low	183 Å²	183	133 Å²	133	86%	0.855	71%	0.714	S	S	*	*			trans	170.7	139.1	135.3	-94.5	-179.3	172.7	0	0	112.7
319	V	33.7	Very low	33.5	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	73%	0.725	S	S	*	*			trans	84.8	92.8	163.2	-156.9	0	0	0	0	117.1
320	K	29.4	Very low	32.6	Very low	184 Å²	184	139.7 Å²	139.7	80%	0.8	74%	0.739	S	S	*	*				63.7	129.1	77.5	-79.2	-172.6	179.9	176.4	0	117
321	Q	27.4	Very low	31.8	Very low	183 Å²	183	139.2 Å²	139.2	86%	0.855	74%	0.744	S	S	*	*			trans	89.4	107.5	150	-69.7	170.1	18.7	0	0	120.9
322	S	29	Very low	31.4	Very low	109 Å²	109	142.7 Å²	142.7	76%	0.762	75%	0.753	S	S	*	*				160.8	93.9	119.9	71.7	0	0	0	0	109.9
323	S	28	Very low	31	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	76%	0.757	S	S	*	*				55.4	113.2	96.9	69.5	0	0	0	0	116.5
324	N	33.8	Very low	30.5	Very low	137 Å²	137	146.7 Å²	146.7	73%	0.733	76%	0.76	S	S	*	*				175.5	128	109.9	-85.5	-20.3	0	0	0	115.3
325	H	32	Very low	30.7	Very low	148 Å²	148	145.4 Å²	145.4	69%	0.685	76%	0.764	S	S	*	*			trans	61.5	114.5	144.4	-73.9	-53.5	0	0	0	121.2
326	D	31.1	Very low	30.8	Very low	121 Å²	121	150.6 Å²	150.6	65%	0.647	77%	0.769	S	S	*	*				68.4	139.3	73.8	-69.8	-25.7	0	0	0	112.5
327	Y	31.7	Very low	30.7	Very low	200 Å²	200	153.5 Å²	153.5	78%	0.784	77%	0.768	S	S	*	*			cis	-157.1	154.7	27	-104.8	-85.2	0	0	0	104.7
328	M	35.2	Very low	30.8	Very low	155 Å²	155	153.3 Å²	153.3	76%	0.764	77%	0.767	S	S	*	*				-178.9	133.7	60.3	-126.9	-74.4	173.4	0	0	107.4
329	N	27.9	Very low	30.8	Very low	146 Å²	146	153.3 Å²	153.3	78%	0.781	77%	0.772	S	S	*	*			trans	-129.8	135.9	-179.5	-147	3.1	0	0	0	105.8
330	Q	31.1	Very low	30.7	Very low	166 Å²	166	154.8 Å²	154.8	78%	0.776	77%	0.768	S	S	*	*			trans	170.5	116.5	155.6	-98.6	161	72.8	0	0	109.6
331	S	29.6	Very low	30.6	Very low	89 Å²	89	152.4 Å²	152.4	62%	0.622	76%	0.759	S	S	*	*				121.9	132.3	93.6	-103.2	0	0	0	0	106
332	K	33.2	Very low	31	Very low	192 Å²	192	150.2 Å²	150.2	84%	0.835	76%	0.759	S	S	*	*			cis	-162.5	142.9	22.2	-92.5	146.9	-177.1	-177.4	0	108.9
333	N	27.9	Very low	31	Very low	149 Å²	149	153 Å²	153	80%	0.797	76%	0.757	S	S	*	*			trans	-86.3	171.5	159	-89.3	-32.8	0	0	0	110.3
334	N	29.1	Very low	31.2	Very low	142 Å²	142	155.1 Å²	155.1	76%	0.759	76%	0.756	S	S	*	*			trans	101.5	125.3	169.9	-52.5	-12.3	0	0	0	111.4
335	D	33.5	Very low	31	Very low	131 Å²	131	154.9 Å²	154.9	70%	0.701	76%	0.755	S	S	*	*			cis	-164.5	172.6	42.9	-88.5	-53.4	0	0	0	112.5
336	Y	29.6	Very low	31.1	Very low	217 Å²	217	154.2 Å²	154.2	85%	0.851	76%	0.756	S	S	*	*			trans	103	77.4	159	-65.5	-78.8	0	0	0	119.5
337	K	31.7	Very low	31.1	Very low	187 Å²	187	156.5 Å²	156.5	81%	0.813	76%	0.763	S	S	*	*			trans	-59.1	135.3	134.7	-84.9	175.4	172.3	173.5	0	110.4
338	N	29.6	Very low	31.1	Very low	152 Å²	152	156.2 Å²	156.2	81%	0.813	77%	0.769	S	S	*	*			trans	154.2	106.4	133.1	-84.9	-29.8	0	0	0	110.6
339	L	31.9	Very low	30.7	Very low	183 Å²	183	160.1 Å²	160.1	96%	0.958	78%	0.775	S	S	*	*				-159.7	125.3	123.6	-144.9	62.8	0	0	0	109.8
340	K	31.6	Very low	31	Very low	162 Å²	162	157.5 Å²	157.5	70%	0.704	77%	0.766	S	S	*	*			trans	-107.5	155.8	-172.1	-141.7	-174.5	173.5	-147.2	0	107.2
341	E	28.7	Very low	30.9	Very low	133 Å²	133	157.3 Å²	157.3	62%	0.621	77%	0.771	S	S	*	*			trans	77	113.4	148.2	-78	157.9	-168.1	0	0	120.4
342	T	33.9	Very low	30.9	Very low	138 Å²	138	157.9 Å²	157.9	85%	0.847	77%	0.774	S	S	*	*			trans	-174.9	100.5	135.3	22.7	0	0	0	0	104.3
343	K	30.2	Very low	30.8	Very low	167 Å²	167	156.8 Å²	156.8	73%	0.726	77%	0.772	S	S	*	*				38.8	124.1	71.4	-73.1	-169.9	173.3	-162.5	0	110.6
344	E	32.7	Very low	31	Very low	142 Å²	142	157.5 Å²	157.5	66%	0.664	77%	0.771	S	S	*	*			cis	-177.1	151.6	35.8	-116.2	159.2	-164.7	0	0	109.1
345	N	29.5	Very low	31	Very low	133 Å²	133	157.5 Å²	157.5	71%	0.711	77%	0.77	S	S	*	*			trans	76.8	149.8	140.1	-63	-23.4	0	0	0	125
346	D	32.4	Very low	30.9	Very low	133 Å²	133	156.6 Å²	156.6	71%	0.711	77%	0.769	S	S	*	*			trans	94.9	87.6	163.1	-56.1	-22.3	0	0	0	117.5
347	Q	32	Very low	31.1	Very low	169 Å²	169	153.3 Å²	153.3	79%	0.79	76%	0.762	S	S	*	*				72.4	99.3	86.2	-76.8	-178	0.6	0	0	113.7
348	Q	31.7	Very low	31.1	Very low	194 Å²	194	148.9 Å²	148.9	91%	0.907	75%	0.754	S	S	*	*				165.2	118.5	119.9	-87.2	178.2	-5.1	0	0	112.4
349	R	26.6	Very low	31.4	Very low	237 Å²	237	147 Å²	147	89%	0.894	74%	0.743	S	S	*	*			trans	-70.6	179.7	161.1	-102.5	178.1	161.9	-150	-2	110.3
350	P	34	Very low	31.6	Very low	91 Å²	91	144.9 Å²	144.9	59%	0.591	73%	0.733	S	S	*	*			cis	-133.8	148.6	-35.4	35.2	-18.4	0	0	0	112.2
351	N	30.1	Very low	32	Very low	163 Å²	163	145 Å²	145	87%	0.872	74%	0.741	S	S	*	*			trans	-130	62.5	163.8	-89.8	-18.9	0	0	0	110.9	E353	N351-E353 PolarHBondContact O-N 3.19Å
352	S	28.5	Very low	32.7	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	73%	0.731	S	S	*	*			trans	-83	89.6	157.1	56.3	0	0	0	0	108.1
353	E	31.9	Very low	33.1	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	72%	0.722	S	S	*	*	S	Bend	trans	-175.1	-11.5	162.8	-106.7	157.1	-149.4	0	0	113.7	N351 T356	N351-E353 PolarHBondContact O-N 3.19Å; E353-T356 PolarHBondContact O-OG1 2.88Å
354	H	32.2	Very low	33.9	Very low	164 Å²	164	136.7 Å²	136.7	76%	0.759	72%	0.716	S	S	*	*	S	Bend	trans	-96.5	-12.4	-176.9	-153.8	-90.1	0	0	0	115.1
355	L	28.9	Very low	34.3	Very low	142 Å²	142	133.9 Å²	133.9	74%	0.743	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-3.2	-178.2	-102.6	95.1	0	0	0	114.8
356	T	32	Very low	35.2	Very low	112 Å²	112	133 Å²	133	69%	0.687	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-4.4	-175.7	20.5	0	0	0	0	114.9	E353	E353-T356 PolarHBondContact O-OG1 2.88Å
357	Q	33.3	Very low	36	Very low	148 Å²	148	131.2 Å²	131.2	69%	0.692	68%	0.679	S	S	*	*	S	Bend	trans	-100.4	-14.2	-179.2	-96.6	98.8	14.9	0	0	116.5
358	S	32.2	Very low	37.1	Very low	95 Å²	95	125.2 Å²	125.2	66%	0.664	66%	0.656	S	S	*	*	S	Bend	trans	-98.1	-0.4	-173.9	-90.3	0	0	0	0	116.4	N360	S358-N360 PolarHBondContact O-N 3.36Å
359	I	34.6	Very low	38	Very low	111 Å²	111	123 Å²	123	57%	0.569	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	6.7	-174.1	-64.1	177.1	0	0	0	113.4	K367	I359-K367 PolarHBondContact O-NZ 2.81Å
360	N	36.8	Very low	39.1	Very low	140 Å²	140	115.8 Å²	115.8	75%	0.749	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-3.5	-171.8	-72.6	-25.8	0	0	0	116.5	S358	S358-N360 PolarHBondContact O-N 3.36Å
361	N	40.6	Very low	40.3	Very low	164 Å²	164	119 Å²	119	88%	0.877	62%	0.622	S	S	*	*			trans	-118.2	10.4	-173.2	-83.5	-6.3	0	0	0	117.1
362	T	42.6	Very low	41.5	Very low	66 Å²	66	114.8 Å²	114.8	41%	0.405	60%	0.6	S	S	.	*	S	Bend	trans	-87.4	127.8	169.9	26.2	0	0	0	0	110.5	A364 K367	T362-A364 PolarHBondContact O-N 3.38Å; T362-K367 WeakPolarHBondContact OG1-CE 3.25Å; T362-K367 PolarHBondContact OG1-NZ 3.21Å
363	N	43.4	Very low	42.3	Very low	125 Å²	125	114.4 Å²	114.4	67%	0.668	58%	0.584	S	S	*	*			trans	-56.6	126.5	-174.4	-133.3	-18.7	0	0	0	109.5	F365 E366	N363-F365 PolarHBondContact O-N 3.29Å; N363-E366 PolarHBondContact O-N 2.96Å
364	A	46.3	Very low	43.4	Very low	72 Å²	72	109 Å²	109	60%	0.595	56%	0.561	S	S	*	*	H	α-helix	trans	-55.5	-20.2	-171.9	0	0	0	0	0	113.7	T362 S368	T362-A364 PolarHBondContact O-N 3.38Å; A364-S368 WeakPolarHBondContact O-CB 3.28Å; A364-S368 PolarHBondContact O-N 3.08Å
365	F	41.7	Very low	44.5	Very low	84 Å²	84	106.9 Å²	106.9	37%	0.368	55%	0.55	S	S	.	*	H	α-helix	trans	-65	-48.2	175.5	179.6	-120.3	0	0	0	113.7	P265 N363 S368 W369	P265-F365 HydrophobicContact CB-CD2 3.73Å; P265-F365 HydrophobicContact CB-CE1 4.25Å; P265-F365 HydrophobicContact CB-CE2 3.2Å; P265-F365 HydrophobicContact CB-CG 4.44Å; P265-F365 HydrophobicContact CB-CZ 3.48Å; P265-F365 VanDerWaalsContact CB-CZ 3.48Å; P265-F365 HydrophobicContact CG-CB 4.39Å; P265-F365 HydrophobicContact CG-CD1 3.86Å; P265-F365 HydrophobicContact CG-CD2 3.2Å; P265-F365 HydrophobicContact CG-CE1 3.85Å; P265-F365 HydrophobicContact CG-CE2 3.22Å; P265-F365 HydrophobicContact CG-CG 3.53Å; P265-F365 HydrophobicContact CG-CZ 3.53Å; N363-F365 PolarHBondContact O-N 3.29Å; F365-S368 PolarHBondContact O-N 2.75Å; F365-W369 WeakPolarHBondContact O-CB 3.46Å; F365-W369 PolarHBondContact O-N 3.34Å
366	E	47.9	Very low	45.5	Very low	114 Å²	114	105.2 Å²	105.2	53%	0.533	54%	0.54	S	S	.	.	H	α-helix	trans	-71.3	-42.6	-173.2	-70.2	169.9	165.2	0	0	111.1	N363 S368 W369 I370	N363-E366 PolarHBondContact O-N 2.96Å; E366-S368 VanDerWaalsContact C-N 3.3Å; E366-S368 PolarHBondContact O-N 3.17Å; E366-W369 PolarHBondContact O-N 3.26Å; E366-I370 WeakPolarHBondContact O-CG1 3.32Å; E366-I370 PolarHBondContact O-N 2.9Å
367	K	48.7	Very low	45.9	Very low	95 Å²	95	101.7 Å²	101.7	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-39.6	170.2	-80.5	174.6	162.2	165.5	0	112.4	I359 T362 K371	I359-K367 PolarHBondContact O-NZ 2.81Å; T362-K367 WeakPolarHBondContact OG1-CE 3.25Å; T362-K367 PolarHBondContact OG1-NZ 3.21Å; K367-K371 WeakPolarHBondContact O-CB 3.32Å; K367-K371 PolarHBondContact O-N 3.46Å; K367-K371 VanDerWaalsContact O-N 3.15Å
368	S	54.4	Low	46.3	Very low	44 Å²	44	97.8 Å²	97.8	31%	0.308	51%	0.506	S	S	.	.	H	α-helix	trans	-72.2	-38.1	178.7	-175.3	0	0	0	0	112.4	A364 F365 E366 N372	A364-S368 WeakPolarHBondContact O-CB 3.28Å; A364-S368 PolarHBondContact O-N 3.08Å; F365-S368 PolarHBondContact O-N 2.75Å; E366-S368 VanDerWaalsContact C-N 3.3Å; E366-S368 PolarHBondContact O-N 3.17Å; S368-N372 WeakPolarHBondContact O-CB 3.43Å; S368-N372 PolarHBondContact O-N 2.93Å
369	W	52.3	Low	46.9	Very low	147 Å²	147	100.2 Å²	100.2	56%	0.557	50%	0.504	S	S	*	.	H	α-helix	trans	-65.4	-50.5	178	-176.8	82.6	0	0	0	111.5	F365 E366 K371 N372 W373	F365-W369 WeakPolarHBondContact O-CB 3.46Å; F365-W369 PolarHBondContact O-N 3.34Å; E366-W369 PolarHBondContact O-N 3.26Å; W369-K371 VanDerWaalsContact C-N 3.35Å; W369-K371 PolarHBondContact O-N 2.94Å; W369-N372 PolarHBondContact O-N 3.26Å; W369-W373 VanDerWaalsContact O-CB 3.28Å; W369-W373 WeakPolarHBondContact O-CB 3.29Å; W369-W373 PolarHBondContact O-N 3.38Å
370	I	49.7	Very low	47.1	Very low	85 Å²	85	98.7 Å²	98.7	44%	0.436	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-45.7	176.9	-63.9	173.9	0	0	0	110.3	E366 N372 W373 V374	E366-I370 WeakPolarHBondContact O-CG1 3.32Å; E366-I370 PolarHBondContact O-N 2.9Å; I370-N372 PolarHBondContact O-N 3.31Å; I370-W373 PolarHBondContact O-N 3.46Å; I370-V374 HydrophobicContact CG2-CG2 4.31Å; I370-V374 WeakPolarHBondContact O-CB 3.36Å; I370-V374 VanDerWaalsContact O-CG2 3.29Å; I370-V374 WeakPolarHBondContact O-CG2 3.42Å; I370-V374 PolarHBondContact O-N 2.88Å
371	K	59.5	Low	47.1	Very low	158 Å²	158	101.2 Å²	101.2	69%	0.687	50%	0.504	S	S	*	.	H	α-helix	trans	-60.9	-42.9	178	-173.9	175.6	-176.9	174.2	0	112.6	K367 W369 K375	K367-K371 WeakPolarHBondContact O-CB 3.32Å; K367-K371 PolarHBondContact O-N 3.46Å; K367-K371 VanDerWaalsContact O-N 3.15Å; W369-K371 VanDerWaalsContact C-N 3.35Å; W369-K371 PolarHBondContact O-N 2.94Å; K371-K375 VanDerWaalsContact O-CB 3.27Å; K371-K375 WeakPolarHBondContact O-CB 3.35Å; K371-K375 PolarHBondContact O-N 3.42Å
372	N	53.2	Low	47	Very low	75 Å²	75	97.7 Å²	97.7	40%	0.401	49%	0.488	S	S	.	.	H	α-helix	trans	-71.6	-35.7	177.9	-87.3	-32.6	0	0	0	112.6	S368 W369 I370 K375 M376	S368-N372 WeakPolarHBondContact O-CB 3.43Å; S368-N372 PolarHBondContact O-N 2.93Å; W369-N372 PolarHBondContact O-N 3.26Å; I370-N372 PolarHBondContact O-N 3.31Å; N372-K375 PolarHBondContact O-N 2.81Å; N372-M376 WeakPolarHBondContact O-CB 3.38Å; N372-M376 PolarHBondContact O-N 2.86Å
373	W	47.3	Very low	46.7	Very low	93 Å²	93	101.7 Å²	101.7	35%	0.352	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-47.7	176.3	-176.2	83.4	0	0	0	111.4	W369 I370 K375 M376 I377	W369-W373 VanDerWaalsContact O-CB 3.28Å; W369-W373 WeakPolarHBondContact O-CB 3.29Å; W369-W373 PolarHBondContact O-N 3.38Å; I370-W373 PolarHBondContact O-N 3.46Å; W373-K375 VanDerWaalsContact C-N 3.29Å; W373-K375 PolarHBondContact O-N 3.07Å; W373-M376 WeakPolarHBondContact O-CB 3.25Å; W373-M376 PolarHBondContact O-N 3.1Å; W373-M376 VanDerWaalsContact O-N 3.13Å; W373-I377 HydrophobicContact CD2-CD1 3.63Å; W373-I377 HydrophobicContact CE3-CD1 3.89Å; W373-I377 HydrophobicContact CG-CD1 4.39Å; W373-I377 HydrophobicContact CH2-CD1 3.53Å; W373-I377 HydrophobicContact CZ2-CD1 3.25Å; W373-I377 HydrophobicContact CZ3-CD1 3.84Å; W373-I377 WeakPolarHBondContact O-CG1 3.2Å; W373-I377 PolarHBondContact O-N 2.87Å
374	V	53.9	Low	46.3	Very low	54 Å²	54	103.4 Å²	103.4	33%	0.327	52%	0.516	S	S	.	.	H	α-helix	trans	-58.2	-42	172.6	172.5	0	0	0	0	110.8	I370 M376 I377 S378 L456	I370-V374 HydrophobicContact CG2-CG2 4.31Å; I370-V374 WeakPolarHBondContact O-CB 3.36Å; I370-V374 VanDerWaalsContact O-CG2 3.29Å; I370-V374 WeakPolarHBondContact O-CG2 3.42Å; I370-V374 PolarHBondContact O-N 2.88Å; V374-M376 PolarHBondContact O-N 2.8Å; V374-I377 PolarHBondContact O-N 3.11Å; V374-S378 WeakPolarHBondContact O-CB 2.97Å; V374-S378 PolarHBondContact O-N 2.9Å; V374-S378 PolarHBondContact O-OG 3.36Å; V374-L456 HydrophobicContact CG2-CD1 4.36Å
375	K	55.3	Low	45.7	Very low	121 Å²	121	106.1 Å²	106.1	53%	0.526	53%	0.526	S	S	.	.	H	α-helix	trans	-67.2	-35.6	177.1	-163.2	174.7	-171.8	176.1	0	113	K371 N372 W373 K379	K371-K375 VanDerWaalsContact O-CB 3.27Å; K371-K375 WeakPolarHBondContact O-CB 3.35Å; K371-K375 PolarHBondContact O-N 3.42Å; N372-K375 PolarHBondContact O-N 2.81Å; W373-K375 VanDerWaalsContact C-N 3.29Å; W373-K375 PolarHBondContact O-N 3.07Å; K375-K379 WeakPolarHBondContact O-CB 3.5Å; K375-K379 WeakPolarHBondContact O-CG 3.5Å; K375-K379 PolarHBondContact O-N 3.32Å
376	M	50.5	Low	45.4	Very low	106 Å²	106	107.6 Å²	107.6	52%	0.522	54%	0.544	S	S	.	.	H	α-helix	trans	-67.1	-45.6	176	-173.3	-177.5	72.5	0	0	110.5	N372 W373 V374 K379 S380	N372-M376 WeakPolarHBondContact O-CB 3.38Å; N372-M376 PolarHBondContact O-N 2.86Å; W373-M376 WeakPolarHBondContact O-CB 3.25Å; W373-M376 PolarHBondContact O-N 3.1Å; W373-M376 VanDerWaalsContact O-N 3.13Å; V374-M376 PolarHBondContact O-N 2.8Å; M376-K379 PolarHBondContact O-N 2.87Å; M376-S380 PolarHBondContact O-N 3.2Å; M376-S380 PolarHBondContact O-OG 3.2Å
377	I	39.9	Very low	44.6	Very low	38 Å²	38	108.5 Å²	108.5	20%	0.195	56%	0.557	C	S	.	*	H	α-helix	trans	-66.4	-50.1	177.8	-66.5	177.7	0	0	0	110.4	W373 V374 K379 S380 Y381	W373-I377 HydrophobicContact CD2-CD1 3.63Å; W373-I377 HydrophobicContact CE3-CD1 3.89Å; W373-I377 HydrophobicContact CG-CD1 4.39Å; W373-I377 HydrophobicContact CH2-CD1 3.53Å; W373-I377 HydrophobicContact CZ2-CD1 3.25Å; W373-I377 HydrophobicContact CZ3-CD1 3.84Å; W373-I377 WeakPolarHBondContact O-CG1 3.2Å; W373-I377 PolarHBondContact O-N 2.87Å; V374-I377 PolarHBondContact O-N 3.11Å; I377-K379 VanDerWaalsContact C-N 3.28Å; I377-K379 PolarHBondContact O-N 3.23Å; I377-S380 WeakPolarHBondContact CA-OG 3.35Å; I377-S380 PolarHBondContact O-N 3.36Å; I377-S380 PolarHBondContact O-OG 3.37Å; I377-Y381 HydrophobicContact CG2-CD2 3.75Å; I377-Y381 HydrophobicContact CG2-CE2 3.93Å; I377-Y381 VanDerWaalsContact O-CD2 3.29Å; I377-Y381 WeakPolarHBondContact O-CD2 3.42Å; I377-Y381 PolarHBondContact O-N 3.3Å; I377-Y381 VanDerWaalsContact O-N 3.07Å
378	S	42.8	Very low	43.8	Very low	67 Å²	67	109 Å²	109	47%	0.469	56%	0.564	S	S	.	*	H	α-helix	trans	-55.1	-42.7	175.7	-80.8	0	0	0	0	112.1	V374 S380 Y381 T382	V374-S378 WeakPolarHBondContact O-CB 2.97Å; V374-S378 PolarHBondContact O-N 2.9Å; V374-S378 PolarHBondContact O-OG 3.36Å; S378-S380 PolarHBondContact O-N 2.71Å; S378-Y381 PolarHBondContact O-N 3.4Å; S378-T382 WeakPolarHBondContact O-CG2 3.5Å; S378-T382 PolarHBondContact O-N 2.81Å; S378-T382 VanDerWaalsContact O-N 3.09Å; S378-T382 PolarHBondContact O-OG1 3.3Å; S378-T382 VanDerWaalsContact O-OG1 3.13Å
379	K	44.4	Very low	42.7	Very low	146 Å²	146	114 Å²	114	64%	0.635	59%	0.586	S	S	*	*	H	α-helix	trans	-69.4	-29.1	177.6	-80.3	-173	172.6	-164.9	0	114.3	K375 M376 I377 Y381	K375-K379 WeakPolarHBondContact O-CB 3.5Å; K375-K379 WeakPolarHBondContact O-CG 3.5Å; K375-K379 PolarHBondContact O-N 3.32Å; M376-K379 PolarHBondContact O-N 2.87Å; I377-K379 VanDerWaalsContact C-N 3.28Å; I377-K379 PolarHBondContact O-N 3.23Å; K379-Y381 VanDerWaalsContact C-N 3.32Å
380	S	38.3	Very low	41.8	Very low	79 Å²	79	114.8 Å²	114.8	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-78.2	-18.2	175	48.6	0	0	0	0	113.5	M376 I377 S378	M376-S380 PolarHBondContact O-N 3.2Å; M376-S380 PolarHBondContact O-OG 3.2Å; I377-S380 WeakPolarHBondContact CA-OG 3.35Å; I377-S380 PolarHBondContact O-N 3.36Å; I377-S380 PolarHBondContact O-OG 3.37Å; S378-S380 PolarHBondContact O-N 2.71Å
381	Y	35.6	Very low	41.1	Very low	192 Å²	192	116.4 Å²	116.4	75%	0.753	61%	0.605	S	S	*	*	H	α-helix	trans	-101.5	-4.9	177.5	-79	-83.2	0	0	0	113.6	I377 S378 K379	I377-Y381 HydrophobicContact CG2-CD2 3.75Å; I377-Y381 HydrophobicContact CG2-CE2 3.93Å; I377-Y381 VanDerWaalsContact O-CD2 3.29Å; I377-Y381 WeakPolarHBondContact O-CD2 3.42Å; I377-Y381 PolarHBondContact O-N 3.3Å; I377-Y381 VanDerWaalsContact O-N 3.07Å; S378-Y381 PolarHBondContact O-N 3.4Å; K379-Y381 VanDerWaalsContact C-N 3.32Å
382	T	39.2	Very low	40.2	Very low	90 Å²	90	114.9 Å²	114.9	55%	0.552	61%	0.61	S	S	*	*			trans	-108.1	79.8	171.6	60.8	0	0	0	0	110.1	S378	S378-T382 WeakPolarHBondContact O-CG2 3.5Å; S378-T382 PolarHBondContact O-N 2.81Å; S378-T382 VanDerWaalsContact O-N 3.09Å; S378-T382 PolarHBondContact O-OG1 3.3Å; S378-T382 VanDerWaalsContact O-OG1 3.13Å
383	N	37.3	Very low	39.4	Very low	151 Å²	151	118.9 Å²	118.9	81%	0.807	63%	0.626	S	S	*	*			trans	-165.9	91.7	149.6	-96.3	-6.4	0	0	0	106.6	T385	N383-T385 PolarHBondContact O-N 3.41Å; N383-T385 VanDerWaalsContact O-N 3.1Å
384	D	33.8	Very low	38.9	Very low	160 Å²	160	121.1 Å²	121.1	86%	0.856	64%	0.64	S	S	*	*			trans	-59.1	100.9	165.4	-63.9	-54.1	0	0	0	109.5
385	T	34	Very low	38	Very low	129 Å²	129	124.5 Å²	124.5	79%	0.791	66%	0.655	S	S	*	*			trans	-159.9	123.7	149.5	36.6	0	0	0	0	108.7	N383	N383-T385 PolarHBondContact O-N 3.41Å; N383-T385 VanDerWaalsContact O-N 3.1Å
386	P	34.9	Very low	36.9	Very low	116 Å²	116	126.8 Å²	126.8	75%	0.753	66%	0.662	S	S	*	*			trans	-96.6	149.8	-171.4	41	-36.2	0	0	0	112.2
387	V	31.1	Very low	36.1	Very low	133 Å²	133	128.6 Å²	128.6	81%	0.806	67%	0.667	S	S	*	*			trans	73.2	118.4	155.3	-162.6	0	0	0	0	119.1
388	N	32.7	Very low	36	Very low	105 Å²	105	129.4 Å²	129.4	56%	0.561	68%	0.675	S	S	*	*				-177.9	143.2	97.4	-155.8	-16.8	0	0	0	111.3	Q390	N388-Q390 PolarHBondContact O-N 3Å
389	I	31.3	Very low	35.8	Very low	150 Å²	150	131.5 Å²	131.5	77%	0.769	68%	0.678	S	S	*	*			trans	-89.6	90.7	-163.2	-62.2	162.8	0	0	0	109.9
390	Q	33.5	Very low	35.5	Very low	162 Å²	162	131.2 Å²	131.2	76%	0.757	68%	0.677	S	S	*	*			trans	-149	-1.3	161.3	-123.4	92.5	23.9	0	0	116.3	N388 T392	N388-Q390 PolarHBondContact O-N 3Å; Q390-T392 PolarHBondContact O-N 3.48Å
391	D	34.5	Very low	35.5	Very low	120 Å²	120	132.2 Å²	132.2	64%	0.642	68%	0.675	S	S	*	*			trans	-96.4	102.8	-177.2	-70.5	-26.8	0	0	0	111.9	H393 H394	D391-H393 PolarHBondContact O-N 3.32Å; D391-H394 PolarHBondContact O-N 3.23Å
392	T	40.9	Very low	35.8	Very low	126 Å²	126	131.7 Å²	131.7	77%	0.773	67%	0.672	S	S	*	*	H	α-helix	trans	-48.9	-17.8	165.8	50.3	0	0	0	0	113.4	Q390	Q390-T392 PolarHBondContact O-N 3.48Å
393	H	36.9	Very low	36	Very low	159 Å²	159	131.5 Å²	131.5	74%	0.736	67%	0.668	S	S	*	*	H	α-helix	trans	-74.9	-27.3	173.9	-132.6	-95.2	0	0	0	114.3	D391 K397	D391-H393 PolarHBondContact O-N 3.32Å; H393-K397 PolarHBondContact O-N 2.93Å
394	H	36.9	Very low	36.3	Very low	140 Å²	140	128.3 Å²	128.3	65%	0.648	65%	0.65	S	S	*	*	H	α-helix	trans	-75.5	-32.5	174.6	-155.2	-86.3	0	0	0	111.4	D391 K397 S398	D391-H394 PolarHBondContact O-N 3.23Å; H394-K397 PolarHBondContact O-N 3.05Å; H394-S398 VanDerWaalsContact O-CB 3.31Å; H394-S398 WeakPolarHBondContact O-CB 3.27Å; H394-S398 PolarHBondContact O-N 2.94Å; H394-S398 PolarHBondContact O-OG 3.18Å
395	L	33.4	Very low	36.8	Very low	125 Å²	125	128.5 Å²	128.5	65%	0.654	64%	0.64	S	S	*	*	H	α-helix	trans	-61.1	-47.8	174.1	-98.4	103.4	0	0	0	112	K397 S398 E399	L395-K397 VanDerWaalsContact C-N 3.3Å; L395-K397 PolarHBondContact O-N 2.92Å; L395-S398 WeakPolarHBondContact CA-OG 3.43Å; L395-S398 PolarHBondContact O-N 3.47Å; L395-S398 PolarHBondContact O-OG 3.41Å; L395-E399 WeakPolarHBondContact O-CB 3.46Å; L395-E399 PolarHBondContact O-N 3.18Å
396	Y	33.1	Very low	37.3	Very low	169 Å²	169	125.6 Å²	125.6	66%	0.663	62%	0.62	S	S	*	*	H	α-helix	trans	-65.6	-33.5	179.6	-163.7	-102.9	0	0	0	112.8	K400	Y396-K400 PolarHBondContact O-N 2.77Å
397	K	34	Very low	38	Very low	144 Å²	144	124.4 Å²	124.4	63%	0.626	61%	0.606	S	S	*	*	H	α-helix	trans	-71.2	-39.1	175.1	-154.5	174.1	-176.6	-176.4	0	111.4	H393 H394 L395 L401	H393-K397 PolarHBondContact O-N 2.93Å; H394-K397 PolarHBondContact O-N 3.05Å; L395-K397 VanDerWaalsContact C-N 3.3Å; L395-K397 PolarHBondContact O-N 2.92Å; K397-L401 WeakPolarHBondContact O-CD1 3.39Å; K397-L401 PolarHBondContact O-N 3.32Å; K397-L401 VanDerWaalsContact O-N 3.11Å
398	S	36.5	Very low	38.5	Very low	54 Å²	54	120 Å²	120	38%	0.378	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-36.7	175.6	77.5	0	0	0	0	112.6	H394 L395 L401 R402	H394-S398 VanDerWaalsContact O-CB 3.31Å; H394-S398 WeakPolarHBondContact O-CB 3.27Å; H394-S398 PolarHBondContact O-N 2.94Å; H394-S398 PolarHBondContact O-OG 3.18Å; L395-S398 WeakPolarHBondContact CA-OG 3.43Å; L395-S398 PolarHBondContact O-N 3.47Å; L395-S398 PolarHBondContact O-OG 3.41Å; S398-L401 PolarHBondContact O-N 3.3Å; S398-R402 VanDerWaalsContact O-CB 3.27Å; S398-R402 WeakPolarHBondContact O-CB 3.31Å; S398-R402 PolarHBondContact O-N 3.42Å
399	E	39	Very low	39.3	Very low	112 Å²	112	117.3 Å²	117.3	52%	0.523	57%	0.569	S	S	.	*	H	α-helix	trans	-68.3	-39	178.3	-167.3	175.6	-168.2	0	0	111.4	L395 R402 N403	L395-E399 WeakPolarHBondContact O-CB 3.46Å; L395-E399 PolarHBondContact O-N 3.18Å; E399-R402 PolarHBondContact O-N 3.39Å; E399-N403 WeakPolarHBondContact O-CB 3.43Å; E399-N403 PolarHBondContact O-N 2.9Å; E399-N403 PolarHBondContact O-ND2 3.39Å
400	K	39.2	Very low	40.4	Very low	140 Å²	140	117.3 Å²	117.3	61%	0.609	56%	0.563	S	S	*	*	H	α-helix	trans	-68.8	-37.4	175.1	-158.3	171.3	-174.4	176.3	0	112.4	Y396 N404	Y396-K400 PolarHBondContact O-N 2.77Å; K400-N404 VanDerWaalsContact O-CG 3.31Å; K400-N404 PolarHBondContact O-N 2.77Å; K400-N404 VanDerWaalsContact O-N 3.11Å; K400-N404 PolarHBondContact O-ND2 2.95Å
401	L	36.7	Very low	40.9	Very low	99 Å²	99	114.8 Å²	114.8	52%	0.518	55%	0.554	S	S	.	*	H	α-helix	trans	-66.3	-42.2	172.4	-84.4	156.5	0	0	0	111.7	K397 S398 N404 Y405	K397-L401 WeakPolarHBondContact O-CD1 3.39Å; K397-L401 PolarHBondContact O-N 3.32Å; K397-L401 VanDerWaalsContact O-N 3.11Å; S398-L401 PolarHBondContact O-N 3.3Å; L401-N404 PolarHBondContact O-N 3.19Å; L401-Y405 WeakPolarHBondContact O-CB 3.37Å; L401-Y405 PolarHBondContact O-N 3.06Å
402	R	42.3	Very low	41.5	Very low	182 Å²	182	113.6 Å²	113.6	69%	0.687	55%	0.546	S	S	*	.	H	α-helix	trans	-63.9	-43.9	176.9	-166.4	170	-173.6	-177.4	2.2	111.8	S398 E399 N404 Y405 D406	S398-R402 VanDerWaalsContact O-CB 3.27Å; S398-R402 WeakPolarHBondContact O-CB 3.31Å; S398-R402 PolarHBondContact O-N 3.42Å; E399-R402 PolarHBondContact O-N 3.39Å; R402-N404 VanDerWaalsContact C-N 3.32Å; R402-N404 PolarHBondContact O-N 3.04Å; R402-Y405 WeakPolarHBondContact O-CB 3.34Å; R402-Y405 PolarHBondContact O-N 3.18Å; R402-D406 WeakPolarHBondContact O-CB 3.45Å; R402-D406 PolarHBondContact O-N 3.28Å
403	N	44.6	Very low	42	Very low	86 Å²	86	111.5 Å²	111.5	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-60	-41.3	172.9	-78.2	-29.8	0	0	0	112.3	E399 D406 I407	E399-N403 WeakPolarHBondContact O-CB 3.43Å; E399-N403 PolarHBondContact O-N 2.9Å; E399-N403 PolarHBondContact O-ND2 3.39Å; N403-D406 PolarHBondContact O-N 3.42Å; N403-I407 WeakPolarHBondContact O-CB 3.2Å; N403-I407 WeakPolarHBondContact O-CD1 3.29Å; N403-I407 WeakPolarHBondContact O-CG1 3.39Å; N403-I407 PolarHBondContact O-N 3.04Å
404	N	42.6	Very low	42.7	Very low	83 Å²	83	109.6 Å²	109.6	44%	0.444	52%	0.521	S	S	.	.	H	α-helix	trans	-67.7	-38.2	176.1	-74.1	-21.2	0	0	0	112.3	K400 L401 R402 S408	K400-N404 VanDerWaalsContact O-CG 3.31Å; K400-N404 PolarHBondContact O-N 2.77Å; K400-N404 VanDerWaalsContact O-N 3.11Å; K400-N404 PolarHBondContact O-ND2 2.95Å; L401-N404 PolarHBondContact O-N 3.19Å; R402-N404 VanDerWaalsContact C-N 3.32Å; R402-N404 PolarHBondContact O-N 3.04Å; N404-S408 WeakPolarHBondContact O-CB 3.38Å; N404-S408 PolarHBondContact O-N 3.47Å; N404-S408 PolarHBondContact O-OG 2.9Å
405	Y	43.8	Very low	43.2	Very low	164 Å²	164	108.5 Å²	108.5	64%	0.643	51%	0.514	S	S	*	.	H	α-helix	trans	-63.4	-45.4	173.8	-178.9	-90.4	0	0	0	111.4	L401 R402 I407 S408 T409	L401-Y405 WeakPolarHBondContact O-CB 3.37Å; L401-Y405 PolarHBondContact O-N 3.06Å; R402-Y405 WeakPolarHBondContact O-CB 3.34Å; R402-Y405 PolarHBondContact O-N 3.18Å; Y405-I407 PolarHBondContact O-N 3.04Å; Y405-S408 PolarHBondContact O-N 2.84Å; Y405-T409 WeakPolarHBondContact O-CB 3.33Å; Y405-T409 PolarHBondContact O-N 2.9Å; Y405-T409 PolarHBondContact O-OG1 3.14Å
406	D	46.3	Very low	44	Very low	69 Å²	69	106.4 Å²	106.4	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-41.5	178	-73.2	-11.6	0	0	0	111.7	R402 N403 T409 K410	R402-D406 WeakPolarHBondContact O-CB 3.45Å; R402-D406 PolarHBondContact O-N 3.28Å; N403-D406 PolarHBondContact O-N 3.42Å; D406-T409 PolarHBondContact O-N 3.41Å; D406-K410 VanDerWaalsContact O-CG 3.32Å; D406-K410 WeakPolarHBondContact O-CG 3.41Å; D406-K410 PolarHBondContact O-N 3.01Å
407	I	47.6	Very low	45	Very low	91 Å²	91	102.8 Å²	102.8	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-63.5	-45.5	174.4	-68.7	164.1	0	0	0	110.4	N403 Y405 T409 K410 I411	N403-I407 WeakPolarHBondContact O-CB 3.2Å; N403-I407 WeakPolarHBondContact O-CD1 3.29Å; N403-I407 WeakPolarHBondContact O-CG1 3.39Å; N403-I407 PolarHBondContact O-N 3.04Å; Y405-I407 PolarHBondContact O-N 3.04Å; I407-T409 VanDerWaalsContact C-N 3.33Å; I407-T409 PolarHBondContact O-N 2.91Å; I407-K410 PolarHBondContact O-N 3.39Å; I407-I411 HydrophobicContact CG2-CD1 3.89Å; I407-I411 WeakPolarHBondContact O-CG1 3.42Å; I407-I411 PolarHBondContact O-N 3.39Å
408	S	43.2	Very low	45.7	Very low	40 Å²	40	102.4 Å²	102.4	28%	0.28	49%	0.489	S	S	.	.	H	α-helix	trans	-63.7	-40.5	179.8	-55.6	0	0	0	0	111.5	N404 Y405 I411 M412	N404-S408 WeakPolarHBondContact O-CB 3.38Å; N404-S408 PolarHBondContact O-N 3.47Å; N404-S408 PolarHBondContact O-OG 2.9Å; Y405-S408 PolarHBondContact O-N 2.84Å; S408-I411 PolarHBondContact O-N 3.42Å; S408-M412 WeakPolarHBondContact O-CG 3.44Å; S408-M412 PolarHBondContact O-N 3.35Å
409	T	48.6	Very low	46	Very low	48 Å²	48	101.7 Å²	101.7	29%	0.294	48%	0.484	S	S	.	.	H	α-helix	trans	-62.9	-41.9	175.7	-56	0	0	0	0	111.1	Y405 D406 I407 M412 N413	Y405-T409 WeakPolarHBondContact O-CB 3.33Å; Y405-T409 PolarHBondContact O-N 2.9Å; Y405-T409 PolarHBondContact O-OG1 3.14Å; D406-T409 PolarHBondContact O-N 3.41Å; I407-T409 VanDerWaalsContact C-N 3.33Å; I407-T409 PolarHBondContact O-N 2.91Å; T409-M412 PolarHBondContact O-N 3.18Å; T409-N413 WeakPolarHBondContact O-CB 3.44Å; T409-N413 VanDerWaalsContact O-CG 3.23Å; T409-N413 PolarHBondContact O-N 3.31Å; T409-N413 PolarHBondContact O-ND2 2.87Å
410	K	53.7	Low	46.3	Very low	150 Å²	150	100.3 Å²	100.3	65%	0.652	48%	0.48	S	S	*	.	H	α-helix	trans	-63.4	-40.8	174.9	-74.6	172.6	-178.3	178	0	112.7	D406 I407 H414	D406-K410 VanDerWaalsContact O-CG 3.32Å; D406-K410 WeakPolarHBondContact O-CG 3.41Å; D406-K410 PolarHBondContact O-N 3.01Å; I407-K410 PolarHBondContact O-N 3.39Å; K410-H414 WeakPolarHBondContact O-CB 3.16Å; K410-H414 PolarHBondContact O-N 3.07Å
411	I	45.7	Very low	46.9	Very low	109 Å²	109	98.9 Å²	98.9	56%	0.559	48%	0.476	S	S	*	.	H	α-helix	trans	-65.1	-45.7	176.7	-67	166.7	0	0	0	110.3	I407 S408 H414 F415	I407-I411 HydrophobicContact CG2-CD1 3.89Å; I407-I411 WeakPolarHBondContact O-CG1 3.42Å; I407-I411 PolarHBondContact O-N 3.39Å; S408-I411 PolarHBondContact O-N 3.42Å; I411-H414 PolarHBondContact O-N 3.38Å; I411-F415 PolarHBondContact O-N 3.1Å
412	M	46.8	Very low	47.1	Very low	96 Å²	96	99 Å²	99	47%	0.473	47%	0.474	S	S	.	.	H	α-helix	trans	-61.6	-44.9	176.8	-75.1	-114.1	-76.2	0	0	111.9	S408 T409 H414 F415 I416 L455	S408-M412 WeakPolarHBondContact O-CG 3.44Å; S408-M412 PolarHBondContact O-N 3.35Å; T409-M412 PolarHBondContact O-N 3.18Å; M412-H414 PolarHBondContact O-N 2.87Å; M412-F415 WeakPolarHBondContact O-CB 3.4Å; M412-F415 PolarHBondContact O-N 3.23Å; M412-I416 VanDerWaalsContact O-CG1 3.3Å; M412-I416 WeakPolarHBondContact O-CG1 3.45Å; M412-I416 PolarHBondContact O-N 3.42Å; M412-L455 HydrophobicContact CE-CD2 3.96Å
413	N	51.1	Low	46.9	Very low	81 Å²	81	93.5 Å²	93.5	43%	0.433	46%	0.46	S	S	.	.	H	α-helix	trans	-62.1	-44.1	176.5	-71.8	-18.3	0	0	0	111.6	T409 F415 I416 D417	T409-N413 WeakPolarHBondContact O-CB 3.44Å; T409-N413 VanDerWaalsContact O-CG 3.23Å; T409-N413 PolarHBondContact O-N 3.31Å; T409-N413 PolarHBondContact O-ND2 2.87Å; N413-F415 VanDerWaalsContact C-N 3.27Å; N413-F415 PolarHBondContact O-N 2.94Å; N413-I416 PolarHBondContact O-N 3.32Å; N413-D417 WeakPolarHBondContact O-CB 3.45Å; N413-D417 PolarHBondContact O-N 3.11Å
414	H	52.4	Low	46.9	Very low	119 Å²	119	95.5 Å²	95.5	55%	0.551	47%	0.471	S	S	*	.	H	α-helix	trans	-60.9	-36.8	174.9	179.7	-76.5	0	0	0	112.3	K410 I411 M412 R418	K410-H414 WeakPolarHBondContact O-CB 3.16Å; K410-H414 PolarHBondContact O-N 3.07Å; I411-H414 PolarHBondContact O-N 3.38Å; M412-H414 PolarHBondContact O-N 2.87Å; H414-R418 WeakPolarHBondContact O-CB 3.34Å; H414-R418 PolarHBondContact O-N 2.94Å
415	F	46.1	Very low	47	Very low	118 Å²	118	99 Å²	99	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-67.8	-44.3	175.8	-157.3	-92.6	0	0	0	111.3	I411 M412 N413 D417 R418 C419	I411-F415 PolarHBondContact O-N 3.1Å; M412-F415 WeakPolarHBondContact O-CB 3.4Å; M412-F415 PolarHBondContact O-N 3.23Å; N413-F415 VanDerWaalsContact C-N 3.27Å; N413-F415 PolarHBondContact O-N 2.94Å; F415-D417 PolarHBondContact O-N 3.39Å; F415-R418 PolarHBondContact O-N 3.45Å; F415-C419 PolarHBondContact O-N 3.19Å; F415-C419 PolarHBondContact O-SG 3.39Å
416	I	50.8	Low	46.7	Very low	81 Å²	81	93.3 Å²	93.3	42%	0.415	47%	0.469	S	S	.	.	H	α-helix	trans	-59.3	-46.3	174.3	-69.5	165.2	0	0	0	110.8	M412 N413 R418 C419 N420	M412-I416 VanDerWaalsContact O-CG1 3.3Å; M412-I416 WeakPolarHBondContact O-CG1 3.45Å; M412-I416 PolarHBondContact O-N 3.42Å; N413-I416 PolarHBondContact O-N 3.32Å; I416-R418 VanDerWaalsContact C-N 3.34Å; I416-R418 PolarHBondContact O-N 3.41Å; I416-C419 PolarHBondContact O-N 3.09Å; I416-N420 WeakPolarHBondContact CG2-ND2 3.42Å; I416-N420 WeakPolarHBondContact O-CB 3.41Å; I416-N420 PolarHBondContact O-N 2.74Å; I416-N420 PolarHBondContact O-ND2 3.04Å; I416-N420 VanDerWaalsContact O-ND2 3.09Å
417	D	54.3	Low	46.2	Very low	92 Å²	92	98.3 Å²	98.3	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-43	178.9	-68.9	-23.7	0	0	0	111.1	N413 F415 N420 E421	N413-D417 WeakPolarHBondContact O-CB 3.45Å; N413-D417 PolarHBondContact O-N 3.11Å; F415-D417 PolarHBondContact O-N 3.39Å; D417-N420 WeakPolarHBondContact O-CB 3.47Å; D417-N420 PolarHBondContact O-N 3.37Å; D417-E421 WeakPolarHBondContact O-CG 3.43Å; D417-E421 PolarHBondContact O-N 3.37Å
418	R	47.5	Very low	45.9	Very low	136 Å²	136	100.1 Å²	100.1	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-42.2	177.5	-165.1	170.3	179.3	100.8	-1.8	112.6	H414 F415 I416 N420 E421 E422	H414-R418 WeakPolarHBondContact O-CB 3.34Å; H414-R418 PolarHBondContact O-N 2.94Å; F415-R418 PolarHBondContact O-N 3.45Å; I416-R418 VanDerWaalsContact C-N 3.34Å; I416-R418 PolarHBondContact O-N 3.41Å; R418-N420 VanDerWaalsContact C-N 3.3Å; R418-N420 PolarHBondContact O-N 3.33Å; R418-E421 PolarHBondContact O-N 3.44Å; R418-E422 IonicContact NE-OE1 3.78Å; R418-E422 WeakPolarHBondContact O-CG 3.5Å; R418-E422 PolarHBondContact O-N 3.09Å
419	C	43.1	Very low	45.9	Very low	40 Å²	40	104 Å²	104	27%	0.27	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-38	172	-66.9	0	0	0	0	111.6	F415 I416 V423	F415-C419 PolarHBondContact O-N 3.19Å; F415-C419 PolarHBondContact O-SG 3.39Å; I416-C419 PolarHBondContact O-N 3.09Å; C419-V423 WeakPolarHBondContact O-CB 3.46Å; C419-V423 WeakPolarHBondContact O-CG2 3.42Å; C419-V423 PolarHBondContact O-N 2.83Å
420	N	46.8	Very low	45.6	Very low	82 Å²	82	107.1 Å²	107.1	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-67.2	-39.6	175.5	-72.7	-35.8	0	0	0	111.8	I416 D417 R418 N424	I416-N420 WeakPolarHBondContact CG2-ND2 3.42Å; I416-N420 WeakPolarHBondContact O-CB 3.41Å; I416-N420 PolarHBondContact O-N 2.74Å; I416-N420 PolarHBondContact O-ND2 3.04Å; I416-N420 VanDerWaalsContact O-ND2 3.09Å; D417-N420 WeakPolarHBondContact O-CB 3.47Å; D417-N420 PolarHBondContact O-N 3.37Å; R418-N420 VanDerWaalsContact C-N 3.3Å; R418-N420 PolarHBondContact O-N 3.33Å; N420-N424 VanDerWaalsContact O-CB 3.32Å; N420-N424 WeakPolarHBondContact O-CB 3.22Å; N420-N424 PolarHBondContact O-N 3.5Å; N420-N424 PolarHBondContact O-ND2 2.94Å
421	E	51.3	Low	45.1	Very low	111 Å²	111	105.5 Å²	105.5	52%	0.519	55%	0.553	S	S	.	*	H	α-helix	trans	-64	-45.4	175.2	-76.7	176.9	-177.9	0	0	111.8	D417 R418 V423 N424 Q425	D417-E421 WeakPolarHBondContact O-CG 3.43Å; D417-E421 PolarHBondContact O-N 3.37Å; R418-E421 PolarHBondContact O-N 3.44Å; E421-V423 PolarHBondContact O-N 2.99Å; E421-N424 CarbonylContact O-C 3.47Å; E421-N424 PolarHBondContact O-N 3.29Å; E421-N424 VanDerWaalsContact O-N 3.11Å; E421-Q425 WeakPolarHBondContact O-CG 3.32Å; E421-Q425 PolarHBondContact O-N 3.49Å
422	E	40	Very low	45.2	Very low	102 Å²	102	104.7 Å²	104.7	48%	0.477	55%	0.55	S	S	.	*	H	α-helix	trans	-64.7	-40.2	178.2	-73.4	173.6	-174.4	0	0	111.6	R418 N424 Q425 S426	R418-E422 IonicContact NE-OE1 3.78Å; R418-E422 WeakPolarHBondContact O-CG 3.5Å; R418-E422 PolarHBondContact O-N 3.09Å; E422-N424 VanDerWaalsContact C-N 3.27Å; E422-N424 PolarHBondContact O-N 3.41Å; E422-Q425 PolarHBondContact O-N 2.78Å; E422-S426 PolarHBondContact O-N 3.16Å; E422-S426 PolarHBondContact O-OG 3.33Å
423	V	38.7	Very low	45	Very low	66 Å²	66	104.2 Å²	104.2	40%	0.4	55%	0.545	S	S	.	.	H	α-helix	trans	-65.4	-29.9	173	170.5	0	0	0	0	112.2	C419 E421 K433	C419-V423 WeakPolarHBondContact O-CB 3.46Å; C419-V423 WeakPolarHBondContact O-CG2 3.42Å; C419-V423 PolarHBondContact O-N 2.83Å; E421-V423 PolarHBondContact O-N 2.99Å; V423-K433 HydrophobicContact CG1-CG 4.32Å; V423-K433 WeakPolarHBondContact O-CE 3.48Å; V423-K433 PolarHBondContact O-NZ 3.35Å
424	N	45.1	Very low	44.7	Very low	128 Å²	128	110.5 Å²	110.5	68%	0.684	56%	0.563	S	S	*	*	H	α-helix	trans	-84	-17.3	178.7	-72.8	-32.4	0	0	0	113.7	N420 E421 E422	N420-N424 VanDerWaalsContact O-CB 3.32Å; N420-N424 WeakPolarHBondContact O-CB 3.22Å; N420-N424 PolarHBondContact O-N 3.5Å; N420-N424 PolarHBondContact O-ND2 2.94Å; E421-N424 CarbonylContact O-C 3.47Å; E421-N424 PolarHBondContact O-N 3.29Å; E421-N424 VanDerWaalsContact O-N 3.11Å; E422-N424 VanDerWaalsContact C-N 3.27Å; E422-N424 PolarHBondContact O-N 3.41Å
425	Q	43.2	Very low	44.4	Very low	155 Å²	155	112.3 Å²	112.3	72%	0.724	57%	0.566	S	S	*	*	H	α-helix	trans	-99.4	-15.8	-179.1	-76.6	165.7	3.2	0	0	114.3	E421 E422	E421-Q425 WeakPolarHBondContact O-CG 3.32Å; E421-Q425 PolarHBondContact O-N 3.49Å; E422-Q425 PolarHBondContact O-N 2.78Å
426	S	37.7	Very low	44.4	Very low	46 Å²	46	110.5 Å²	110.5	32%	0.322	56%	0.558	S	S	.	*			trans	-92.2	116.3	176.2	59.2	0	0	0	0	112.4	E422 I428	E422-S426 PolarHBondContact O-N 3.16Å; E422-S426 PolarHBondContact O-OG 3.33Å; S426-I428 PolarHBondContact O-N 3.31Å
427	D	37.3	Very low	44.3	Very low	174 Å²	174	110 Å²	110	93%	0.93	56%	0.559	S	S	*	*			trans	-65.7	46.5	168.6	-99.1	-26.2	0	0	0	112.8
428	I	41	Very low	44.1	Very low	128 Å²	128	111.3 Å²	111.3	66%	0.656	56%	0.562	S	S	*	*			trans	-103.9	132	-178.3	-58.3	173.9	0	0	0	110.2	S426	S426-I428 PolarHBondContact O-N 3.31Å
429	T	41.7	Very low	43.9	Very low	123 Å²	123	109.1 Å²	109.1	76%	0.755	56%	0.558	S	S	*	*			trans	-80.8	128.5	-154.3	43.8	0	0	0	0	115.4	V431	T429-V431 PolarHBondContact O-N 2.87Å
430	S	42.8	Very low	43.9	Very low	112 Å²	112	113.6 Å²	113.6	78%	0.783	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn		70.8	-8.6	126.2	-160.2	0	0	0	0	125.3
431	V	43.5	Very low	43.8	Very low	117 Å²	117	116.1 Å²	116.1	71%	0.709	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	-34.9	172.9	-178.4	0	0	0	0	113.4	T429	T429-V431 PolarHBondContact O-N 2.87Å
432	D	48.1	Very low	43.3	Very low	91 Å²	91	114.1 Å²	114.1	49%	0.487	58%	0.578	S	S	.	*	H	α-helix	trans	-77.9	-29.4	-172.2	-154.2	36.5	0	0	0	113.5	R434 K436	D432-R434 VanDerWaalsContact C-N 3.35Å; D432-R434 PolarHBondContact O-N 3.21Å; D432-K436 WeakPolarHBondContact O-CB 3.13Å; D432-K436 PolarHBondContact O-N 3.22Å; D432-K436 VanDerWaalsContact O-N 3.12Å; D432-K436 WeakPolarHBondContact OD2-CE 3.35Å; D432-K436 IonicContact OD2-NZ 2.72Å; D432-K436 PolarHBondContact OD2-NZ 3.17Å
433	K	43.5	Very low	43.2	Very low	86 Å²	86	113.3 Å²	113.3	37%	0.374	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-34.1	175.2	-90.8	178.2	174.3	172.1	0	113.1	V423 T437	V423-K433 HydrophobicContact CG1-CG 4.32Å; V423-K433 WeakPolarHBondContact O-CE 3.48Å; V423-K433 PolarHBondContact O-NZ 3.35Å; K433-T437 VanDerWaalsContact O-CB 3.24Å; K433-T437 WeakPolarHBondContact O-CB 3.46Å; K433-T437 PolarHBondContact O-N 3.11Å; K433-T437 PolarHBondContact O-OG1 3.07Å
434	R	43.7	Very low	43.3	Very low	213 Å²	213	119.5 Å²	119.5	80%	0.804	60%	0.595	S	S	*	*	H	α-helix	trans	-75.3	-39.9	-177.5	-131.5	176.3	-170.3	170.7	2.4	111.5	D432 E438	D432-R434 VanDerWaalsContact C-N 3.35Å; D432-R434 PolarHBondContact O-N 3.21Å; R434-E438 WeakPolarHBondContact O-CB 3.46Å; R434-E438 VanDerWaalsContact O-CG 3.31Å; R434-E438 WeakPolarHBondContact O-CG 3.49Å; R434-E438 PolarHBondContact O-N 3.34Å
435	Y	46	Very low	42.9	Very low	158 Å²	158	121.6 Å²	121.6	62%	0.62	60%	0.602	S	S	*	*	H	α-helix	trans	-66.1	-44.3	175.7	-169.6	-99	0	0	0	111.9	Q439	Y435-Q439 HydrophobicContact CE1-CG 4.31Å; Y435-Q439 VanDerWaalsContact O-CG 3.3Å; Y435-Q439 WeakPolarHBondContact O-CG 3.5Å; Y435-Q439 PolarHBondContact O-N 3.44Å; Y435-Q439 VanDerWaalsContact O-N 3.16Å
436	K	46.3	Very low	42.6	Very low	79 Å²	79	117.4 Å²	117.4	34%	0.343	59%	0.59	S	S	.	*	H	α-helix	trans	-66.5	-41.6	177	-75.3	172.1	175.3	162.2	0	112.5	D432 F440	D432-K436 WeakPolarHBondContact O-CB 3.13Å; D432-K436 PolarHBondContact O-N 3.22Å; D432-K436 VanDerWaalsContact O-N 3.12Å; D432-K436 WeakPolarHBondContact OD2-CE 3.35Å; D432-K436 IonicContact OD2-NZ 2.72Å; D432-K436 PolarHBondContact OD2-NZ 3.17Å; K436-F440 WeakPolarHBondContact O-CB 3.32Å; K436-F440 WeakPolarHBondContact O-CD2 3.49Å; K436-F440 PolarHBondContact O-N 2.88Å; K436-F440 VanDerWaalsContact O-N 3.11Å
437	T	48.9	Very low	42.4	Very low	70 Å²	70	123.4 Å²	123.4	43%	0.429	62%	0.619	S	S	.	*	H	α-helix	trans	-71.3	-37.1	-179.1	-51.4	0	0	0	0	112.8	K433 K441	K433-T437 VanDerWaalsContact O-CB 3.24Å; K433-T437 WeakPolarHBondContact O-CB 3.46Å; K433-T437 PolarHBondContact O-N 3.11Å; K433-T437 PolarHBondContact O-OG1 3.07Å; T437-K441 HydrophobicContact CG2-CD 4.29Å; T437-K441 WeakPolarHBondContact O-CB 3.47Å; T437-K441 WeakPolarHBondContact O-CG 3.36Å; T437-K441 PolarHBondContact O-N 3.13Å
438	E	49.8	Very low	42.5	Very low	120 Å²	120	121.2 Å²	121.2	56%	0.561	61%	0.607	S	S	*	*	H	α-helix	trans	-70.8	-39.2	177.7	-76.1	-68.6	134.9	0	0	112.2	R434 K441 S442	R434-E438 WeakPolarHBondContact O-CB 3.46Å; R434-E438 VanDerWaalsContact O-CG 3.31Å; R434-E438 WeakPolarHBondContact O-CG 3.49Å; R434-E438 PolarHBondContact O-N 3.34Å; E438-K441 PolarHBondContact O-N 3.48Å; E438-S442 PolarHBondContact O-N 3.41Å
439	Q	44.4	Very low	42.4	Very low	91 Å²	91	122 Å²	122	43%	0.425	62%	0.618	S	S	.	*	H	α-helix	trans	-67.2	-37.8	174.8	-68.2	-68.6	13.7	0	0	112.1	Y435 S442 F443	Y435-Q439 HydrophobicContact CE1-CG 4.31Å; Y435-Q439 VanDerWaalsContact O-CG 3.3Å; Y435-Q439 WeakPolarHBondContact O-CG 3.5Å; Y435-Q439 PolarHBondContact O-N 3.44Å; Y435-Q439 VanDerWaalsContact O-N 3.16Å; Q439-S442 PolarHBondContact O-OG 3.4Å; Q439-F443 WeakPolarHBondContact O-CD2 3.46Å; Q439-F443 PolarHBondContact O-N 3.5Å
440	F	42.4	Very low	42.5	Very low	134 Å²	134	119.7 Å²	119.7	59%	0.588	60%	0.6	S	S	*	*	H	α-helix	trans	-73.9	-28.7	175.5	-91.8	-85.1	0	0	0	113.5	K436	K436-F440 WeakPolarHBondContact O-CB 3.32Å; K436-F440 WeakPolarHBondContact O-CD2 3.49Å; K436-F440 PolarHBondContact O-N 2.88Å; K436-F440 VanDerWaalsContact O-N 3.11Å
441	K	44	Very low	42.7	Very low	134 Å²	134	117.2 Å²	117.2	58%	0.583	58%	0.583	S	S	*	*	H	α-helix	trans	-73.2	-36.6	174.5	-84.3	-179.8	178.4	177.9	0	112.8	T437 E438 F443 K444	T437-K441 HydrophobicContact CG2-CD 4.29Å; T437-K441 WeakPolarHBondContact O-CB 3.47Å; T437-K441 WeakPolarHBondContact O-CG 3.36Å; T437-K441 PolarHBondContact O-N 3.13Å; E438-K441 PolarHBondContact O-N 3.48Å; K441-F443 PolarHBondContact O-N 3.37Å; K441-K444 PolarHBondContact O-N 3.42Å
442	S	42.1	Very low	42.6	Very low	69 Å²	69	114.9 Å²	114.9	48%	0.483	57%	0.572	S	S	.	*	H	α-helix	trans	-64.9	-27.9	174.6	75.2	0	0	0	0	112.2	E438 Q439 K444	E438-S442 PolarHBondContact O-N 3.41Å; Q439-S442 PolarHBondContact O-OG 3.4Å; S442-K444 VanDerWaalsContact C-N 3.31Å; S442-K444 PolarHBondContact O-N 3.43Å
443	F	36.5	Very low	42.5	Very low	86 Å²	86	117.9 Å²	117.9	38%	0.377	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-18.2	176.6	-105.1	-87	0	0	0	115.1	Q439 K441 M445 I450 I458	Q439-F443 WeakPolarHBondContact O-CD2 3.46Å; Q439-F443 PolarHBondContact O-N 3.5Å; K441-F443 PolarHBondContact O-N 3.37Å; F443-M445 PolarHBondContact O-N 3.49Å; F443-I450 HydrophobicContact CD1-CD1 3.81Å; F443-I450 HydrophobicContact CE1-CD1 3.58Å; F443-I450 HydrophobicContact CE1-CG1 4.22Å; F443-I458 HydrophobicContact CE1-CD1 3.74Å; F443-I458 HydrophobicContact CE2-CD1 4.2Å; F443-I458 HydrophobicContact CZ-CD1 3.34Å; F443-I458 HydrophobicContact CZ-CG1 4.19Å
444	K	41.3	Very low	42.7	Very low	195 Å²	195	120 Å²	120	85%	0.848	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-4.6	-179.5	-151.4	174.1	-176.4	177.4	0	113.3	K441 S442	K441-K444 PolarHBondContact O-N 3.42Å; S442-K444 VanDerWaalsContact C-N 3.31Å; S442-K444 PolarHBondContact O-N 3.43Å
445	M	36	Very low	42.8	Very low	172 Å²	172	112.8 Å²	112.8	85%	0.847	57%	0.569	S	S	*	*	S	Bend	trans	-110.9	-6.6	-172.7	-75.9	-168.3	65.5	0	0	115.9	F443	F443-M445 PolarHBondContact O-N 3.49Å
446	S	37.9	Very low	43	Very low	67 Å²	67	109.2 Å²	109.2	47%	0.469	56%	0.56	S	S	.	*			trans	-107.4	108.5	176.5	60.5	0	0	0	0	111.3	D448	S446-D448 PolarHBondContact O-N 3.17Å
447	N	33.8	Very low	43.3	Very low	172 Å²	172	111.9 Å²	111.9	92%	0.92	57%	0.574	S	S	*	*			trans	-66.5	17.6	176.7	-91.4	-21.3	0	0	0	115
448	D	38.2	Very low	43.1	Very low	128 Å²	128	111.3 Å²	111.3	68%	0.684	57%	0.568	S	S	*	*	S	Bend	trans	-96.3	123.3	-175.2	-67.8	-25.5	0	0	0	110.5	S446 I450	S446-D448 PolarHBondContact O-N 3.17Å; D448-I450 PolarHBondContact O-N 2.98Å
449	T	39.8	Very low	42.9	Very low	144 Å²	144	108 Å²	108	88%	0.883	56%	0.557	S	S	*	*			trans	-42.8	105.7	172.8	34.3	0	0	0	0	111.4	S451	T449-S451 PolarHBondContact O-N 3.12Å
450	I	44.5	Very low	42.8	Very low	75 Å²	75	108.5 Å²	108.5	39%	0.385	56%	0.559	S	S	.	*			trans	-63.7	119.2	174.9	-67.2	169.1	0	0	0	108	F443 D448 K454 L455	F443-I450 HydrophobicContact CD1-CD1 3.81Å; F443-I450 HydrophobicContact CE1-CD1 3.58Å; F443-I450 HydrophobicContact CE1-CG1 4.22Å; D448-I450 PolarHBondContact O-N 2.98Å; I450-K454 HydrophobicContact CG2-CB 4.22Å; I450-L455 HydrophobicContact CB-CD1 4.48Å; I450-L455 HydrophobicContact CG2-CB 3.92Å; I450-L455 HydrophobicContact CG2-CD1 3.83Å; I450-L455 HydrophobicContact CG2-CG 3.98Å
451	S	46.5	Very low	42.5	Very low	61 Å²	61	105.3 Å²	105.3	43%	0.427	55%	0.552	S	S	.	*			trans	-64.9	146.7	173.3	84.2	0	0	0	0	110.2	T449 Q453 K454 L455	T449-S451 PolarHBondContact O-N 3.12Å; S451-Q453 PolarHBondContact O-N 2.92Å; S451-Q453 VanDerWaalsContact O-N 3.12Å; S451-K454 PolarHBondContact O-N 3.08Å; S451-K454 PolarHBondContact OG-N 2.99Å; S451-L455 PolarHBondContact O-N 3.26Å
452	S	40.6	Very low	42.1	Very low	67 Å²	67	102.2 Å²	102.2	47%	0.469	54%	0.544	S	S	.	.	H	α-helix	trans	-54.5	-31.5	177.7	51	0	0	0	0	113.2	L456	S452-L456 PolarHBondContact O-N 3.32Å
453	Q	45.6	Very low	41.9	Very low	154 Å²	154	104.2 Å²	104.2	72%	0.72	55%	0.549	S	S	*	.	H	α-helix	trans	-65.9	-42.6	173.5	-104.7	166.2	-41	0	0	112.7	S451 L455 L456 Q457	S451-Q453 PolarHBondContact O-N 2.92Å; S451-Q453 VanDerWaalsContact O-N 3.12Å; Q453-L455 VanDerWaalsContact C-N 3.34Å; Q453-L456 PolarHBondContact O-N 3.18Å; Q453-Q457 WeakPolarHBondContact O-CB 3.48Å; Q453-Q457 PolarHBondContact O-N 3.45Å
454	K	48.1	Very low	41.8	Very low	130 Å²	130	105.5 Å²	105.5	57%	0.565	56%	0.556	S	S	*	*	H	α-helix	trans	-70.6	-35.8	-179.6	-143.1	162.5	-173.2	177.7	0	110.7	I450 S451 Q457 I458	I450-K454 HydrophobicContact CG2-CB 4.22Å; S451-K454 PolarHBondContact O-N 3.08Å; S451-K454 PolarHBondContact OG-N 2.99Å; K454-Q457 PolarHBondContact O-N 3.49Å; K454-I458 WeakPolarHBondContact O-CD1 3.33Å; K454-I458 WeakPolarHBondContact O-CG1 3.33Å; K454-I458 PolarHBondContact O-N 3.45Å
455	L	46.2	Very low	41.6	Very low	62 Å²	62	101.3 Å²	101.3	33%	0.325	54%	0.542	S	S	.	.	H	α-helix	trans	-63.1	-42.9	173	-134.4	149.7	0	0	0	112	M412 I450 S451 Q453 Q457 I458 C459	M412-L455 HydrophobicContact CE-CD2 3.96Å; I450-L455 HydrophobicContact CB-CD1 4.48Å; I450-L455 HydrophobicContact CG2-CB 3.92Å; I450-L455 HydrophobicContact CG2-CD1 3.83Å; I450-L455 HydrophobicContact CG2-CG 3.98Å; S451-L455 PolarHBondContact O-N 3.26Å; Q453-L455 VanDerWaalsContact C-N 3.34Å; L455-Q457 VanDerWaalsContact C-N 3.34Å; L455-Q457 PolarHBondContact O-N 3.49Å; L455-I458 PolarHBondContact O-N 3.24Å; L455-C459 PolarHBondContact O-N 3.46Å; L455-C459 PolarHBondContact O-SG 3.39Å
456	L	49.2	Very low	41.4	Very low	84 Å²	84	99.9 Å²	99.9	44%	0.44	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-40.6	172.9	-111.2	138.7	0	0	0	112.6	V374 S452 Q453 I458 C459 Q460	V374-L456 HydrophobicContact CG2-CD1 4.36Å; S452-L456 PolarHBondContact O-N 3.32Å; Q453-L456 PolarHBondContact O-N 3.18Å; L456-I458 VanDerWaalsContact C-N 3.32Å; L456-C459 PolarHBondContact O-N 3.48Å; L456-Q460 PolarHBondContact O-N 2.86Å; L456-Q460 VanDerWaalsContact O-N 3.15Å
457	Q	53.2	Low	41.2	Very low	135 Å²	135	106 Å²	106	63%	0.631	56%	0.559	S	S	*	*	H	α-helix	trans	-68.8	-31.8	179.1	-149.8	167.1	11.8	0	0	112.3	Q453 K454 L455	Q453-Q457 WeakPolarHBondContact O-CB 3.48Å; Q453-Q457 PolarHBondContact O-N 3.45Å; K454-Q457 PolarHBondContact O-N 3.49Å; L455-Q457 VanDerWaalsContact C-N 3.34Å; L455-Q457 PolarHBondContact O-N 3.49Å
458	I	44.1	Very low	41.5	Very low	58 Å²	58	102.8 Å²	102.8	30%	0.297	54%	0.541	S	S	.	.	H	α-helix	trans	-75.5	-38.4	175.9	-66.9	157.9	0	0	0	111.4	F443 K454 L455 L456 Q460 P461	F443-I458 HydrophobicContact CE1-CD1 3.74Å; F443-I458 HydrophobicContact CE2-CD1 4.2Å; F443-I458 HydrophobicContact CZ-CD1 3.34Å; F443-I458 HydrophobicContact CZ-CG1 4.19Å; K454-I458 WeakPolarHBondContact O-CD1 3.33Å; K454-I458 WeakPolarHBondContact O-CG1 3.33Å; K454-I458 PolarHBondContact O-N 3.45Å; L455-I458 PolarHBondContact O-N 3.24Å; L456-I458 VanDerWaalsContact C-N 3.32Å; I458-Q460 PolarHBondContact O-N 2.88Å; I458-P461 WeakPolarHBondContact O-CD 3.23Å
459	C	45.6	Very low	41.7	Very low	49 Å²	49	101.4 Å²	101.4	33%	0.331	53%	0.534	S	S	.	.	H	α-helix	trans	-74.6	-15.3	177.4	-66.5	0	0	0	0	112.9	L455 L456 V462 L463	L455-C459 PolarHBondContact O-N 3.46Å; L455-C459 PolarHBondContact O-SG 3.39Å; L456-C459 PolarHBondContact O-N 3.48Å; C459-V462 PolarHBondContact O-N 3.35Å; C459-L463 HydrophobicContact CB-CD1 4.12Å; C459-L463 WeakPolarHBondContact O-CB 3.47Å; C459-L463 VanDerWaalsContact O-CG 3.29Å; C459-L463 WeakPolarHBondContact O-CG 3.45Å; C459-L463 PolarHBondContact O-N 3.41Å
460	Q	43.7	Very low	41.8	Very low	102 Å²	102	99.1 Å²	99.1	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-59.3	-45.5	-173.1	-142.9	161.5	-43.3	0	0	113.8	L456 I458 L463 E464	L456-Q460 PolarHBondContact O-N 2.86Å; L456-Q460 VanDerWaalsContact O-N 3.15Å; I458-Q460 PolarHBondContact O-N 2.88Å; Q460-L463 PolarHBondContact O-N 2.83Å; Q460-E464 WeakPolarHBondContact O-CG 3.32Å; Q460-E464 PolarHBondContact O-N 3.31Å
461	P	35.1	Very low	41.7	Very low	67 Å²	67	100.5 Å²	100.5	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-73.8	-26.6	176.9	-16.8	32.6	0	0	0	113.5	I458 E464 I465	I458-P461 WeakPolarHBondContact O-CD 3.23Å; P461-E464 PolarHBondContact O-N 2.97Å; P461-I465 VanDerWaalsContact O-CG1 3.32Å; P461-I465 WeakPolarHBondContact O-CG1 3.38Å; P461-I465 PolarHBondContact O-N 2.98Å
462	V	36.5	Very low	41.4	Very low	69 Å²	69	102.9 Å²	102.9	42%	0.418	53%	0.528	S	S	.	.	H	α-helix	trans	-75.7	-30.4	177.4	-179.8	0	0	0	0	110.8	C459 E464	C459-V462 PolarHBondContact O-N 3.35Å; V462-E464 VanDerWaalsContact C-N 3.31Å
463	L	37.5	Very low	41.4	Very low	112 Å²	112	105.3 Å²	105.3	59%	0.586	53%	0.532	S	S	*	.	H	α-helix	trans	-75.4	-18.9	169.8	-70.3	164.7	0	0	0	113	C459 Q460	C459-L463 HydrophobicContact CB-CD1 4.12Å; C459-L463 WeakPolarHBondContact O-CB 3.47Å; C459-L463 VanDerWaalsContact O-CG 3.29Å; C459-L463 WeakPolarHBondContact O-CG 3.45Å; C459-L463 PolarHBondContact O-N 3.41Å; Q460-L463 PolarHBondContact O-N 2.83Å
464	E	35.2	Very low	41.1	Very low	113 Å²	113	101.9 Å²	101.9	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-86.9	-14.5	175.6	-78.2	171.6	177.5	0	0	113.2	Q460 P461 V462	Q460-E464 WeakPolarHBondContact O-CG 3.32Å; Q460-E464 PolarHBondContact O-N 3.31Å; P461-E464 PolarHBondContact O-N 2.97Å; V462-E464 VanDerWaalsContact C-N 3.31Å
465	I	35.9	Very low	40.6	Very low	107 Å²	107	99.7 Å²	99.7	55%	0.549	52%	0.515	S	S	.	.	S	Bend	trans	-90	-15.6	177.4	-68.3	167.4	0	0	0	112	P461	P461-I465 VanDerWaalsContact O-CG1 3.32Å; P461-I465 WeakPolarHBondContact O-CG1 3.38Å; P461-I465 PolarHBondContact O-N 2.98Å
466	D	32.7	Very low	40.1	Very low	142 Å²	142	102.8 Å²	102.8	76%	0.759	53%	0.531	S	S	*	.			trans	-107.6	21.8	178.8	-145.8	18.3	0	0	0	112.3
467	Q	32.8	Very low	39.3	Very low	196 Å²	196	104.5 Å²	104.5	92%	0.916	54%	0.539	S	S	*	.			trans	-102.9	0	162.5	-84.6	-174.7	1.7	0	0	109.4

Retrieved 467 of 467 residues in 90.6 ms (Link to these results)

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