A0A060Y019_ONCMY Loading...

ADP-ribosylation factor interacting protein 1 (arfaptin 1)

AlphaFold DB , UniProt , Accession A0A060Y019, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene arfip1, Length 585 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	35.2	Very low	30.4	Very low	248 Å²	248	151.2 Å²	151.2	100%	1.222	76%	0.756	S	S	*	*				0	128.4	0	-68	171.8	176.4	0	0	107.5
2	G	26	Very low	32.6	Very low	63 Å²	63	141.8 Å²	141.8	65%	0.649	71%	0.71	S	S	*	*			trans	-94.2	136.4	177.8	0	0	0	0	0	111.3	F4	G2-F4 PolarHBondContact O-N 2.75Å
3	N	25.6	Very low	34.4	Very low	140 Å²	140	137 Å²	137	75%	0.749	70%	0.695	S	S	*	*			trans	-79.6	96.5	173.9	-73.1	-15.2	0	0	0	109.7	Y5	N3-Y5 HydrophobicContact CB-CD2 4.49Å; N3-Y5 HydrophobicContact CB-CE2 4.28Å; N3-Y5 PolarHBondContact O-N 2.67Å; N3-Y5 VanDerWaalsContact O-N 3.13Å
4	F	22.9	Very low	35.6	Very low	186 Å²	186	134.1 Å²	134.1	82%	0.816	69%	0.69	S	S	*	*			trans	-71.3	100.4	166.3	-81	-88.8	0	0	0	109.6	G2 F6	G2-F4 PolarHBondContact O-N 2.75Å; F4-F6 HydrophobicContact CB-CD2 4.46Å; F4-F6 PolarHBondContact O-N 3.28Å
5	Y	24.9	Very low	36.8	Very low	209 Å²	209	134.6 Å²	134.6	82%	0.82	69%	0.693	S	S	*	*			trans	-73.7	104.3	161.8	-77.7	-88.5	0	0	0	108.5	N3 E7	N3-Y5 HydrophobicContact CB-CD2 4.49Å; N3-Y5 HydrophobicContact CB-CE2 4.28Å; N3-Y5 PolarHBondContact O-N 2.67Å; N3-Y5 VanDerWaalsContact O-N 3.13Å; Y5-E7 PolarHBondContact O-N 3.11Å
6	F	22.7	Very low	38.5	Very low	172 Å²	172	129.1 Å²	129.1	75%	0.754	66%	0.663	S	S	*	*			trans	-78.7	102	164.8	-95.5	-87.8	0	0	0	108.9	F4 C8	F4-F6 HydrophobicContact CB-CD2 4.46Å; F4-F6 PolarHBondContact O-N 3.28Å; F6-C8 PolarHBondContact O-N 2.96Å
7	E	27.4	Very low	40.1	Very low	192 Å²	192	126.8 Å²	126.8	90%	0.897	65%	0.652	S	S	*	*			trans	-77.9	75.5	172.2	-166.4	163.3	-131.4	0	0	109.5	Y5	Y5-E7 PolarHBondContact O-N 3.11Å
8	C	27.5	Very low	41.2	Very low	92 Å²	92	125.7 Å²	125.7	62%	0.622	65%	0.647	S	S	*	*			trans	-79.2	118.4	175.3	-69.1	0	0	0	0	110.5	F6 P10	F6-C8 PolarHBondContact O-N 2.96Å; C8-P10 WeakPolarHBondContact O-CD 3.48Å
9	E	32.5	Very low	43.2	Very low	148 Å²	148	124.5 Å²	124.5	69%	0.692	63%	0.633	S	S	*	*			trans	-57.7	123.7	155.9	-75.6	-163.3	147.7	0	0	109.2	Q11	E9-Q11 HydrophobicContact CB-CG 4.32Å; E9-Q11 PolarHBondContact O-N 3.37Å; E9-Q11 PolarHBondContact OE2-NE2 2.64Å
10	P	45.3	Very low	44.6	Very low	58 Å²	58	119.5 Å²	119.5	38%	0.377	61%	0.608	S	S	.	*			trans	-84.4	64.9	-179.6	35.1	-34.9	0	0	0	110.8	C8 I12 C40	C8-P10 WeakPolarHBondContact O-CD 3.48Å; P10-I12 PolarHBondContact O-N 3.32Å; P10-I12 VanDerWaalsContact O-N 3.12Å; P10-C40 HydrophobicContact CB-CB 3.79Å; P10-C40 HydrophobicContact CG-CB 4.16Å; P10-C40 VanDerWaalsContact CG-O 3.28Å; P10-C40 WeakPolarHBondContact CG-O 3.45Å
11	Q	44.4	Very low	45.6	Very low	155 Å²	155	117.9 Å²	117.9	72%	0.724	61%	0.612	S	S	*	*			trans	-66.4	110	173.2	-64.4	-167.9	16.6	0	0	110	E9 P13	E9-Q11 HydrophobicContact CB-CG 4.32Å; E9-Q11 PolarHBondContact O-N 3.37Å; E9-Q11 PolarHBondContact OE2-NE2 2.64Å; Q11-P13 WeakPolarHBondContact O-CD 3.48Å
12	I	56.4	Low	47.1	Very low	39 Å²	39	110.7 Å²	110.7	20%	0.2	59%	0.586	C	S	.	*			trans	-72	116.5	178.9	-62.6	149.4	0	0	0	108.5	P10 F16 L17 I37 C40 E41	P10-I12 PolarHBondContact O-N 3.32Å; P10-I12 VanDerWaalsContact O-N 3.12Å; I12-F16 HydrophobicContact CG2-CB 4.34Å; I12-F16 HydrophobicContact CG2-CD1 3.98Å; I12-L17 HydrophobicContact CG2-CD2 4.04Å; I12-L17 HydrophobicContact CG2-CG 4.11Å; I12-I37 HydrophobicContact CD1-CB 4.16Å; I12-I37 HydrophobicContact CD1-CG1 3.91Å; I12-I37 HydrophobicContact CD1-CG2 3.82Å; I12-I37 HydrophobicContact CG1-CG1 4.31Å; I12-I37 HydrophobicContact CG2-CD1 4.4Å; I12-I37 HydrophobicContact CG2-CG1 4.18Å; I12-C40 HydrophobicContact CD1-CB 4.21Å; I12-C40 HydrophobicContact CG1-CB 4.21Å; I12-E41 HydrophobicContact CD1-CG 4.3Å
13	P	56.4	Low	49.6	Very low	79 Å²	79	111.4 Å²	111.4	51%	0.513	57%	0.573	S	S	.	*			trans	-67.9	139.2	-174	24.5	-31.9	0	0	0	111.1	Q11 L15 F16	Q11-P13 WeakPolarHBondContact O-CD 3.48Å; P13-L15 PolarHBondContact O-N 3Å; P13-F16 HydrophobicContact CG-CB 4.15Å; P13-F16 VanDerWaalsContact O-CB 3.29Å; P13-F16 WeakPolarHBondContact O-CB 3.32Å; P13-F16 PolarHBondContact O-N 3.37Å
14	P	51.4	Low	51.1	Low	97 Å²	97	114.7 Å²	114.7	63%	0.63	58%	0.575	S	S	*	*	H	α-helix	trans	-55.2	-31.4	-174.4	-29.6	35.6	0	0	0	115	F16 L17 L18	P14-F16 PolarHBondContact O-N 2.87Å; P14-L17 PolarHBondContact O-N 3.35Å; P14-L18 PolarHBondContact O-N 2.75Å
15	L	53.5	Low	53.1	Low	141 Å²	141	111.4 Å²	111.4	74%	0.738	57%	0.572	S	S	*	*	H	α-helix	trans	-63.7	-26.9	176	-62.4	177.3	0	0	0	113.1	P13 L18 W19	P13-L15 PolarHBondContact O-N 3Å; L15-L18 HydrophobicContact CD2-CD1 4.33Å; L15-W19 VanDerWaalsContact O-CB 3.3Å; L15-W19 WeakPolarHBondContact O-CB 3.41Å; L15-W19 PolarHBondContact O-N 3.23Å
16	F	64.1	Low	55	Low	46 Å²	46	103.8 Å²	103.8	20%	0.202	56%	0.557	C	S	.	*	H	α-helix	trans	-73	-38.8	175.7	-166.1	-105.6	0	0	0	111.5	I12 P13 P14 W19 I20 W32 A33 Y36 I37	I12-F16 HydrophobicContact CG2-CB 4.34Å; I12-F16 HydrophobicContact CG2-CD1 3.98Å; P13-F16 HydrophobicContact CG-CB 4.15Å; P13-F16 VanDerWaalsContact O-CB 3.29Å; P13-F16 WeakPolarHBondContact O-CB 3.32Å; P13-F16 PolarHBondContact O-N 3.37Å; P14-F16 PolarHBondContact O-N 2.87Å; F16-W19 WeakPolarHBondContact O-CB 3.47Å; F16-W19 PolarHBondContact O-N 3.46Å; F16-I20 HydrophobicContact CD1-CD1 4.04Å; F16-I20 HydrophobicContact CE1-CD1 3.93Å; F16-I20 WeakPolarHBondContact O-CG1 3.37Å; F16-I20 PolarHBondContact O-N 3.04Å; F16-W32 HydrophobicContact CZ-CZ3 4.34Å; F16-A33 HydrophobicContact CE1-CB 3.96Å; F16-A33 HydrophobicContact CZ-CB 3.68Å; F16-Y36 AromaticContact CE1-CD1 3.93Å; F16-Y36 HydrophobicContact CE1-CD1 3.93Å; F16-Y36 AromaticContact CZ-CD1 3.96Å; F16-Y36 HydrophobicContact CZ-CD1 3.96Å; F16-I37 HydrophobicContact CD1-CD1 4.18Å; F16-I37 HydrophobicContact CD1-CG1 4.3Å; F16-I37 HydrophobicContact CE1-CD1 4.17Å; F16-I37 HydrophobicContact CE1-CG1 4.07Å
17	L	65.2	Low	57.5	Low	91 Å²	91	97.5 Å²	97.5	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-43.3	173.8	-61.2	175.9	0	0	0	111.3	I12 P14 W19 I20 A21 I37	I12-L17 HydrophobicContact CG2-CD2 4.04Å; I12-L17 HydrophobicContact CG2-CG 4.11Å; P14-L17 PolarHBondContact O-N 3.35Å; L17-W19 VanDerWaalsContact C-N 3.31Å; L17-W19 PolarHBondContact O-N 3.45Å; L17-I20 PolarHBondContact O-N 3.13Å; L17-A21 WeakPolarHBondContact O-CB 3.07Å; L17-A21 PolarHBondContact O-N 2.81Å; L17-I37 HydrophobicContact CD2-CD1 3.61Å
18	L	60.8	Low	59.3	Low	107 Å²	107	92.9 Å²	92.9	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-61.8	-37.4	172.7	-77	163.7	0	0	0	112.3	P14 L15 A21 S22	P14-L18 PolarHBondContact O-N 2.75Å; L15-L18 HydrophobicContact CD2-CD1 4.33Å; L18-A21 PolarHBondContact O-N 3.06Å; L18-S22 WeakPolarHBondContact O-CB 3.29Å; L18-S22 PolarHBondContact O-N 2.91Å; L18-S22 PolarHBondContact O-OG 2.99Å
19	W	78.4	Confident	60.9	Low	102 Å²	102	93.3 Å²	93.3	39%	0.386	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-48.1	174.8	-177.8	90.6	0	0	0	111.4	L15 F16 L17 A21 S22 H23 E29 A33	L15-W19 VanDerWaalsContact O-CB 3.3Å; L15-W19 WeakPolarHBondContact O-CB 3.41Å; L15-W19 PolarHBondContact O-N 3.23Å; F16-W19 WeakPolarHBondContact O-CB 3.47Å; F16-W19 PolarHBondContact O-N 3.46Å; L17-W19 VanDerWaalsContact C-N 3.31Å; L17-W19 PolarHBondContact O-N 3.45Å; W19-A21 PolarHBondContact O-N 3.17Å; W19-S22 PolarHBondContact O-N 3.43Å; W19-S22 VanDerWaalsContact O-N 3.15Å; W19-H23 AromaticContact CD1-CE1 3.65Å; W19-H23 AromaticContact CD2-CE1 3.87Å; W19-H23 AromaticContact CD2-ND1 3.89Å; W19-H23 AromaticContact CE2-CE1 3.35Å; W19-H23 AromaticContact CE2-ND1 3.79Å; W19-H23 AromaticContact CE2-NE2 3.82Å; W19-H23 AromaticContact CZ2-CE1 3.79Å; W19-H23 AromaticContact CZ2-NE2 3.8Å; W19-H23 AromaticContact NE1-CE1 3.21Å; W19-H23 PolarHBondContact NE1-CE1 3.08Å; W19-H23 AromaticContact NE1-ND1 3.97Å; W19-H23 AromaticContact NE1-NE2 3.84Å; W19-H23 PolarHBondContact O-N 3.29Å; W19-H23 PolarHBondContact O-ND1 3.09Å; W19-E29 HydrophobicContact CH2-CB 4.09Å; W19-A33 HydrophobicContact CZ3-CB 3.92Å
20	I	71.7	Confident	62.6	Low	25 Å²	25	86.4 Å²	86.4	13%	0.128	48%	0.48	C	S	.	.	H	α-helix	trans	-59.3	-47.1	175.7	-64.6	169.7	0	0	0	110.8	F16 L17 S22 H23 A33 L34 I37	F16-I20 HydrophobicContact CD1-CD1 4.04Å; F16-I20 HydrophobicContact CE1-CD1 3.93Å; F16-I20 WeakPolarHBondContact O-CG1 3.37Å; F16-I20 PolarHBondContact O-N 3.04Å; L17-I20 PolarHBondContact O-N 3.13Å; I20-S22 PolarHBondContact O-N 2.95Å; I20-H23 PolarHBondContact O-N 3.45Å; I20-H23 VanDerWaalsContact O-N 3.08Å; I20-A33 HydrophobicContact CD1-CB 3.7Å; I20-A33 HydrophobicContact CG1-CB 3.74Å; I20-L34 HydrophobicContact CG2-CD2 4.4Å; I20-I37 HydrophobicContact CD1-CD1 3.35Å; I20-I37 HydrophobicContact CD1-CG1 4.5Å
21	A	66.2	Low	63.6	Low	85 Å²	85	88.8 Å²	88.8	70%	0.702	49%	0.486	S	S	*	.	H	α-helix	trans	-62.7	-23.1	179.1	0	0	0	0	0	113.6	L17 L18 W19	L17-A21 WeakPolarHBondContact O-CB 3.07Å; L17-A21 PolarHBondContact O-N 2.81Å; L18-A21 PolarHBondContact O-N 3.06Å; W19-A21 PolarHBondContact O-N 3.17Å
22	S	66.7	Low	65.1	Low	97 Å²	97	89 Å²	89	68%	0.678	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-8	177.1	-56.9	0	0	0	0	113.9	L18 W19 I20	L18-S22 WeakPolarHBondContact O-CB 3.29Å; L18-S22 PolarHBondContact O-N 2.91Å; L18-S22 PolarHBondContact O-OG 2.99Å; W19-S22 PolarHBondContact O-N 3.43Å; W19-S22 VanDerWaalsContact O-N 3.15Å; I20-S22 PolarHBondContact O-N 2.95Å
23	H	76.6	Confident	65.7	Low	79 Å²	79	87.2 Å²	87.2	37%	0.366	47%	0.471	S	S	.	.	S	Bend	trans	-103.5	152	-179	-75.7	70.6	0	0	0	111.8	W19 I20 T30	W19-H23 AromaticContact CD1-CE1 3.65Å; W19-H23 AromaticContact CD2-CE1 3.87Å; W19-H23 AromaticContact CD2-ND1 3.89Å; W19-H23 AromaticContact CE2-CE1 3.35Å; W19-H23 AromaticContact CE2-ND1 3.79Å; W19-H23 AromaticContact CE2-NE2 3.82Å; W19-H23 AromaticContact CZ2-CE1 3.79Å; W19-H23 AromaticContact CZ2-NE2 3.8Å; W19-H23 AromaticContact NE1-CE1 3.21Å; W19-H23 PolarHBondContact NE1-CE1 3.08Å; W19-H23 AromaticContact NE1-ND1 3.97Å; W19-H23 AromaticContact NE1-NE2 3.84Å; W19-H23 PolarHBondContact O-N 3.29Å; W19-H23 PolarHBondContact O-ND1 3.09Å; I20-H23 PolarHBondContact O-N 3.45Å; I20-H23 VanDerWaalsContact O-N 3.08Å; H23-T30 HydrophobicContact CB-CG2 3.43Å; H23-T30 VanDerWaalsContact CB-CG2 3.43Å
24	R	58.8	Low	66.6	Low	209 Å²	209	87.1 Å²	87.1	79%	0.789	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-63.7	126.4	177.8	-179.5	177	-73.8	-162.6	-2.7	109.3	T27 T30	R24-T27 HydrophobicContact CB-CG2 4.36Å; R24-T27 WeakPolarHBondContact O-CG2 3.38Å; R24-T30 PolarHBondContact O-OG1 3.48Å
25	P	64	Low	67.5	Low	116 Å²	116	86.8 Å²	86.8	75%	0.753	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	142.8	-179.6	25.5	-34.4	0	0	0	111.5
26	G	64.9	Low	68.3	Low	50 Å²	50	85.8 Å²	85.8	52%	0.515	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	-1.5	174.9	0	0	0	0	0	115.4	T30 Q31	G26-T30 PolarHBondContact N-OG1 3.07Å; G26-Q31 PolarHBondContact O-NE2 3.41Å
27	T	75	Confident	68.5	Low	39 Å²	39	84.8 Å²	84.8	24%	0.239	44%	0.443	C	S	.	.	S	Bend	trans	-70.1	159.9	170.3	74.3	0	0	0	0	111.6	R24 E29 T30 Q31	R24-T27 HydrophobicContact CB-CG2 4.36Å; R24-T27 WeakPolarHBondContact O-CG2 3.38Å; T27-E29 WeakPolarHBondContact CB-OE2 3.47Å; T27-E29 PolarHBondContact O-N 2.87Å; T27-E29 PolarHBondContact OG1-OE2 3.04Å; T27-T30 PolarHBondContact N-OG1 3.24Å; T27-T30 PolarHBondContact O-N 2.96Å; T27-T30 PolarHBondContact O-OG1 3.02Å; T27-T30 PolarHBondContact OG1-N 3.36Å; T27-T30 PolarHBondContact OG1-OG1 2.81Å; T27-Q31 WeakPolarHBondContact O-CG 3.23Å; T27-Q31 PolarHBondContact O-N 3.14Å
28	P	64.6	Low	68.3	Low	96 Å²	96	82 Å²	82	62%	0.623	43%	0.428	S	S	*	.	H	α-helix	trans	-57.1	-34.2	177.9	-25.3	35.9	0	0	0	113.5	W32	P28-W32 VanDerWaalsContact O-CB 3.29Å; P28-W32 WeakPolarHBondContact O-CB 3.44Å; P28-W32 PolarHBondContact O-N 3.36Å
29	E	62.4	Low	68.2	Low	100 Å²	100	79.9 Å²	79.9	47%	0.467	42%	0.422	S	S	.	.	H	α-helix	trans	-76.1	-38.4	-177	-45	72.1	-156	0	0	111.5	W19 T27 W32 A33	W19-E29 HydrophobicContact CH2-CB 4.09Å; T27-E29 WeakPolarHBondContact CB-OE2 3.47Å; T27-E29 PolarHBondContact O-N 2.87Å; T27-E29 PolarHBondContact OG1-OE2 3.04Å; E29-W32 PolarHBondContact O-N 3.47Å; E29-A33 WeakPolarHBondContact O-CB 3.41Å; E29-A33 PolarHBondContact O-N 3.35Å
30	T	67	Low	67.2	Low	3 Å²	3	75.9 Å²	75.9	2%	0.018	41%	0.409	C	S	.	.	H	α-helix	trans	-70.4	-37.5	173.4	48.7	0	0	0	0	111.6	H23 R24 G26 T27 A33 L34	H23-T30 HydrophobicContact CB-CG2 3.43Å; H23-T30 VanDerWaalsContact CB-CG2 3.43Å; R24-T30 PolarHBondContact O-OG1 3.48Å; G26-T30 PolarHBondContact N-OG1 3.07Å; T27-T30 PolarHBondContact N-OG1 3.24Å; T27-T30 PolarHBondContact O-N 2.96Å; T27-T30 PolarHBondContact O-OG1 3.02Å; T27-T30 PolarHBondContact OG1-N 3.36Å; T27-T30 PolarHBondContact OG1-OG1 2.81Å; T30-A33 PolarHBondContact O-N 2.91Å; T30-L34 WeakPolarHBondContact O-CB 3.38Å; T30-L34 VanDerWaalsContact O-CG 3.28Å; T30-L34 WeakPolarHBondContact O-CG 3.27Å; T30-L34 PolarHBondContact O-N 3.1Å
31	Q	67.5	Low	66.4	Low	108 Å²	108	80 Å²	80	51%	0.505	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-42.1	171.2	-69.4	-176.7	43.3	0	0	112	G26 T27 L34 N35	G26-Q31 PolarHBondContact O-NE2 3.41Å; T27-Q31 WeakPolarHBondContact O-CG 3.23Å; T27-Q31 PolarHBondContact O-N 3.14Å; Q31-L34 PolarHBondContact O-N 3.5Å; Q31-N35 WeakPolarHBondContact O-CB 3.49Å; Q31-N35 VanDerWaalsContact O-CG 3.31Å; Q31-N35 PolarHBondContact O-N 3.19Å; Q31-N35 PolarHBondContact O-ND2 2.87Å
32	W	76.6	Confident	65.7	Low	161 Å²	161	80.7 Å²	80.7	61%	0.61	42%	0.419	S	S	*	.	H	α-helix	trans	-61.5	-46	175.6	-179.1	87.2	0	0	0	111.9	F16 P28 E29 L34 N35 Y36	F16-W32 HydrophobicContact CZ-CZ3 4.34Å; P28-W32 VanDerWaalsContact O-CB 3.29Å; P28-W32 WeakPolarHBondContact O-CB 3.44Å; P28-W32 PolarHBondContact O-N 3.36Å; E29-W32 PolarHBondContact O-N 3.47Å; W32-L34 PolarHBondContact O-N 2.92Å; W32-N35 PolarHBondContact O-N 2.88Å; W32-Y36 WeakPolarHBondContact O-CB 3.31Å; W32-Y36 PolarHBondContact O-N 3.44Å
33	A	68.9	Low	65	Low	0 Å²	0	83.2 Å²	83.2	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-66.9	-36	-180	0	0	0	0	0	113.1	F16 W19 I20 E29 T30 Y36 I37	F16-A33 HydrophobicContact CE1-CB 3.96Å; F16-A33 HydrophobicContact CZ-CB 3.68Å; W19-A33 HydrophobicContact CZ3-CB 3.92Å; I20-A33 HydrophobicContact CD1-CB 3.7Å; I20-A33 HydrophobicContact CG1-CB 3.74Å; E29-A33 WeakPolarHBondContact O-CB 3.41Å; E29-A33 PolarHBondContact O-N 3.35Å; T30-A33 PolarHBondContact O-N 2.91Å; A33-Y36 PolarHBondContact O-N 3.43Å; A33-I37 WeakPolarHBondContact O-CG1 3.31Å; A33-I37 PolarHBondContact O-N 3.18Å
34	L	74.8	Confident	63.5	Low	78 Å²	78	83.4 Å²	83.4	41%	0.408	43%	0.427	S	S	.	.	H	α-helix	trans	-68.1	-40.1	172.5	-71.9	168.9	0	0	0	112.2	I20 T30 Q31 W32 Y36 I37 L38	I20-L34 HydrophobicContact CG2-CD2 4.4Å; T30-L34 WeakPolarHBondContact O-CB 3.38Å; T30-L34 VanDerWaalsContact O-CG 3.28Å; T30-L34 WeakPolarHBondContact O-CG 3.27Å; T30-L34 PolarHBondContact O-N 3.1Å; Q31-L34 PolarHBondContact O-N 3.5Å; W32-L34 PolarHBondContact O-N 2.92Å; L34-Y36 VanDerWaalsContact C-N 3.32Å; L34-I37 PolarHBondContact O-N 2.86Å; L34-L38 WeakPolarHBondContact O-CB 3.28Å; L34-L38 PolarHBondContact O-N 3.4Å
35	N	69	Low	62.7	Low	90 Å²	90	77.4 Å²	77.4	48%	0.481	43%	0.431	S	S	.	.	H	α-helix	trans	-65.7	-34.9	173.4	-73.7	-38	0	0	0	112.2	Q31 W32 L38 C39	Q31-N35 WeakPolarHBondContact O-CB 3.49Å; Q31-N35 VanDerWaalsContact O-CG 3.31Å; Q31-N35 PolarHBondContact O-N 3.19Å; Q31-N35 PolarHBondContact O-ND2 2.87Å; W32-N35 PolarHBondContact O-N 2.88Å; N35-L38 PolarHBondContact O-N 3.13Å; N35-C39 PolarHBondContact O-N 3.07Å
36	Y	70.6	Confident	61.3	Low	120 Å²	120	77 Å²	77	47%	0.471	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-47.5	174.1	-179	-103.7	0	0	0	111.5	F16 W32 A33 L34 L38 C39 C40	F16-Y36 AromaticContact CE1-CD1 3.93Å; F16-Y36 HydrophobicContact CE1-CD1 3.93Å; F16-Y36 AromaticContact CZ-CD1 3.96Å; F16-Y36 HydrophobicContact CZ-CD1 3.96Å; W32-Y36 WeakPolarHBondContact O-CB 3.31Å; W32-Y36 PolarHBondContact O-N 3.44Å; A33-Y36 PolarHBondContact O-N 3.43Å; L34-Y36 VanDerWaalsContact C-N 3.32Å; Y36-L38 VanDerWaalsContact C-N 3.28Å; Y36-L38 PolarHBondContact O-N 3.37Å; Y36-C39 PolarHBondContact O-N 3.09Å; Y36-C40 PolarHBondContact O-N 2.85Å; Y36-C40 PolarHBondContact O-SG 3.5Å; Y36-C40 VanDerWaalsContact O-SG 3.36Å
37	I	69	Low	59.7	Low	24 Å²	24	81 Å²	81	12%	0.123	44%	0.438	C	S	.	.	H	α-helix	trans	-55.8	-43.3	172.4	-74.3	171.7	0	0	0	111.5	I12 F16 L17 I20 A33 L34 C40 E41	I12-I37 HydrophobicContact CD1-CB 4.16Å; I12-I37 HydrophobicContact CD1-CG1 3.91Å; I12-I37 HydrophobicContact CD1-CG2 3.82Å; I12-I37 HydrophobicContact CG1-CG1 4.31Å; I12-I37 HydrophobicContact CG2-CD1 4.4Å; I12-I37 HydrophobicContact CG2-CG1 4.18Å; F16-I37 HydrophobicContact CD1-CD1 4.18Å; F16-I37 HydrophobicContact CD1-CG1 4.3Å; F16-I37 HydrophobicContact CE1-CD1 4.17Å; F16-I37 HydrophobicContact CE1-CG1 4.07Å; L17-I37 HydrophobicContact CD2-CD1 3.61Å; I20-I37 HydrophobicContact CD1-CD1 3.35Å; I20-I37 HydrophobicContact CD1-CG1 4.5Å; A33-I37 WeakPolarHBondContact O-CG1 3.31Å; A33-I37 PolarHBondContact O-N 3.18Å; L34-I37 PolarHBondContact O-N 2.86Å; I37-C40 WeakPolarHBondContact O-CB 3.34Å; I37-C40 PolarHBondContact O-N 2.93Å; I37-E41 PolarHBondContact O-N 3.31Å
38	L	62	Low	57.5	Low	33 Å²	33	88.9 Å²	88.9	17%	0.173	47%	0.469	C	S	.	.	H	α-helix	trans	-64.3	-41.5	178.6	-170	76.1	0	0	0	112.2	L34 N35 Y36 C40 L42 T347	L34-L38 WeakPolarHBondContact O-CB 3.28Å; L34-L38 PolarHBondContact O-N 3.4Å; N35-L38 PolarHBondContact O-N 3.13Å; Y36-L38 VanDerWaalsContact C-N 3.28Å; Y36-L38 PolarHBondContact O-N 3.37Å; L38-C40 VanDerWaalsContact C-N 3.3Å; L38-C40 PolarHBondContact O-N 2.68Å; L38-L42 HydrophobicContact CD1-CD1 3.92Å; L38-L42 HydrophobicContact CD1-CG 4.29Å; L38-L42 HydrophobicContact CD2-CD1 4.38Å; L38-L42 HydrophobicContact CG-CD1 3.79Å; L38-L42 HydrophobicContact CG-CG 4.35Å; L38-L42 VanDerWaalsContact O-CB 3.26Å; L38-L42 WeakPolarHBondContact O-CB 3.31Å; L38-L42 VanDerWaalsContact O-CG 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.41Å; L38-L42 PolarHBondContact O-N 3.41Å; L38-T347 HydrophobicContact CD1-CG2 4.15Å; L38-T347 HydrophobicContact CD2-CG2 3.39Å; L38-T347 HydrophobicContact CG-CG2 4.43Å
39	C	57.8	Low	55.8	Low	63 Å²	63	92.5 Å²	92.5	43%	0.426	48%	0.475	S	S	.	.	H	α-helix	trans	-63.4	-35.2	172.7	-78.1	0	0	0	0	112.6	N35 Y36 Q43	N35-C39 PolarHBondContact O-N 3.07Å; Y36-C39 PolarHBondContact O-N 3.09Å; C39-Q43 PolarHBondContact O-N 3.45Å
40	C	58.2	Low	54.3	Low	18 Å²	18	93.1 Å²	93.1	12%	0.122	49%	0.488	C	S	.	.	H	α-helix	trans	-66.9	-53.7	175.3	-71.4	0	0	0	0	112.3	P10 I12 Y36 I37 L38 L42 Q43	P10-C40 HydrophobicContact CB-CB 3.79Å; P10-C40 HydrophobicContact CG-CB 4.16Å; P10-C40 VanDerWaalsContact CG-O 3.28Å; P10-C40 WeakPolarHBondContact CG-O 3.45Å; I12-C40 HydrophobicContact CD1-CB 4.21Å; I12-C40 HydrophobicContact CG1-CB 4.21Å; Y36-C40 PolarHBondContact O-N 2.85Å; Y36-C40 PolarHBondContact O-SG 3.5Å; Y36-C40 VanDerWaalsContact O-SG 3.36Å; I37-C40 WeakPolarHBondContact O-CB 3.34Å; I37-C40 PolarHBondContact O-N 2.93Å; L38-C40 VanDerWaalsContact C-N 3.3Å; L38-C40 PolarHBondContact O-N 2.68Å; C40-L42 PolarHBondContact O-N 2.93Å; C40-Q43 PolarHBondContact O-N 2.96Å
41	E	54.1	Low	52.5	Low	112 Å²	112	100 Å²	100	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-70.9	-25.3	-178.7	-69.2	-159.3	136.5	0	0	113.5	I12 I37 K358	I12-E41 HydrophobicContact CD1-CG 4.3Å; I37-E41 PolarHBondContact O-N 3.31Å; E41-K358 VanDerWaalsContact CD-NZ 3.34Å; E41-K358 IonicContact OE1-NZ 2.74Å; E41-K358 PolarHBondContact OE1-NZ 3.41Å; E41-K358 IonicContact OE2-NZ 3.4Å; E41-K358 PolarHBondContact OE2-NZ 3.26Å
42	L	51.3	Low	50.9	Low	99 Å²	99	101 Å²	101	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-89.8	-8.1	178	-64.8	-178.1	0	0	0	114.9	L38 C40 T44	L38-L42 HydrophobicContact CD1-CD1 3.92Å; L38-L42 HydrophobicContact CD1-CG 4.29Å; L38-L42 HydrophobicContact CD2-CD1 4.38Å; L38-L42 HydrophobicContact CG-CD1 3.79Å; L38-L42 HydrophobicContact CG-CG 4.35Å; L38-L42 VanDerWaalsContact O-CB 3.26Å; L38-L42 WeakPolarHBondContact O-CB 3.31Å; L38-L42 VanDerWaalsContact O-CG 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.41Å; L38-L42 PolarHBondContact O-N 3.41Å; C40-L42 PolarHBondContact O-N 2.93Å; L42-T44 HydrophobicContact CB-CG2 4.27Å; L42-T44 PolarHBondContact O-N 3.15Å
43	Q	52.3	Low	48.7	Very low	150 Å²	150	96.1 Å²	96.1	70%	0.701	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	19.6	178.7	-128.1	170.4	3.9	0	0	114.9	C39 C40 G45	C39-Q43 PolarHBondContact O-N 3.45Å; C40-Q43 PolarHBondContact O-N 2.96Å; Q43-G45 PolarHBondContact O-N 3.36Å
44	T	45.4	Very low	46.9	Very low	82 Å²	82	102.1 Å²	102.1	50%	0.503	58%	0.582	S	S	.	*			trans	-83.9	96.5	-176.3	46	0	0	0	0	111.8	L42 C46	L42-T44 HydrophobicContact CB-CG2 4.27Å; L42-T44 PolarHBondContact O-N 3.15Å; T44-C46 PolarHBondContact O-N 2.91Å
45	G	42.6	Very low	44.6	Very low	84 Å²	84	102.2 Å²	102.2	87%	0.866	60%	0.602	S	S	*	*			trans	-70	56.4	-177.6	0	0	0	0	0	116.6	Q43	Q43-G45 PolarHBondContact O-N 3.36Å
46	C	33.3	Very low	42.7	Very low	107 Å²	107	104 Å²	104	72%	0.723	62%	0.616	S	S	*	*			trans	-132.7	103.1	178.3	-78.5	0	0	0	0	111.9	T44	T44-C46 PolarHBondContact O-N 2.91Å
47	I	32.5	Very low	40.4	Very low	135 Å²	135	107 Å²	107	69%	0.692	63%	0.632	S	S	*	*			trans	-108.2	116.4	167.1	-54.6	176.8	0	0	0	108.9	F49	I47-F49 HydrophobicContact CG2-CD2 3.71Å; I47-F49 HydrophobicContact CG2-CE2 3.47Å; I47-F49 VanDerWaalsContact CG2-CE2 3.47Å; I47-F49 HydrophobicContact CG2-CG 4.4Å; I47-F49 HydrophobicContact CG2-CZ 3.98Å
48	F	27	Very low	38.3	Very low	203 Å²	203	112.1 Å²	112.1	89%	0.89	67%	0.668	S	S	*	*			trans	-107.4	113.7	169.7	-109.5	-88.6	0	0	0	109.5
49	F	30.2	Very low	36.8	Very low	173 Å²	173	115 Å²	115	76%	0.759	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-93.8	125.4	176.5	-81.4	-74.9	0	0	0	111.9	I47	I47-F49 HydrophobicContact CG2-CD2 3.71Å; I47-F49 HydrophobicContact CG2-CE2 3.47Å; I47-F49 VanDerWaalsContact CG2-CE2 3.47Å; I47-F49 HydrophobicContact CG2-CG 4.4Å; I47-F49 HydrophobicContact CG2-CZ 3.98Å
50	P	31.5	Very low	35.3	Very low	113 Å²	113	121.3 Å²	121.3	73%	0.734	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-76.5	133.5	154.8	31.9	-30.3	0	0	0	109.5	P52	P50-P52 WeakPolarHBondContact O-CD 3.49Å
51	N	28.3	Very low	33.8	Very low	146 Å²	146	129.5 Å²	129.5	78%	0.781	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-84.2	116.7	-173.3	178.6	4.3	0	0	0	112.9	G53	N51-G53 PolarHBondContact O-N 3.21Å; N51-G53 PolarHBondContact OD1-N 3.29Å
52	P	34.2	Very low	32.7	Very low	130 Å²	130	133.1 Å²	133.1	84%	0.844	76%	0.758	S	S	*	*			trans	-89.4	66.3	175.3	36.9	-32.7	0	0	0	111.6	P50	P50-P52 WeakPolarHBondContact O-CD 3.49Å
53	G	29.9	Very low	31.6	Very low	59 Å²	59	139.6 Å²	139.6	61%	0.608	78%	0.776	S	S	*	*			trans	-111.1	65.5	-164.9	0	0	0	0	0	117.6	N51	N51-G53 PolarHBondContact O-N 3.21Å; N51-G53 PolarHBondContact OD1-N 3.29Å
54	S	31.4	Very low	30.3	Very low	126 Å²	126	141 Å²	141	88%	0.881	78%	0.782	S	S	*	*			trans	-166.5	131.4	152.5	52.7	0	0	0	0	111.6
55	G	26.6	Very low	29.4	Very low	80 Å²	80	144.9 Å²	144.9	83%	0.825	80%	0.798	S	S	*	*			trans	152.2	57.7	-176.2	0	0	0	0	0	115.8
56	T	28	Very low	28.5	Very low	126 Å²	126	150 Å²	150	77%	0.773	80%	0.796	S	S	*	*			trans	-40	141.8	-178	42.3	0	0	0	0	119.7
57	F	23.9	Very low	28.2	Very low	183 Å²	183	151 Å²	151	80%	0.803	80%	0.799	S	S	*	*			trans	70.8	110.8	149.3	-81.7	-67.3	0	0	0	121.9	T59	F57-T59 HydrophobicContact CD1-CG2 4.05Å; F57-T59 HydrophobicContact CE1-CG2 4.16Å
58	C	24.4	Very low	27.9	Very low	132 Å²	132	155.4 Å²	155.4	89%	0.892	81%	0.807	S	S	*	*				-144.8	163.7	115.9	-148.2	0	0	0	0	110.5
59	T	29.9	Very low	27.9	Very low	94 Å²	94	152.4 Å²	152.4	58%	0.577	81%	0.805	S	S	*	*			trans	-131.7	159.1	-173	64.9	0	0	0	0	113.5	F57	F57-T59 HydrophobicContact CD1-CG2 4.05Å; F57-T59 HydrophobicContact CE1-CG2 4.16Å
60	K	27.4	Very low	27.8	Very low	195 Å²	195	153.2 Å²	153.2	85%	0.848	81%	0.808	S	S	*	*			trans	70.7	151.5	-178.1	-58.7	165.9	176.9	164.6	0	112.9
61	K	25.9	Very low	27.7	Very low	191 Å²	191	152.7 Å²	152.7	83%	0.83	81%	0.814	S	S	*	*			cis	-147.4	144.6	8.7	-154.2	175.9	-179.2	179.6	0	110
62	H	30.4	Very low	27.7	Very low	188 Å²	188	150.5 Å²	150.5	87%	0.87	82%	0.815	S	S	*	*			trans	-57.1	140	164.3	-97.9	-94.1	0	0	0	110.5
63	R	27.6	Very low	27.4	Very low	235 Å²	235	147.7 Å²	147.7	89%	0.887	81%	0.811	S	S	*	*			trans	-147.5	120.2	161.8	-137.1	179.8	-167.9	-178.7	3.4	109.3
64	E	27	Very low	27.3	Very low	180 Å²	180	154.1 Å²	154.1	84%	0.841	83%	0.827	S	S	*	*			trans	-68.8	133.6	177.4	-58.2	152.1	110	0	0	109.8	K66	E64-K66 VanDerWaalsContact C-N 3.3Å; E64-K66 PolarHBondContact O-N 2.97Å; E64-K66 VanDerWaalsContact O-N 3.09Å
65	I	25.1	Very low	27.2	Very low	162 Å²	162	154.4 Å²	154.4	83%	0.831	83%	0.829	S	S	*	*			trans	-84.3	82	169.7	-58.5	-178.8	0	0	0	107.7	V67	I65-V67 HydrophobicContact CG2-CG2 4.39Å; I65-V67 PolarHBondContact O-N 3.18Å
66	K	25.1	Very low	27.2	Very low	192 Å²	192	158.9 Å²	158.9	84%	0.835	83%	0.829	S	S	*	*			trans	-75.2	89.6	173.7	-170.1	161.8	-169.7	158.3	0	109.6	E64 R68	E64-K66 VanDerWaalsContact C-N 3.3Å; E64-K66 PolarHBondContact O-N 2.97Å; E64-K66 VanDerWaalsContact O-N 3.09Å; K66-R68 PolarHBondContact O-N 3.27Å; K66-R68 VanDerWaalsContact O-N 3.17Å
67	V	25.6	Very low	27.1	Very low	128 Å²	128	158.3 Å²	158.3	78%	0.776	83%	0.825	S	S	*	*			trans	-55.9	119.6	173.4	-179.2	0	0	0	0	108.5	I65	I65-V67 HydrophobicContact CG2-CG2 4.39Å; I65-V67 PolarHBondContact O-N 3.18Å
68	R	25.4	Very low	27.2	Very low	228 Å²	228	154.8 Å²	154.8	86%	0.86	82%	0.822	S	S	*	*			trans	-126.3	95.9	179.6	-167.1	176.6	-167.8	172.5	4.3	108.7	K66 K70	K66-R68 PolarHBondContact O-N 3.27Å; K66-R68 VanDerWaalsContact O-N 3.17Å; R68-K70 PolarHBondContact O-N 3.2Å
69	T	28.8	Very low	27.4	Very low	139 Å²	139	154.5 Å²	154.5	85%	0.853	82%	0.816	S	S	*	*			trans	-51.3	135.1	167.8	21.8	0	0	0	0	109.9
70	K	26.3	Very low	27.2	Very low	191 Å²	191	159 Å²	159	83%	0.83	83%	0.831	S	S	*	*			trans	-141.8	95.2	173	-163.3	-174.1	-176.8	-166.5	0	109.6	R68	R68-K70 PolarHBondContact O-N 3.2Å
71	A	30	Very low	27.2	Very low	102 Å²	102	154.3 Å²	154.3	84%	0.843	83%	0.828	S	S	*	*			trans	-66.7	146.8	163.6	0	0	0	0	0	109.8
72	A	29.3	Very low	27.2	Very low	99 Å²	99	154.5 Å²	154.5	82%	0.818	83%	0.832	S	S	*	*			trans	-151.2	122.6	167.7	0	0	0	0	0	107.8
73	G	27.7	Very low	27.2	Very low	72 Å²	72	150.7 Å²	150.7	74%	0.742	83%	0.827	S	S	*	*			trans	-103.5	151.8	174.3	0	0	0	0	0	111.7
74	M	27.8	Very low	27.7	Very low	194 Å²	194	145.5 Å²	145.5	96%	0.956	82%	0.824	S	S	*	*			trans	36.1	114	144	-60.2	165.7	67.4	0	0	119
75	S	28.3	Very low	27.8	Very low	131 Å²	131	140.8 Å²	140.8	92%	0.916	82%	0.815	S	S	*	*				-152.7	165.2	125.4	-160.2	0	0	0	0	110.5
76	E	27.8	Very low	28.2	Very low	175 Å²	175	142.1 Å²	142.1	82%	0.818	82%	0.818	S	S	*	*			trans	-118.5	-179.4	-152.9	-166.5	175.5	-134.3	0	0	112.5
77	V	26.3	Very low	28.4	Very low	114 Å²	114	139.4 Å²	139.4	69%	0.691	81%	0.813	S	S	*	*			trans	96	125.7	156.8	179.4	0	0	0	0	120.6
78	S	25.3	Very low	28.9	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	81%	0.812	S	S	*	*			trans	65.5	157.3	156.9	-70.1	0	0	0	0	121.5
79	V	27.5	Very low	30	Very low	126 Å²	126	134.2 Å²	134.2	76%	0.764	80%	0.802	S	S	*	*			cis	168.2	120.5	-41.3	145.1	0	0	0	0	106.7
80	E	25.6	Very low	30.1	Very low	190 Å²	190	135.6 Å²	135.6	89%	0.888	80%	0.801	S	S	*	*			trans	159.7	123.9	157.5	-94.3	173.4	170.2	0	0	106.1
81	A	27.9	Very low	30.1	Very low	96 Å²	96	133.1 Å²	133.1	79%	0.793	80%	0.797	S	S	*	*			cis	102.2	89.2	26.6	0	0	0	0	0	113.7
82	E	26.3	Very low	30.1	Very low	195 Å²	195	132.6 Å²	132.6	91%	0.911	79%	0.787	S	S	*	*			trans	-156.5	156.8	146.1	-127	178.1	-171.1	0	0	111.8
83	S	30.2	Very low	30.2	Very low	108 Å²	108	132 Å²	132	76%	0.755	78%	0.777	S	S	*	*			trans	-157.5	151.4	176.3	-68.4	0	0	0	0	108.9
84	P	38.1	Very low	30.4	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	78%	0.777	S	S	*	*				-136.6	150.5	100.2	34.3	-21.4	0	0	0	112.6
85	A	30.2	Very low	30.4	Very low	81 Å²	81	134.6 Å²	134.6	67%	0.669	77%	0.765	S	S	*	*			cis	84.7	93.6	30.4	0	0	0	0	0	115.3
86	Q	31.8	Very low	30.5	Very low	189 Å²	189	132.3 Å²	132.3	88%	0.883	75%	0.754	S	S	*	*			trans	-167.1	116.4	146.1	-102.4	161.4	31.8	0	0	106.6
87	D	29.7	Very low	30.7	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	75%	0.754	S	S	*	*			cis	72.5	129.9	43.4	-73.1	-14.2	0	0	0	113.7
88	L	36.1	Very low	30.7	Very low	147 Å²	147	132.8 Å²	132.8	77%	0.77	75%	0.753	S	S	*	*			cis	-155	-157.1	5.3	-97.1	157.6	0	0	0	108.6
89	P	48.7	Very low	30.8	Very low	99 Å²	99	133.7 Å²	133.7	64%	0.643	75%	0.754	S	S	*	*				-142.3	-166.1	-85.6	46.7	-27.4	0	0	0	117
90	M	31.5	Very low	31.1	Very low	169 Å²	169	135.9 Å²	135.9	83%	0.833	76%	0.756	S	S	*	*			trans	68.2	159.6	155.5	-67.5	-61	-166.4	0	0	118.5
91	D	27.1	Very low	31.2	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	75%	0.745	S	S	*	*			cis	-138.7	177.4	9.7	-155.1	-21.1	0	0	0	112.4
92	S	29	Very low	31.2	Very low	92 Å²	92	136.1 Å²	136.1	64%	0.643	74%	0.742	S	S	*	*			trans	-75.9	-169.9	176.5	69.2	0	0	0	0	113.7
93	S	31.7	Very low	31.2	Very low	87 Å²	87	132 Å²	132	61%	0.608	72%	0.723	S	S	*	*			cis	-162.9	167	18.4	-107.4	0	0	0	0	110.2
94	K	31.7	Very low	31.2	Very low	170 Å²	170	135.7 Å²	135.7	74%	0.739	72%	0.72	S	S	*	*			trans	36.6	161	136	-61.8	164.7	162.9	-143.4	0	121.4
95	E	28.5	Very low	30.8	Very low	149 Å²	149	136.9 Å²	136.9	70%	0.696	72%	0.715	S	S	*	*			cis	-156.1	139.5	5.7	-116.5	142.8	-151.5	0	0	105.1
96	A	29.6	Very low	30.8	Very low	84 Å²	84	136.8 Å²	136.8	69%	0.694	71%	0.71	S	S	*	*				75.9	135.1	82.4	0	0	0	0	0	117.5
97	Q	31.2	Very low	30.8	Very low	174 Å²	174	135.1 Å²	135.1	81%	0.813	70%	0.702	S	S	*	*			trans	69.7	158.5	162.8	-61.6	-179.2	-7	0	0	118.8
98	N	27	Very low	30.9	Very low	124 Å²	124	137.4 Å²	137.4	66%	0.663	71%	0.708	S	S	*	*			cis	-165.7	147.3	-25.8	-104.9	6.3	0	0	0	109.6
99	T	28.3	Very low	30.5	Very low	127 Å²	127	138.2 Å²	138.2	78%	0.779	71%	0.713	S	S	*	*			trans	167.7	125.7	143.2	40.7	0	0	0	0	107.5
100	E	32	Very low	29.6	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.804	71%	0.713	S	S	*	*				66.6	134.5	59.3	-66.3	179	-161.5	0	0	113.5
101	D	28.2	Very low	29.5	Very low	123 Å²	123	138.2 Å²	138.2	66%	0.658	72%	0.715	S	S	*	*			cis	-165.2	154.7	-15.5	176.9	28.6	0	0	0	107.6
102	F	27.3	Very low	29.5	Very low	169 Å²	169	136.7 Å²	136.7	74%	0.741	72%	0.715	S	S	*	*			trans	-177.7	104.5	135.7	-121	-109	0	0	0	113.6
103	Q	28	Very low	29.4	Very low	109 Å²	109	142.2 Å²	142.2	51%	0.509	73%	0.728	S	S	.	*			trans	62	111.3	133.1	-60.3	-168.4	4.8	0	0	120.1
104	R	30.3	Very low	29.2	Very low	184 Å²	184	145 Å²	145	69%	0.694	74%	0.736	S	S	*	*				80	146.8	83.5	-75.4	-177.6	154.6	100.4	14.3	113.7
105	E	28.6	Very low	29	Very low	151 Å²	151	141.9 Å²	141.9	71%	0.706	74%	0.735	S	S	*	*			cis	-163.9	164.1	-7.8	-110.9	152.4	-171.1	0	0	104.7
106	S	30.7	Very low	29	Very low	80 Å²	80	140.6 Å²	140.6	56%	0.559	74%	0.738	S	S	*	*			cis	-158.7	-177.6	7.4	46.5	0	0	0	0	109.8
107	E	31.4	Very low	29	Very low	153 Å²	153	143.2 Å²	143.2	72%	0.715	74%	0.736	S	S	*	*			trans	56.1	120.6	164.6	-70.2	97	-137.4	0	0	120
108	E	31.3	Very low	28.9	Very low	184 Å²	184	144.1 Å²	144.1	86%	0.86	73%	0.733	S	S	*	*				74.2	127.9	69.3	-67.1	175.9	-173.1	0	0	112.3
109	D	27.9	Very low	29.1	Very low	165 Å²	165	143.5 Å²	143.5	88%	0.882	73%	0.734	S	S	*	*				-143.5	176.7	58.2	-141.5	-29.9	0	0	0	114.9
110	A	29.6	Very low	29.1	Very low	76 Å²	76	143.5 Å²	143.5	63%	0.628	73%	0.728	S	S	*	*			trans	-114.7	151.5	-170.4	0	0	0	0	0	115.6
111	H	29.2	Very low	29	Very low	192 Å²	192	143.2 Å²	143.2	89%	0.889	73%	0.732	S	S	*	*			trans	-171.1	111.5	144.4	-89	-54.1	0	0	0	108.4
112	S	28.9	Very low	29	Very low	105 Å²	105	143 Å²	143	73%	0.734	73%	0.731	S	S	*	*				74.2	94.2	80.3	-177.6	0	0	0	0	114.1
113	F	26.5	Very low	29.2	Very low	208 Å²	208	142.4 Å²	142.4	91%	0.912	74%	0.736	S	S	*	*			trans	-148.7	114.3	156.3	-145	-86.2	0	0	0	111.5
114	D	27.6	Very low	29.2	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	75%	0.751	S	S	*	*			trans	-152.9	168.5	169.5	-172.1	20.9	0	0	0	108
115	S	26.9	Very low	29.5	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	75%	0.754	S	S	*	*			trans	98	98.6	-175	-45.1	0	0	0	0	115.2
116	T	27.9	Very low	30	Very low	122 Å²	122	141.6 Å²	141.6	75%	0.748	76%	0.759	S	S	*	*			trans	-67.7	177.6	144.8	45.8	0	0	0	0	111.7
117	E	30.7	Very low	30.2	Very low	140 Å²	140	146.9 Å²	146.9	65%	0.654	78%	0.775	S	S	*	*			trans	74.4	154.9	172.9	-49.1	-162.3	144.8	0	0	114
118	Y	28.3	Very low	30.1	Very low	192 Å²	192	142.6 Å²	142.6	75%	0.753	77%	0.771	S	S	*	*			cis	-167.5	165.3	-8.6	-113.4	17.1	0	0	0	109
119	V	31.4	Very low	29.9	Very low	112 Å²	112	141.5 Å²	141.5	68%	0.679	77%	0.771	S	S	*	*			cis	-152.3	-160.9	-1.7	82.4	0	0	0	0	110.6
120	L	29.4	Very low	30.1	Very low	127 Å²	127	143.1 Å²	143.1	67%	0.665	77%	0.765	S	S	*	*			trans	-44.4	159.8	174.4	-61.1	158.6	0	0	0	118.5
121	N	27.9	Very low	30.2	Very low	166 Å²	166	143.9 Å²	143.9	89%	0.888	77%	0.771	S	S	*	*				-142.1	147.1	120.6	-101.7	-30.1	0	0	0	111.1
122	N	29.8	Very low	30.6	Very low	119 Å²	119	141.1 Å²	141.1	64%	0.636	76%	0.759	S	S	*	*			trans	-112	-177	175.8	-89.4	-19.2	0	0	0	109.8
123	D	30.7	Very low	30.8	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	77%	0.767	S	S	*	*			trans	73.9	147.1	166.5	-49.6	-44	0	0	0	114.3
124	E	28.6	Very low	31.1	Very low	178 Å²	178	142 Å²	142	83%	0.832	77%	0.765	S	S	*	*			cis	-137.2	146.7	20.3	-161.8	169.1	-147.4	0	0	112.4
125	V	35.7	Very low	31.5	Very low	125 Å²	125	140.3 Å²	140.3	76%	0.758	77%	0.765	S	S	*	*			trans	-115.6	112.9	175	174.8	0	0	0	0	109.8	H127	V125-H127 PolarHBondContact O-N 3.04Å
126	P	39.3	Very low	31.8	Very low	125 Å²	125	142.8 Å²	142.8	81%	0.812	77%	0.77	S	S	*	*			trans	-75.2	121.1	170.7	-14.9	30.5	0	0	0	110.9
127	H	34.6	Very low	32	Very low	191 Å²	191	143.5 Å²	143.5	88%	0.884	77%	0.774	S	S	*	*			trans	-126	129.1	171.8	-130	-19	0	0	0	109.7	V125	V125-H127 PolarHBondContact O-N 3.04Å
128	G	29.5	Very low	32.2	Very low	63 Å²	63	144.9 Å²	144.9	65%	0.649	78%	0.78	S	S	*	*			trans	119.3	148.9	177.1	0	0	0	0	0	113.4
129	D	28.4	Very low	32.4	Very low	161 Å²	161	142.2 Å²	142.2	86%	0.861	78%	0.779	S	S	*	*			cis	-160.1	140.2	-18.7	-134.7	-26.7	0	0	0	111.3
130	R	31.6	Very low	32.5	Very low	198 Å²	198	144 Å²	144	75%	0.747	79%	0.785	S	S	*	*			trans	27.3	113.9	154.9	-166.1	-173.5	-164.5	109.7	8.9	122.7	E132	R130-E132 IonicContact CZ-OE1 3.13Å; R130-E132 IonicContact NE-OE1 2.75Å; R130-E132 PolarHBondContact NE-OE1 3.47Å; R130-E132 IonicContact NH2-OE1 2.67Å; R130-E132 PolarHBondContact NH2-OE1 3.45Å
131	A	31.1	Very low	32.7	Very low	92 Å²	92	143.9 Å²	143.9	76%	0.76	79%	0.785	S	S	*	*				-163.4	119.1	129.2	0	0	0	0	0	108.1
132	E	37.2	Very low	33	Very low	135 Å²	135	143.9 Å²	143.9	63%	0.631	79%	0.785	S	S	*	*				64.3	96.5	68.3	-72.8	-178.5	-147.6	0	0	114.9	R130	R130-E132 IonicContact CZ-OE1 3.13Å; R130-E132 IonicContact NE-OE1 2.75Å; R130-E132 PolarHBondContact NE-OE1 3.47Å; R130-E132 IonicContact NH2-OE1 2.67Å; R130-E132 PolarHBondContact NH2-OE1 3.45Å
133	N	33.7	Very low	33.1	Very low	170 Å²	170	145.1 Å²	145.1	91%	0.909	79%	0.792	S	S	*	*			trans	-169.1	152.2	138.1	-97.6	-38.9	0	0	0	111.4
134	D	33.3	Very low	33.3	Very low	160 Å²	160	142.8 Å²	142.8	86%	0.856	79%	0.793	S	S	*	*			trans	-83.6	156.8	-175.3	-67.6	-68.1	0	0	0	114.6
135	S	36.1	Very low	33.5	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	80%	0.797	S	S	*	*			trans	-156.4	124.1	144.7	62.3	0	0	0	0	111.3
136	D	31.6	Very low	33.4	Very low	155 Å²	155	145.1 Å²	145.1	83%	0.829	80%	0.801	S	S	*	*			trans	-47.5	142.4	-167.4	-58	-87.3	0	0	0	118.6
137	V	32.8	Very low	33.1	Very low	137 Å²	137	144.9 Å²	144.9	83%	0.83	80%	0.803	S	S	*	*			trans	-93	102.4	159	177.1	0	0	0	0	108.6
138	Q	35.5	Very low	33	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	80%	0.802	S	S	*	*			trans	-78.7	131.6	164	-69.4	-169.1	-95.5	0	0	110
139	N	31.4	Very low	33	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	81%	0.809	S	S	*	*			trans	-128.7	80.8	-175.2	176.1	88	0	0	0	109
140	D	34.3	Very low	33.1	Very low	151 Å²	151	140.7 Å²	140.7	81%	0.807	80%	0.803	S	S	*	*			trans	-92.2	126.1	172.8	-69.3	-45.1	0	0	0	109.8
141	N	33.4	Very low	33.2	Very low	124 Å²	124	139.1 Å²	139.1	66%	0.663	80%	0.804	S	S	*	*			trans	-141.6	98.1	-170.2	172.2	98.3	0	0	0	108.7
142	D	33.6	Very low	33.3	Very low	166 Å²	166	142.7 Å²	142.7	89%	0.888	81%	0.81	S	S	*	*			trans	-114.2	133.8	176.3	-95.5	-40.6	0	0	0	111.8
143	N	33	Very low	33.1	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	82%	0.816	S	S	*	*			trans	-86.8	150.9	174	-68.9	-55.4	0	0	0	110.8
144	A	33.8	Very low	33	Very low	105 Å²	105	142 Å²	142	87%	0.868	82%	0.816	S	S	*	*			trans	-138	141.4	156	0	0	0	0	0	109.2
145	E	34.5	Very low	33	Very low	193 Å²	193	142.7 Å²	142.7	90%	0.902	81%	0.814	S	S	*	*			trans	-101.7	169.8	-163.7	-62.1	-178.1	116.3	0	0	114.4
146	N	32.8	Very low	32.7	Very low	160 Å²	160	142 Å²	142	86%	0.856	81%	0.809	S	S	*	*			trans	-60	154	174.3	-89.8	-6.2	0	0	0	113.9
147	S	32.9	Very low	32.7	Very low	120 Å²	120	141 Å²	141	84%	0.839	80%	0.804	S	S	*	*			trans	-155.3	149.2	140.8	-163.4	0	0	0	0	111.5
148	D	33	Very low	32.5	Very low	161 Å²	161	140.7 Å²	140.7	86%	0.861	80%	0.797	S	S	*	*			trans	-84.6	161.6	-172.2	-61.9	-80	0	0	0	114.6
149	G	29.1	Very low	32.3	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	80%	0.796	S	S	*	*			trans	-164.3	85.6	178	0	0	0	0	0	114.3
150	A	31.6	Very low	32.2	Very low	88 Å²	88	140 Å²	140	73%	0.727	79%	0.794	S	S	*	*			trans	-61.5	145.2	-167.2	0	0	0	0	0	118.2
151	Q	33.2	Very low	32	Very low	165 Å²	165	137.5 Å²	137.5	77%	0.771	78%	0.784	S	S	*	*			trans	40.3	133.6	137.5	-59.3	178.8	-81.6	0	0	121.7
152	N	32.2	Very low	31.9	Very low	167 Å²	167	139.3 Å²	139.3	89%	0.893	79%	0.788	S	S	*	*				-163.8	145	116.4	-95.6	-49.2	0	0	0	111.6
153	D	33.2	Very low	31.7	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	78%	0.782	S	S	*	*			trans	-88.8	161.4	171.3	-60.1	-79.4	0	0	0	111.6
154	V	32.8	Very low	31.7	Very low	148 Å²	148	136 Å²	136	90%	0.897	78%	0.778	S	S	*	*				175.4	148.9	124.7	150.1	0	0	0	0	112.4
155	Q	31.3	Very low	31.6	Very low	173 Å²	173	137.5 Å²	137.5	81%	0.808	78%	0.777	S	S	*	*			trans	-75.6	166.5	-175.7	-93.9	166.5	-101.7	0	0	116.9
156	S	31.6	Very low	31.5	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	77%	0.77	S	S	*	*			trans	67.6	156.1	145.5	76.4	0	0	0	0	118.1
157	D	30.3	Very low	31.4	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	77%	0.77	S	S	*	*			cis	-133.7	146.2	-1.7	-91.5	-57.6	0	0	0	107.8
158	N	29.5	Very low	31.5	Very low	129 Å²	129	136 Å²	136	69%	0.69	77%	0.773	S	S	*	*				67.1	139.8	74.2	-161.8	33.2	0	0	0	116.2
159	E	30.7	Very low	31.6	Very low	164 Å²	164	136.5 Å²	136.5	77%	0.766	77%	0.77	S	S	*	*			trans	66.1	156.5	176.2	-61.2	-164.2	-175.7	0	0	119.2
160	N	28.9	Very low	32	Very low	126 Å²	126	138.9 Å²	138.9	67%	0.674	77%	0.765	S	S	*	*			cis	-166.1	164.1	-38	-167.3	9.6	0	0	0	109.5
161	T	30.4	Very low	32.1	Very low	98 Å²	98	142 Å²	142	60%	0.601	77%	0.769	S	S	*	*			trans	65.3	121.4	153.2	33.1	0	0	0	0	122.4
162	Q	31.5	Very low	32.1	Very low	162 Å²	162	141.4 Å²	141.4	76%	0.757	77%	0.771	S	S	*	*				112.6	115.9	120	-86.8	173	-5.9	0	0	122.2
163	N	29.6	Very low	32.1	Very low	142 Å²	142	139 Å²	139	76%	0.759	76%	0.762	S	S	*	*			trans	67.4	107.4	135.1	-66.7	10.4	0	0	0	121.5
164	S	32	Very low	32.2	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	76%	0.764	S	S	*	*			trans	-53.4	151.1	143.8	178.9	0	0	0	0	112.7
165	V	32.5	Very low	32.3	Very low	138 Å²	138	137.9 Å²	137.9	84%	0.836	75%	0.752	S	S	*	*			trans	-134.8	135.4	153.7	-177.9	0	0	0	0	108.1
166	N	32	Very low	32.3	Very low	144 Å²	144	136.1 Å²	136.1	77%	0.77	75%	0.749	S	S	*	*			trans	-83.3	159.4	-178.3	-45.8	-33.8	0	0	0	112
167	A	31.8	Very low	32.4	Very low	102 Å²	102	138.6 Å²	138.6	84%	0.843	75%	0.754	S	S	*	*			trans	-166.4	135.4	132.7	0	0	0	0	0	111.3
168	E	34.2	Very low	32.6	Very low	194 Å²	194	136.5 Å²	136.5	91%	0.907	76%	0.756	S	S	*	*			trans	-103.5	151.6	161.5	-63.4	172.4	125.5	0	0	108.1
169	H	36.2	Very low	32.5	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.796	77%	0.765	S	S	*	*			trans	-158.6	100.7	167.3	-147.5	23	0	0	0	112.5
170	D	36.1	Very low	32.9	Very low	129 Å²	129	131.5 Å²	131.5	69%	0.69	77%	0.769	S	S	*	*			trans	44.8	165.4	130.7	-55.3	-57.1	0	0	0	124.8
171	D	34.3	Very low	33.1	Very low	152 Å²	152	135.9 Å²	135.9	81%	0.813	78%	0.782	S	S	*	*			trans	76.6	72.2	159.5	-62.8	-17.6	0	0	0	121.8
172	D	32.3	Very low	33.3	Very low	154 Å²	154	142.1 Å²	142.1	82%	0.824	79%	0.794	S	S	*	*				41.9	161.8	103	-146	-0.1	0	0	0	123.5
173	V	32.9	Very low	33.5	Very low	115 Å²	115	143.5 Å²	143.5	70%	0.697	80%	0.801	S	S	*	*			trans	95.4	138	162.7	-170.3	0	0	0	0	120.7
174	H	36.3	Very low	33.5	Very low	175 Å²	175	144.6 Å²	144.6	81%	0.81	81%	0.806	S	S	*	*			trans	-34.8	167.6	174.4	-54	-46.5	0	0	0	119.6
175	S	35	Very low	33.5	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	81%	0.805	S	S	*	*			cis	-168.1	164.2	34.3	-136.4	0	0	0	0	116.6
176	D	31	Very low	33.5	Very low	137 Å²	137	145.8 Å²	145.8	73%	0.733	80%	0.801	S	S	*	*			trans	55.2	111.3	140.1	-71.8	-51	0	0	0	125.5
177	N	33.1	Very low	33.4	Very low	149 Å²	149	145 Å²	145	80%	0.797	80%	0.802	S	S	*	*				88.6	141.8	106.1	-160.3	22	0	0	0	123
178	A	34	Very low	33.5	Very low	92 Å²	92	146.4 Å²	146.4	76%	0.76	80%	0.8	S	S	*	*			trans	62.9	135.7	155	0	0	0	0	0	122.2
179	G	27.9	Very low	34.3	Very low	86 Å²	86	142.5 Å²	142.5	89%	0.887	79%	0.791	S	S	*	*			trans	155.4	99.8	156.9	0	0	0	0	0	115.5
180	A	39.1	Very low	34.3	Very low	102 Å²	102	139.5 Å²	139.5	84%	0.843	79%	0.785	S	S	*	*			trans	-129.5	131.1	173.3	0	0	0	0	0	112.1
181	K	33.8	Very low	34.3	Very low	219 Å²	219	140.8 Å²	140.8	95%	0.952	79%	0.787	S	S	*	*			trans	-162.5	162.4	154.7	-119.2	176.9	-177	-174.3	0	113.3
182	R	34.5	Very low	34.3	Very low	229 Å²	229	139.2 Å²	139.2	86%	0.864	78%	0.778	S	S	*	*			trans	-105.7	170	179.6	-70.1	175.3	169	-169.9	-3.4	111
183	E	34.1	Very low	34.2	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	78%	0.775	S	S	*	*				132.7	121.7	129.9	-71.3	-174.9	148.4	0	0	115.4
184	N	29.9	Very low	34	Very low	165 Å²	165	139.2 Å²	139.2	88%	0.882	78%	0.779	S	S	*	*				-156.6	170.9	119.7	-154.8	2.3	0	0	0	110.4
185	C	32	Very low	35	Very low	98 Å²	98	135.8 Å²	135.8	66%	0.662	77%	0.772	S	S	*	*			trans	-141.5	-166.2	-168.7	-161.6	0	0	0	0	112.8
186	H	32.5	Very low	34.7	Very low	165 Å²	165	141 Å²	141	76%	0.764	78%	0.784	S	S	*	*			trans	81.1	139.9	159.5	-69.8	-0.1	0	0	0	118.4
187	T	29.4	Very low	34.7	Very low	127 Å²	127	141.6 Å²	141.6	78%	0.779	78%	0.782	S	S	*	*			cis	-157.5	-179.4	-16.2	-23.8	0	0	0	0	110.8
188	V	34.2	Very low	35.4	Very low	131 Å²	131	139.7 Å²	139.7	79%	0.794	78%	0.777	S	S	*	*			trans	-118.5	150.4	-179.1	-180	0	0	0	0	112.5
189	P	51.3	Low	35.4	Very low	112 Å²	112	143.2 Å²	143.2	73%	0.727	78%	0.776	S	S	*	*			trans	-143.1	-168.8	140.6	37.8	-21.5	0	0	0	114.6
190	T	36.3	Very low	35.6	Very low	110 Å²	110	147 Å²	147	68%	0.675	77%	0.768	S	S	*	*				-149.9	167	-89.9	-31.7	0	0	0	0	111.7
191	H	35.8	Very low	35.3	Very low	155 Å²	155	147 Å²	147	72%	0.718	75%	0.753	S	S	*	*			trans	84.4	112.8	147.2	-77.4	-52.8	0	0	0	124.4
192	N	34	Very low	35.3	Very low	120 Å²	120	144 Å²	144	64%	0.642	74%	0.743	S	S	*	*				93.8	133.8	113.2	-84.2	41	0	0	0	127.7
193	D	30.4	Very low	35.3	Very low	140 Å²	140	140.4 Å²	140.4	75%	0.749	74%	0.741	S	S	*	*			trans	96	148	133.7	-67	-29.9	0	0	0	125.4
194	T	29.4	Very low	35.1	Very low	128 Å²	128	136.5 Å²	136.5	79%	0.785	73%	0.734	S	S	*	*			trans	-108.9	-158.9	-157.5	29.6	0	0	0	0	112.5
195	P	56.6	Low	35.3	Very low	103 Å²	103	136.2 Å²	136.2	67%	0.669	73%	0.728	S	S	*	*				-130.6	179.1	-51.3	34.1	-18.1	0	0	0	113.7
196	K	30.2	Very low	35.3	Very low	204 Å²	204	137 Å²	137	89%	0.887	73%	0.73	S	S	*	*				174	154.9	127.9	-97.3	162.9	-174.3	173.5	0	117.4
197	E	30.7	Very low	35.3	Very low	148 Å²	148	137.2 Å²	137.2	69%	0.692	73%	0.731	S	S	*	*			trans	-93.2	173.2	171.7	-143.8	-160.9	-126.5	0	0	110.8	K199	E197-K199 WeakPolarHBondContact OE2-CG 3.47Å
198	P	46.3	Very low	35.4	Very low	109 Å²	109	136.5 Å²	136.5	71%	0.708	73%	0.726	S	S	*	*				-161.2	140.3	72.9	40.6	-16.9	0	0	0	121.5
199	K	35.7	Very low	35.3	Very low	167 Å²	167	139.5 Å²	139.5	73%	0.726	73%	0.728	S	S	*	*				70.1	152.5	126	-66.6	-174.9	169	175	0	128.1	E197	E197-K199 WeakPolarHBondContact OE2-CG 3.47Å
200	K	30.6	Very low	34.3	Very low	166 Å²	166	141.1 Å²	141.1	72%	0.722	73%	0.731	S	S	*	*			trans	83.2	144.6	152.5	-71.1	-150.7	158.7	-139.3	0	118
201	N	32.6	Very low	33.9	Very low	100 Å²	100	140.6 Å²	140.6	54%	0.535	73%	0.732	S	S	.	*			cis	-174.6	-177	-9.7	-103.3	9.4	0	0	0	106.8
202	E	34.9	Very low	33.7	Very low	158 Å²	158	139.7 Å²	139.7	74%	0.738	74%	0.737	S	S	*	*			cis	-170.3	161.8	-10.4	-105.9	156.2	174.9	0	0	104.3
203	D	33.9	Very low	33.8	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	75%	0.745	S	S	*	*			cis	-169.9	-177.3	-7.9	-178.9	32.9	0	0	0	108.9
204	S	31	Very low	33.9	Very low	108 Å²	108	143.2 Å²	143.2	76%	0.755	75%	0.753	S	S	*	*			trans	110.4	158	157.8	-153.8	0	0	0	0	119.9
205	H	33.8	Very low	34.1	Very low	160 Å²	160	145.8 Å²	145.8	74%	0.741	76%	0.756	S	S	*	*				-159.5	168.5	-122.1	-152.4	56.9	0	0	0	116.9
206	T	32.6	Very low	32.7	Very low	115 Å²	115	149.1 Å²	149.1	71%	0.706	76%	0.763	S	S	*	*			trans	73.7	159.7	165.4	77.9	0	0	0	0	119
207	H	32.3	Very low	32.7	Very low	169 Å²	169	144.3 Å²	144.3	78%	0.782	75%	0.75	S	S	*	*			cis	-149	-174.8	-6.3	-136.1	-63.3	0	0	0	112.3
208	T	30.6	Very low	32.7	Very low	111 Å²	111	146.6 Å²	146.6	68%	0.681	76%	0.76	S	S	*	*			trans	-108.9	147.7	-161.9	50.7	0	0	0	0	117.1
209	K	32.7	Very low	32	Very low	195 Å²	195	152.3 Å²	152.3	85%	0.848	77%	0.768	S	S	*	*			trans	174.5	140.8	137.6	-96.1	-176.5	173.4	-173.3	0	108.6
210	D	29.7	Very low	31.9	Very low	146 Å²	146	149.7 Å²	149.7	78%	0.781	77%	0.771	S	S	*	*			cis	97.7	108.6	27.1	-174	34.9	0	0	0	114.8
211	S	28.9	Very low	32.4	Very low	99 Å²	99	147.9 Å²	147.9	69%	0.692	78%	0.776	S	S	*	*			trans	166.7	106.3	157.9	173.7	0	0	0	0	110.1
212	T	29.7	Very low	32.3	Very low	135 Å²	135	147.5 Å²	147.5	83%	0.828	79%	0.787	S	S	*	*				94.6	152.3	95.8	-42.4	0	0	0	0	113.8
213	M	37.2	Very low	32.3	Very low	165 Å²	165	144.5 Å²	144.5	81%	0.813	79%	0.789	S	S	*	*			trans	-83.5	164.1	-167	-54.1	172	-178.9	0	0	115
214	D	33.3	Very low	32.3	Very low	170 Å²	170	146 Å²	146	91%	0.909	79%	0.791	S	S	*	*				-147.4	158.9	126.3	-106.9	-33.5	0	0	0	109.7
215	E	32.5	Very low	32.5	Very low	181 Å²	181	148.2 Å²	148.2	85%	0.846	79%	0.793	S	S	*	*			trans	-111.1	177.3	-174.7	-82.1	-149.4	138.4	0	0	114.1
216	E	28	Very low	32.3	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	80%	0.796	S	S	*	*			trans	99.1	102.5	141.9	-147	169.8	-160.6	0	0	119.3
217	V	29.7	Very low	32.1	Very low	102 Å²	102	147 Å²	147	62%	0.618	80%	0.801	S	S	*	*			trans	54.8	120.3	138	178.2	0	0	0	0	119.3
218	H	30.6	Very low	32.5	Very low	197 Å²	197	145.4 Å²	145.4	91%	0.912	80%	0.803	S	S	*	*				-143.1	154.7	111.1	-99.3	-65.1	0	0	0	112
219	R	31.4	Very low	32.6	Very low	228 Å²	228	144.8 Å²	144.8	86%	0.86	80%	0.803	S	S	*	*			trans	-119.6	146.8	-163.8	-169	179.5	-169.3	160.5	1.2	109.2
220	S	33.6	Very low	32.8	Very low	113 Å²	113	142.7 Å²	142.7	79%	0.79	80%	0.801	S	S	*	*			trans	-57.2	159.9	177.1	-36.2	0	0	0	0	112.7
221	P	41.5	Very low	32.9	Very low	127 Å²	127	139.6 Å²	139.6	83%	0.825	80%	0.804	S	S	*	*				-135.9	179.5	100	39.4	-29.9	0	0	0	113.9
222	A	31.1	Very low	32.8	Very low	93 Å²	93	143 Å²	143	77%	0.769	81%	0.814	S	S	*	*			trans	-94.1	169.8	177.9	0	0	0	0	0	112.6
223	A	35.1	Very low	32.9	Very low	95 Å²	95	143.8 Å²	143.8	79%	0.785	81%	0.813	S	S	*	*			trans	-123.1	115.8	149.1	0	0	0	0	0	105
224	E	32.2	Very low	32.7	Very low	183 Å²	183	145.5 Å²	145.5	86%	0.855	82%	0.819	S	S	*	*			cis	68.9	111.1	44.3	-152.9	167.7	-113.1	0	0	111.5
225	I	35.1	Very low	32.6	Very low	155 Å²	155	146 Å²	146	80%	0.795	82%	0.816	S	S	*	*			trans	-108	113.9	-168.8	-51.1	170.5	0	0	0	107.6	V227	I225-V227 PolarHBondContact O-N 3.34Å
226	S	29.6	Very low	32.3	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	81%	0.811	S	S	*	*			trans	-74.2	99.2	-176.5	-52.8	0	0	0	0	112.1
227	V	29.9	Very low	32.4	Very low	133 Å²	133	142.2 Å²	142.2	81%	0.806	81%	0.81	S	S	*	*			trans	-87.9	112.4	166.3	-179.2	0	0	0	0	108.7	I225	I225-V227 PolarHBondContact O-N 3.34Å
228	T	39.8	Very low	32.5	Very low	136 Å²	136	145 Å²	145	83%	0.834	82%	0.816	S	S	*	*			trans	-81.6	127.6	175.4	50	0	0	0	0	110.9
229	S	32.4	Very low	32.5	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	81%	0.806	S	S	*	*			trans	-107.5	138.2	-175.3	-172.9	0	0	0	0	112.4
230	N	36.6	Very low	32.4	Very low	151 Å²	151	135.8 Å²	135.8	81%	0.807	79%	0.794	S	S	*	*			trans	40.8	104.5	154.5	-61	-1.1	0	0	0	120
231	G	31.9	Very low	32.1	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	80%	0.8	S	S	*	*				79	136	102.4	0	0	0	0	0	120.1
232	D	27.9	Very low	31.5	Very low	170 Å²	170	145.2 Å²	145.2	91%	0.909	80%	0.802	S	S	*	*			trans	-146	167.9	150.8	-149.5	-14.2	0	0	0	109.6
233	L	31.9	Very low	31.5	Very low	153 Å²	153	147 Å²	147	80%	0.801	80%	0.798	S	S	*	*			trans	-121.5	140.9	-168.1	-162.3	87.4	0	0	0	111.3
234	E	32.4	Very low	31.9	Very low	201 Å²	201	147.8 Å²	147.8	94%	0.939	80%	0.795	S	S	*	*			trans	-137.5	162	159.5	-114.1	-173.2	-174.7	0	0	111.5
235	E	31	Very low	31.8	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	78%	0.777	S	S	*	*			trans	-125.7	172.3	-149.1	-169.6	176.6	179.3	0	0	113
236	S	26.7	Very low	31.8	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	78%	0.783	S	S	*	*			trans	81.6	148.4	177.7	81.8	0	0	0	0	116.2
237	H	30.2	Very low	31.7	Very low	169 Å²	169	143.9 Å²	143.9	78%	0.782	78%	0.78	S	S	*	*			cis	-139.5	137.8	7.4	-159.3	-74.3	0	0	0	111.2
238	E	31.6	Very low	31.7	Very low	159 Å²	159	144.4 Å²	144.4	74%	0.743	78%	0.779	S	S	*	*			trans	-77	151.7	171.4	-74.9	-83.1	-171.7	0	0	111.3
239	D	29.7	Very low	31.4	Very low	133 Å²	133	144.5 Å²	144.5	71%	0.711	77%	0.773	S	S	*	*				176.7	119.8	123.3	-100.8	-30.4	0	0	0	113.5
240	V	30	Very low	31.2	Very low	100 Å²	100	146.2 Å²	146.2	61%	0.606	78%	0.775	S	S	*	*				38.2	115.6	125.8	-176.1	0	0	0	0	118.2
241	F	28.2	Very low	30.9	Very low	208 Å²	208	145.7 Å²	145.7	91%	0.912	77%	0.771	S	S	*	*				-156.1	158	104.9	-109.5	-72.1	0	0	0	113.3
242	R	28.9	Very low	30.9	Very low	229 Å²	229	146.8 Å²	146.8	86%	0.864	77%	0.766	S	S	*	*			trans	-112.1	146	-173.7	179.1	-177	-71.8	177.6	-2.6	110.9
243	D	30.4	Very low	30.9	Very low	130 Å²	130	146 Å²	146	70%	0.695	76%	0.757	S	S	*	*			trans	-51.9	152.9	171.7	179	59.8	0	0	0	114.2	S245	D243-S245 VanDerWaalsContact CG-N 3.31Å; D243-S245 PolarHBondContact OD1-N 2.88Å; D243-S245 PolarHBondContact OD2-N 3.22Å
244	P	42.5	Very low	30.8	Very low	112 Å²	112	144 Å²	144	73%	0.727	76%	0.756	S	S	*	*				-141.5	115.5	122.5	35.2	-20	0	0	0	116.3
245	S	31.8	Very low	30.6	Very low	68 Å²	68	142.6 Å²	142.6	48%	0.476	75%	0.749	S	S	.	*				50.7	128	120.9	173.3	0	0	0	0	120.5	D243	D243-S245 VanDerWaalsContact CG-N 3.31Å; D243-S245 PolarHBondContact OD1-N 2.88Å; D243-S245 PolarHBondContact OD2-N 3.22Å
246	Y	33.8	Very low	30.5	Very low	231 Å²	231	140.9 Å²	140.9	91%	0.906	74%	0.744	S	S	*	*				-179	144.9	106.2	-102.1	-67.3	0	0	0	114.8
247	G	28.6	Very low	30.5	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	75%	0.746	S	S	*	*			trans	97.7	95.6	164.3	0	0	0	0	0	115.3
248	D	29.5	Very low	30.7	Very low	144 Å²	144	141.8 Å²	141.8	77%	0.77	75%	0.75	S	S	*	*			cis	115.2	157.2	20.7	-170.3	31.4	0	0	0	111.6
249	L	32.5	Very low	30.4	Very low	137 Å²	137	137.8 Å²	137.8	72%	0.717	75%	0.752	S	S	*	*			trans	78.9	125.6	-177.9	-47.1	179.6	0	0	0	115.7
250	N	28.5	Very low	30.3	Very low	134 Å²	134	137.4 Å²	137.4	72%	0.717	76%	0.76	S	S	*	*			cis	-157.3	171.6	-9.5	-145.4	-30.8	0	0	0	112.9
251	L	30.9	Very low	30.4	Very low	139 Å²	139	141.2 Å²	141.2	73%	0.728	77%	0.768	S	S	*	*			trans	-58.1	169.2	-178.4	-64.2	159.8	0	0	0	114.7
252	S	31.9	Very low	30.4	Very low	104 Å²	104	135.9 Å²	135.9	73%	0.727	76%	0.763	S	S	*	*			cis	-150	144	23.4	52.6	0	0	0	0	111.1
253	E	28.6	Very low	30.6	Very low	153 Å²	153	129.2 Å²	129.2	72%	0.715	75%	0.751	S	S	*	*				62.5	116.8	63.5	-164.6	170.2	-142.2	0	0	112.5
254	S	29.1	Very low	30.6	Very low	112 Å²	112	131.2 Å²	131.2	78%	0.783	76%	0.758	S	S	*	*				-153.8	164.1	75.7	55.8	0	0	0	0	117.4
255	H	27.5	Very low	30.1	Very low	172 Å²	172	131.3 Å²	131.3	80%	0.796	76%	0.757	S	S	*	*			trans	-82.1	177.2	176.2	-64.7	-40.5	0	0	0	112.8
256	I	30	Very low	30.2	Very low	142 Å²	142	137.1 Å²	137.1	73%	0.728	78%	0.777	S	S	*	*				-170.8	144.5	68	-82.1	-172	0	0	0	113.9
257	H	26.1	Very low	30.1	Very low	171 Å²	171	129.7 Å²	129.7	79%	0.792	77%	0.77	S	S	*	*			trans	43.9	111.1	159.5	-62.2	-33.2	0	0	0	124.6
258	S	33.7	Very low	30.2	Very low	126 Å²	126	133.8 Å²	133.8	88%	0.881	77%	0.773	S	S	*	*				28.4	135	105.3	-163.2	0	0	0	0	121.4
259	G	26.3	Very low	30.3	Very low	75 Å²	75	134.6 Å²	134.6	77%	0.773	78%	0.775	S	S	*	*			trans	-153.1	142.3	165	0	0	0	0	0	111.8
260	S	28.1	Very low	30.2	Very low	125 Å²	125	132.5 Å²	132.5	87%	0.874	78%	0.777	S	S	*	*			trans	-85	159.7	-163.3	-165	0	0	0	0	116.4
261	F	31.2	Very low	30.3	Very low	180 Å²	180	131.8 Å²	131.8	79%	0.789	78%	0.783	S	S	*	*			trans	-52.2	141.8	171.1	177.5	-87.8	0	0	0	114.7
262	A	28.2	Very low	30.3	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	77%	0.774	S	S	*	*			trans	-148.7	140.8	159.8	0	0	0	0	0	109.8
263	S	33.1	Very low	30.4	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	78%	0.781	S	S	*	*			trans	-119	129.5	-176.5	177.3	0	0	0	0	111
264	M	30.1	Very low	30.3	Very low	172 Å²	172	132.2 Å²	132.2	85%	0.847	79%	0.788	S	S	*	*			trans	-145	105	174.1	-67.4	-65.5	-78.6	0	0	111.4
265	T	33	Very low	30.3	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.693	79%	0.792	S	S	*	*			trans	23.5	120.5	141.2	53.9	0	0	0	0	121.1
266	E	33.8	Very low	30.4	Very low	191 Å²	191	135 Å²	135	89%	0.893	80%	0.795	S	S	*	*				62	130.7	124.8	-158.9	168.4	-137.7	0	0	121
267	G	30.4	Very low	30.4	Very low	74 Å²	74	133.7 Å²	133.7	76%	0.763	80%	0.799	S	S	*	*			trans	178.2	84.8	174.6	0	0	0	0	0	114.8
268	I	30.6	Very low	30.5	Very low	161 Å²	161	130.2 Å²	130.2	83%	0.826	80%	0.8	S	S	*	*			trans	-86.6	118.4	172.2	-63.8	171.3	0	0	0	109.8
269	I	33.5	Very low	30.3	Very low	161 Å²	161	130 Å²	130	83%	0.826	80%	0.798	S	S	*	*			trans	-138.7	129.2	160.5	-57.2	-178.9	0	0	0	109
270	A	30.5	Very low	30.7	Very low	92 Å²	92	135 Å²	135	76%	0.76	80%	0.801	S	S	*	*			trans	-126.4	125.4	169	0	0	0	0	0	109.9
271	S	30.5	Very low	30.9	Very low	119 Å²	119	134.7 Å²	134.7	83%	0.832	80%	0.796	S	S	*	*			trans	171.7	153.4	154.3	43.2	0	0	0	0	112.6
272	G	30.5	Very low	30.8	Very low	53 Å²	53	131.8 Å²	131.8	55%	0.546	79%	0.793	S	S	.	*			trans	102.6	117.7	152.5	0	0	0	0	0	117.1
273	P	33.6	Very low	30.9	Very low	135 Å²	135	132.9 Å²	132.9	88%	0.877	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-80.7	126.4	171.4	32.2	-32.3	0	0	0	111.4
274	Y	26.1	Very low	31.1	Very low	217 Å²	217	134.2 Å²	134.2	85%	0.851	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-86.1	129.4	177.8	17.7	-86.5	0	0	0	111.6
275	K	29.6	Very low	31.1	Very low	201 Å²	201	133 Å²	133	87%	0.874	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.7	130.6	177	-70	179.2	174.9	-179.7	0	111	S277	K275-S277 PolarHBondContact O-N 3.05Å
276	V	29.1	Very low	31.1	Very low	141 Å²	141	131.4 Å²	131.4	86%	0.855	80%	0.802	S	S	*	*			trans	-80.7	113	163.8	178.4	0	0	0	0	108.6
277	S	30	Very low	31.1	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	80%	0.8	S	S	*	*			trans	-80.5	118.7	167.7	-69.1	0	0	0	0	109.4	K275	K275-S277 PolarHBondContact O-N 3.05Å
278	A	27.9	Very low	31.2	Very low	98 Å²	98	131.6 Å²	131.6	81%	0.81	80%	0.804	S	S	*	*			trans	-78.2	143.3	179.7	0	0	0	0	0	112.3
279	S	30.4	Very low	31.4	Very low	121 Å²	121	127.8 Å²	127.8	85%	0.846	80%	0.796	S	S	*	*			trans	-128	120.5	159.4	52	0	0	0	0	108.7
280	Q	34.9	Very low	31.4	Very low	180 Å²	180	126.6 Å²	126.6	84%	0.841	80%	0.799	S	S	*	*			trans	-129.5	136.9	-172.5	-159.9	-172.6	33.5	0	0	109.5
281	P	31	Very low	31.5	Very low	119 Å²	119	127.5 Å²	127.5	77%	0.773	80%	0.8	S	S	*	*			trans	-112.1	94.6	160	32.7	-22.1	0	0	0	111.1
282	T	30.1	Very low	32.2	Very low	119 Å²	119	128.1 Å²	128.1	73%	0.73	80%	0.804	S	S	*	*			trans	29.6	136.6	142.2	56.1	0	0	0	0	122.8
283	S	30.6	Very low	32.5	Very low	119 Å²	119	129.9 Å²	129.9	83%	0.832	81%	0.813	S	S	*	*			trans	97.4	146.8	147.3	-68.9	0	0	0	0	119.4
284	P	36.1	Very low	32.5	Very low	118 Å²	118	128.7 Å²	128.7	77%	0.766	82%	0.815	S	S	*	*			trans	-121.3	162.6	-147.6	40.2	-26.5	0	0	0	115.4
285	V	30.4	Very low	32.8	Very low	147 Å²	147	122.5 Å²	122.5	89%	0.891	81%	0.808	S	S	*	*			trans	-128.5	133.9	159.9	-179.9	0	0	0	0	108
286	A	33.5	Very low	33.1	Very low	78 Å²	78	118.7 Å²	118.7	65%	0.645	81%	0.807	S	S	*	*			trans	-83.3	150.7	-175.2	0	0	0	0	0	112.6
287	P	33.4	Very low	33.5	Very low	131 Å²	131	123.9 Å²	123.9	85%	0.851	81%	0.811	S	S	*	*			trans	-73.4	132.5	174.1	30.7	-33.9	0	0	0	111.1
288	V	33.6	Very low	33.7	Very low	139 Å²	139	126.9 Å²	126.9	84%	0.842	82%	0.818	S	S	*	*			trans	-111.6	126.4	174.4	179.9	0	0	0	0	109.2
289	A	34.4	Very low	34	Very low	80 Å²	80	126.9 Å²	126.9	66%	0.661	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.9	149.7	179.1	0	0	0	0	0	112.1	S291	A289-S291 PolarHBondContact O-N 3.46Å
290	P	32.4	Very low	34.5	Very low	136 Å²	136	132.7 Å²	132.7	88%	0.883	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-70.9	121.9	179.6	28.8	-34.3	0	0	0	111.4
291	S	34.3	Very low	35	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-98.6	146.4	174.4	58.2	0	0	0	0	112.1	A289 A293	A289-S291 PolarHBondContact O-N 3.46Å; S291-A293 PolarHBondContact O-N 2.87Å; S291-A293 VanDerWaalsContact O-N 3.17Å
292	S	44.8	Very low	35.2	Very low	132 Å²	132	131 Å²	131	92%	0.923	82%	0.816	S	S	*	*	S	Bend	trans	-76.8	100	-172.6	171.2	0	0	0	0	112.8
293	A	35.5	Very low	35.4	Very low	89 Å²	89	131 Å²	131	74%	0.736	82%	0.821	S	S	*	*			trans	-145.7	32.7	174.7	0	0	0	0	0	114.4	S291 A295	S291-A293 PolarHBondContact O-N 2.87Å; S291-A293 VanDerWaalsContact O-N 3.17Å; A293-A295 PolarHBondContact O-N 3.42Å
294	A	33.6	Very low	35.4	Very low	111 Å²	111	132.7 Å²	132.7	92%	0.917	82%	0.821	S	S	*	*			trans	-92.9	53	-174.3	0	0	0	0	0	114.4
295	A	33.5	Very low	35.4	Very low	86 Å²	86	132.7 Å²	132.7	71%	0.711	82%	0.824	S	S	*	*			trans	-147.1	143.1	170.7	0	0	0	0	0	111.5	A293	A293-A295 PolarHBondContact O-N 3.42Å
296	S	34.8	Very low	35.6	Very low	122 Å²	122	134.5 Å²	134.5	85%	0.853	82%	0.822	S	S	*	*			trans	81.4	61.1	177.6	-45.3	0	0	0	0	118.2
297	R	38.2	Very low	35.5	Very low	249 Å²	249	137.6 Å²	137.6	94%	0.94	83%	0.834	S	S	*	*			trans	-138.5	60.2	161.3	-74.9	-160.5	175	-143.5	-0.7	114.7
298	L	35	Very low	35.4	Very low	179 Å²	179	140.1 Å²	140.1	94%	0.937	83%	0.834	S	S	*	*			trans	-137.8	79.3	165.1	-76.3	178.8	0	0	0	111.2
299	A	33.9	Very low	35.3	Very low	98 Å²	98	142 Å²	142	81%	0.81	84%	0.837	S	S	*	*			trans	167.7	92.4	152.9	0	0	0	0	0	112.1
300	R	40.5	Very low	35.1	Very low	243 Å²	243	145.8 Å²	145.8	92%	0.917	84%	0.841	S	S	*	*			trans	-169.2	124.1	150.5	-121.2	174.2	-179.5	157.7	1.1	111.8
301	P	46.3	Very low	35.1	Very low	119 Å²	119	148.5 Å²	148.5	77%	0.773	84%	0.839	S	S	*	*			trans	-70.9	160.7	157.6	-10.3	27.4	0	0	0	110.4
302	I	33.5	Very low	34.8	Very low	143 Å²	143	146.6 Å²	146.6	73%	0.733	84%	0.837	S	S	*	*			trans	-85.6	147.4	171.2	-65.2	163.8	0	0	0	108.8	D304	I302-D304 WeakPolarHBondContact CG2-OD2 3.01Å
303	S	35.4	Very low	34	Very low	119 Å²	119	146.4 Å²	146.4	83%	0.832	83%	0.831	S	S	*	*			trans	-133	110	166.7	-64	0	0	0	0	108.6
304	D	31	Very low	33.8	Very low	155 Å²	155	148.9 Å²	148.9	83%	0.829	83%	0.829	S	S	*	*			trans	-99.5	123.7	175.9	-74.1	-53.1	0	0	0	110.4	I302	I302-D304 WeakPolarHBondContact CG2-OD2 3.01Å
305	S	34.6	Very low	33.6	Very low	119 Å²	119	152.5 Å²	152.5	83%	0.832	83%	0.827	S	S	*	*			trans	-155.7	125.7	162.7	60.4	0	0	0	0	109.2
306	Q	34.6	Very low	33.4	Very low	184 Å²	184	152.2 Å²	152.2	86%	0.86	83%	0.833	S	S	*	*			trans	-85.9	153.8	-167.1	-59.4	160.8	-34.6	0	0	113
307	T	31.5	Very low	33.1	Very low	144 Å²	144	155.5 Å²	155.5	88%	0.883	84%	0.835	S	S	*	*				176.8	153.3	112.2	28.4	0	0	0	0	112.3
308	E	31.9	Very low	33.5	Very low	183 Å²	183	148.6 Å²	148.6	86%	0.855	82%	0.822	S	S	*	*			trans	-93.1	155.2	171.6	-60.5	-175.3	111.4	0	0	112.2
309	I	32.3	Very low	33.3	Very low	179 Å²	179	149.7 Å²	149.7	92%	0.918	82%	0.822	S	S	*	*			trans	-168.1	159.3	136.6	-101.5	155.1	0	0	0	109.3
310	Q	30.5	Very low	33.2	Very low	159 Å²	159	151 Å²	151	74%	0.743	83%	0.825	S	S	*	*			trans	-123.5	156.1	-157.6	-156	-169.8	85.1	0	0	114.3
311	K	30.7	Very low	32.9	Very low	193 Å²	193	142.7 Å²	142.7	84%	0.839	82%	0.815	S	S	*	*			trans	81.2	137.6	164.5	-59.4	-179.6	177.1	173	0	119.6
312	G	28.4	Very low	32.6	Very low	72 Å²	72	143.4 Å²	143.4	74%	0.742	82%	0.82	S	S	*	*			trans	159.2	135.9	164.5	0	0	0	0	0	111.8
313	T	28.6	Very low	33.3	Very low	128 Å²	128	143.3 Å²	143.3	79%	0.785	83%	0.826	S	S	*	*			trans	-143.7	151.6	-171.7	-27	0	0	0	0	113.4
314	M	31.3	Very low	33.6	Very low	142 Å²	142	143.8 Å²	143.8	70%	0.7	82%	0.824	S	S	*	*			trans	85.9	118.7	161.7	-65.2	-70.5	102.2	0	0	121.2
315	Q	29.9	Very low	33.9	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	82%	0.821	S	S	*	*			trans	57.4	128.8	133.3	-65.8	-178.9	-20.4	0	0	122.9
316	G	28.8	Very low	34.2	Very low	81 Å²	81	142.5 Å²	142.5	84%	0.835	82%	0.82	S	S	*	*			trans	176.6	140.9	161.8	0	0	0	0	0	111.5
317	Q	28.1	Very low	34.8	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	82%	0.817	S	S	*	*			trans	-131	-178.9	-177.2	-131.9	-163.3	-53.2	0	0	111.2
318	P	46.1	Very low	35.8	Very low	103 Å²	103	139.4 Å²	139.4	67%	0.669	80%	0.804	S	S	*	*				-115.4	161.1	-116.9	39.9	-25.7	0	0	0	115.5
319	Q	31	Very low	36.8	Very low	202 Å²	202	138.6 Å²	138.6	94%	0.944	81%	0.805	S	S	*	*			trans	-145.2	164.6	160.3	-74.8	-155.1	-4.1	0	0	113.4
320	S	32.3	Very low	38.2	Very low	125 Å²	125	135.3 Å²	135.3	87%	0.874	78%	0.784	S	S	*	*			trans	-57.8	153.8	-169.5	-71.1	0	0	0	0	117.1
321	G	34.8	Very low	40.5	Very low	69 Å²	69	131.7 Å²	131.7	71%	0.711	77%	0.77	S	S	*	*			trans	-78.8	-172	172.2	0	0	0	0	0	115
322	P	39.3	Very low	43	Very low	134 Å²	134	126.4 Å²	126.4	87%	0.87	76%	0.755	S	S	*	*				-124.5	174.9	92.2	38.5	-35.2	0	0	0	114.7
323	V	48.1	Very low	45.6	Very low	142 Å²	142	125.8 Å²	125.8	86%	0.861	74%	0.743	S	S	*	*			trans	-74.9	127.1	-173.6	176.7	0	0	0	0	112.7
324	V	41.4	Very low	48.3	Very low	129 Å²	129	124.8 Å²	124.8	78%	0.782	73%	0.731	S	S	*	*			trans	-136.1	124	151	-178.3	0	0	0	0	108.4
325	L	38.5	Very low	51	Low	148 Å²	148	123 Å²	123	78%	0.775	72%	0.72	S	S	*	*			trans	21.5	109.4	162.8	-54.6	177.4	0	0	0	118.2	D327	L325-D327 PolarHBondContact O-N 3.21Å
326	A	39.8	Very low	53.7	Low	98 Å²	98	121.1 Å²	121.1	81%	0.81	71%	0.71	S	S	*	*			trans	-77.8	100.6	160.2	0	0	0	0	0	109.5
327	D	47	Very low	56.7	Low	151 Å²	151	122 Å²	122	81%	0.807	70%	0.695	S	S	*	*			trans	-67.3	150.4	169.4	-99.1	-39.9	0	0	0	111.8	L325 L329	L325-D327 PolarHBondContact O-N 3.21Å; D327-L329 PolarHBondContact O-N 2.88Å
328	D	52	Low	59.7	Low	112 Å²	112	116 Å²	116	60%	0.599	67%	0.669	S	S	*	*			trans	58.8	39.1	161.4	-126.4	18.5	0	0	0	118.4	K330	D328-K330 PolarHBondContact O-N 3.45Å; D328-K330 VanDerWaalsContact OD1-CE 3.25Å; D328-K330 WeakPolarHBondContact OD1-CE 3.32Å; D328-K330 VanDerWaalsContact OD1-CG 3.25Å; D328-K330 WeakPolarHBondContact OD1-CG 3.48Å; D328-K330 IonicContact OD1-NZ 3.45Å; D328-K330 PolarHBondContact OD1-NZ 3.36Å; D328-K330 IonicContact OD2-NZ 2.78Å; D328-K330 PolarHBondContact OD2-NZ 3.08Å
329	L	53.7	Low	61.8	Low	167 Å²	167	116.9 Å²	116.9	87%	0.874	67%	0.667	S	S	*	*			trans	-71.3	80.4	145.8	-119.4	80.8	0	0	0	109.2	D327 N331	D327-L329 PolarHBondContact O-N 2.88Å; L329-N331 PolarHBondContact O-N 3.48Å
330	K	61.5	Low	64.7	Low	109 Å²	109	111.7 Å²	111.7	47%	0.474	65%	0.649	S	S	.	*			trans	-60.7	102	171.5	-70.9	-166.6	174.1	94	0	109.6	D328 P332 E335	D328-K330 PolarHBondContact O-N 3.45Å; D328-K330 VanDerWaalsContact OD1-CE 3.25Å; D328-K330 WeakPolarHBondContact OD1-CE 3.32Å; D328-K330 VanDerWaalsContact OD1-CG 3.25Å; D328-K330 WeakPolarHBondContact OD1-CG 3.48Å; D328-K330 IonicContact OD1-NZ 3.45Å; D328-K330 PolarHBondContact OD1-NZ 3.36Å; D328-K330 IonicContact OD2-NZ 2.78Å; D328-K330 PolarHBondContact OD2-NZ 3.08Å; K330-P332 VanDerWaalsContact O-CD 3.3Å; K330-P332 WeakPolarHBondContact O-CD 3.22Å; K330-E335 HydrophobicContact CB-CG 4.32Å
331	N	79.8	Confident	67.6	Low	84 Å²	84	111.6 Å²	111.6	45%	0.449	63%	0.629	S	S	.	*			trans	-58.9	120.4	177.5	175.7	-4.8	0	0	0	109.2	L329 A333 M334 E335	L329-N331 PolarHBondContact O-N 3.48Å; N331-A333 PolarHBondContact O-N 3.39Å; N331-A333 WeakPolarHBondContact OD1-CB 3.45Å; N331-A333 PolarHBondContact OD1-N 2.97Å; N331-M334 HydrophobicContact CB-CE 4.18Å; N331-M334 HydrophobicContact CB-CG 4.06Å; N331-M334 WeakPolarHBondContact O-CB 3.48Å; N331-M334 PolarHBondContact O-N 2.72Å; N331-E335 PolarHBondContact O-N 3.01Å
332	P	82.9	Confident	70.3	Confident	81 Å²	81	114.9 Å²	114.9	53%	0.526	62%	0.624	S	S	.	*	H	α-helix	trans	-59	-17.8	-178.9	-27.2	36.3	0	0	0	114.6	K330 K336	K330-P332 VanDerWaalsContact O-CD 3.3Å; K330-P332 WeakPolarHBondContact O-CD 3.22Å; P332-K336 VanDerWaalsContact O-CG 3.28Å; P332-K336 WeakPolarHBondContact O-CG 3.46Å; P332-K336 PolarHBondContact O-N 3.5Å
333	A	83.1	Confident	72.8	Confident	60 Å²	60	115.5 Å²	115.5	50%	0.496	61%	0.609	S	S	.	*	H	α-helix	trans	-71.9	-35.1	170.5	0	0	0	0	0	112.8	N331 L337	N331-A333 PolarHBondContact O-N 3.39Å; N331-A333 WeakPolarHBondContact OD1-CB 3.45Å; N331-A333 PolarHBondContact OD1-N 2.97Å; A333-L337 WeakPolarHBondContact O-CB 3.34Å; A333-L337 PolarHBondContact O-N 3.1Å
334	M	84.7	Confident	75	Confident	107 Å²	107	111.2 Å²	111.2	53%	0.527	59%	0.585	S	S	.	*	H	α-helix	trans	-72.3	-42	176.4	-61.6	-166.5	-44.3	0	0	111.1	N331 K336 L337 D338	N331-M334 HydrophobicContact CB-CE 4.18Å; N331-M334 HydrophobicContact CB-CG 4.06Å; N331-M334 WeakPolarHBondContact O-CB 3.48Å; N331-M334 PolarHBondContact O-N 2.72Å; M334-K336 VanDerWaalsContact C-N 3.28Å; M334-K336 PolarHBondContact O-N 3.39Å; M334-L337 PolarHBondContact O-N 2.86Å; M334-L337 VanDerWaalsContact O-N 3.1Å; M334-D338 WeakPolarHBondContact O-CB 3.39Å; M334-D338 PolarHBondContact O-N 3.17Å
335	E	88.6	Confident	77.5	Confident	103 Å²	103	109 Å²	109	48%	0.481	57%	0.568	S	S	.	*	H	α-helix	trans	-59.7	-39.7	175.5	-60.8	-169.4	144.7	0	0	112	K330 N331 L339	K330-E335 HydrophobicContact CB-CG 4.32Å; N331-E335 PolarHBondContact O-N 3.01Å; E335-L339 WeakPolarHBondContact O-CB 3.43Å; E335-L339 PolarHBondContact O-N 3.21Å
336	K	86.7	Confident	80.1	Confident	148 Å²	148	103.3 Å²	103.3	64%	0.643	54%	0.539	S	S	*	.	H	α-helix	trans	-65.6	-41.8	173	-74.3	175.3	-178.9	-175.7	0	112.5	P332 M334 L339 V340	P332-K336 VanDerWaalsContact O-CG 3.28Å; P332-K336 WeakPolarHBondContact O-CG 3.46Å; P332-K336 PolarHBondContact O-N 3.5Å; M334-K336 VanDerWaalsContact C-N 3.28Å; M334-K336 PolarHBondContact O-N 3.39Å; K336-L339 PolarHBondContact O-N 3.17Å; K336-V340 WeakPolarHBondContact O-CG2 3.49Å; K336-V340 PolarHBondContact O-N 3.09Å
337	L	91.9	Very high	82.7	Confident	100 Å²	100	99.9 Å²	99.9	52%	0.524	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-42.5	177	-170.5	158.7	0	0	0	111.2	A333 M334 V340 R341	A333-L337 WeakPolarHBondContact O-CB 3.34Å; A333-L337 PolarHBondContact O-N 3.1Å; M334-L337 PolarHBondContact O-N 2.86Å; M334-L337 VanDerWaalsContact O-N 3.1Å; L337-V340 PolarHBondContact O-N 3.32Å; L337-R341 PolarHBondContact O-N 2.82Å
338	D	90.1	Very high	85.1	Confident	65 Å²	65	99.9 Å²	99.9	35%	0.348	50%	0.497	S	S	.	.	H	α-helix	trans	-67.5	-36.2	176.7	-73.1	-10.4	0	0	0	112.1	M334 R341 K342	M334-D338 WeakPolarHBondContact O-CB 3.39Å; M334-D338 PolarHBondContact O-N 3.17Å; D338-R341 PolarHBondContact O-N 3.05Å; D338-R341 IonicContact OD1-CZ 3.62Å; D338-R341 IonicContact OD1-NH1 3.55Å; D338-R341 PolarHBondContact OD1-NH1 2.85Å; D338-R341 IonicContact OD1-NH2 3.63Å; D338-R341 PolarHBondContact OD1-NH2 3.3Å; D338-K342 WeakPolarHBondContact O-CB 3.49Å; D338-K342 WeakPolarHBondContact O-CG 3.4Å; D338-K342 PolarHBondContact O-N 2.98Å
339	L	90.6	Very high	87.2	Confident	121 Å²	121	95.9 Å²	95.9	63%	0.634	48%	0.475	S	S	*	.	H	α-helix	trans	-63.3	-45	171.3	-177.9	63.1	0	0	0	111.5	E335 K336 R341 K342 W343	E335-L339 WeakPolarHBondContact O-CB 3.43Å; E335-L339 PolarHBondContact O-N 3.21Å; K336-L339 PolarHBondContact O-N 3.17Å; L339-R341 VanDerWaalsContact C-N 3.34Å; L339-R341 PolarHBondContact O-N 3.18Å; L339-K342 PolarHBondContact O-N 3.45Å; L339-W343 WeakPolarHBondContact O-CB 3.31Å; L339-W343 PolarHBondContact O-N 2.86Å
340	V	92.2	Very high	89.2	Confident	92 Å²	92	88.8 Å²	88.8	56%	0.558	44%	0.439	S	S	*	.	H	α-helix	trans	-62.7	-39.2	174.8	170.1	0	0	0	0	111.4	K336 L337 W343 S344	K336-V340 WeakPolarHBondContact O-CG2 3.49Å; K336-V340 PolarHBondContact O-N 3.09Å; L337-V340 PolarHBondContact O-N 3.32Å; V340-W343 PolarHBondContact O-N 2.84Å; V340-S344 WeakPolarHBondContact O-CB 3.29Å; V340-S344 PolarHBondContact O-N 3.36Å; V340-S344 PolarHBondContact O-OG 3.31Å
341	R	92.9	Very high	90.9	Very high	123 Å²	123	85.7 Å²	85.7	46%	0.464	43%	0.429	S	S	.	.	H	α-helix	trans	-66.1	-43.5	175.5	-163.5	-167.4	-59.5	103.4	-0.9	112	L337 D338 L339 S344 I345	L337-R341 PolarHBondContact O-N 2.82Å; D338-R341 PolarHBondContact O-N 3.05Å; D338-R341 IonicContact OD1-CZ 3.62Å; D338-R341 IonicContact OD1-NH1 3.55Å; D338-R341 PolarHBondContact OD1-NH1 2.85Å; D338-R341 IonicContact OD1-NH2 3.63Å; D338-R341 PolarHBondContact OD1-NH2 3.3Å; L339-R341 VanDerWaalsContact C-N 3.34Å; L339-R341 PolarHBondContact O-N 3.18Å; R341-S344 PolarHBondContact O-OG 3.22Å; R341-I345 HydrophobicContact CG-CD1 4.06Å; R341-I345 WeakPolarHBondContact O-CB 3.34Å; R341-I345 WeakPolarHBondContact O-CD1 3.29Å; R341-I345 VanDerWaalsContact O-CG1 3.26Å; R341-I345 WeakPolarHBondContact O-CG1 3.46Å; R341-I345 PolarHBondContact O-N 2.96Å; R341-I345 VanDerWaalsContact O-N 3.12Å
342	K	90.6	Very high	91.7	Very high	139 Å²	139	84.7 Å²	84.7	60%	0.604	42%	0.419	S	S	*	.	H	α-helix	trans	-62.7	-44.3	175.7	-75.1	173.6	-179.5	179.6	0	111	D338 L339 N346	D338-K342 WeakPolarHBondContact O-CB 3.49Å; D338-K342 WeakPolarHBondContact O-CG 3.4Å; D338-K342 PolarHBondContact O-N 2.98Å; L339-K342 PolarHBondContact O-N 3.45Å; K342-N346 WeakPolarHBondContact O-CB 3.28Å; K342-N346 PolarHBondContact O-N 2.93Å
343	W	92.1	Very high	92.4	Very high	147 Å²	147	81.1 Å²	81.1	56%	0.557	40%	0.395	S	S	*	.	H	α-helix	trans	-60.2	-51.1	175.9	174.3	81	0	0	0	111.9	L339 V340 I345 N346 T347	L339-W343 WeakPolarHBondContact O-CB 3.31Å; L339-W343 PolarHBondContact O-N 2.86Å; V340-W343 PolarHBondContact O-N 2.84Å; W343-I345 VanDerWaalsContact C-N 3.31Å; W343-I345 PolarHBondContact O-N 3.32Å; W343-N346 WeakPolarHBondContact O-CB 3.3Å; W343-N346 PolarHBondContact O-N 3.39Å; W343-N346 VanDerWaalsContact O-N 3.13Å; W343-T347 WeakPolarHBondContact O-CB 3.5Å; W343-T347 PolarHBondContact O-N 3.03Å; W343-T347 PolarHBondContact O-OG1 3.29Å
344	S	95.6	Very high	93	Very high	52 Å²	52	80.6 Å²	80.6	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-64.9	-34.4	-177.6	65	0	0	0	0	113	V340 R341 Y348	V340-S344 WeakPolarHBondContact O-CB 3.29Å; V340-S344 PolarHBondContact O-N 3.36Å; V340-S344 PolarHBondContact O-OG 3.31Å; R341-S344 PolarHBondContact O-OG 3.22Å; S344-Y348 WeakPolarHBondContact O-CB 2.82Å; S344-Y348 PolarHBondContact O-N 3.24Å
345	I	93.6	Very high	93.5	Very high	81 Å²	81	79.6 Å²	79.6	42%	0.415	38%	0.38	S	S	.	.	H	α-helix	trans	-65.8	-47	171.7	-68.1	168.4	0	0	0	110.9	R341 W343 Y348 K349	R341-I345 HydrophobicContact CG-CD1 4.06Å; R341-I345 WeakPolarHBondContact O-CB 3.34Å; R341-I345 WeakPolarHBondContact O-CD1 3.29Å; R341-I345 VanDerWaalsContact O-CG1 3.26Å; R341-I345 WeakPolarHBondContact O-CG1 3.46Å; R341-I345 PolarHBondContact O-N 2.96Å; R341-I345 VanDerWaalsContact O-N 3.12Å; W343-I345 VanDerWaalsContact C-N 3.31Å; W343-I345 PolarHBondContact O-N 3.32Å; I345-Y348 PolarHBondContact O-N 3.46Å; I345-K349 HydrophobicContact CG2-CD 4.1Å; I345-K349 WeakPolarHBondContact O-CB 3.5Å; I345-K349 VanDerWaalsContact O-CG 3.3Å; I345-K349 WeakPolarHBondContact O-CG 3.11Å; I345-K349 PolarHBondContact O-N 3.46Å
346	N	93.6	Very high	93.9	Very high	30 Å²	30	76.4 Å²	76.4	16%	0.16	37%	0.369	C	S	.	.	H	α-helix	trans	-59.6	-48.3	177.4	-172	50.4	0	0	0	111.3	K342 W343 Y348 K349 C350 E478 Y482	K342-N346 WeakPolarHBondContact O-CB 3.28Å; K342-N346 PolarHBondContact O-N 2.93Å; W343-N346 WeakPolarHBondContact O-CB 3.3Å; W343-N346 PolarHBondContact O-N 3.39Å; W343-N346 VanDerWaalsContact O-N 3.13Å; N346-Y348 PolarHBondContact O-N 3.48Å; N346-K349 WeakPolarHBondContact O-CB 3.13Å; N346-K349 PolarHBondContact O-N 3Å; N346-C350 WeakPolarHBondContact O-CB 3.46Å; N346-C350 PolarHBondContact O-N 2.86Å; N346-C350 PolarHBondContact O-SG 3.39Å; N346-E478 PolarHBondContact ND2-OE1 2.88Å; N346-E478 VanDerWaalsContact ND2-OE1 3.08Å; N346-Y482 WeakPolarHBondContact OD1-CE2 3.3Å
347	T	94.6	Very high	94.3	Very high	25 Å²	25	71 Å²	71	15%	0.153	35%	0.346	C	S	.	.	H	α-helix	trans	-58.8	-45.3	176.7	-68	0	0	0	0	112	L38 W343 C350 T351	L38-T347 HydrophobicContact CD1-CG2 4.15Å; L38-T347 HydrophobicContact CD2-CG2 3.39Å; L38-T347 HydrophobicContact CG-CG2 4.43Å; W343-T347 WeakPolarHBondContact O-CB 3.5Å; W343-T347 PolarHBondContact O-N 3.03Å; W343-T347 PolarHBondContact O-OG1 3.29Å; T347-C350 PolarHBondContact O-N 3.35Å; T347-T351 WeakPolarHBondContact O-CB 3.36Å; T347-T351 PolarHBondContact O-N 3.1Å; T347-T351 PolarHBondContact O-OG1 3.46Å
348	Y	96.8	Very high	94.4	Very high	152 Å²	152	72.3 Å²	72.3	60%	0.596	35%	0.347	S	S	*	.	H	α-helix	trans	-61.1	-47.4	175.6	171.3	-99.7	0	0	0	112	S344 I345 N346 C350 T351 R352	S344-Y348 WeakPolarHBondContact O-CB 2.82Å; S344-Y348 PolarHBondContact O-N 3.24Å; I345-Y348 PolarHBondContact O-N 3.46Å; N346-Y348 PolarHBondContact O-N 3.48Å; Y348-C350 PolarHBondContact O-N 3.3Å; Y348-T351 PolarHBondContact O-N 2.9Å; Y348-R352 WeakPolarHBondContact O-CB 3.4Å; Y348-R352 PolarHBondContact O-N 3.3Å
349	K	95.6	Very high	94.6	Very high	28 Å²	28	74.8 Å²	74.8	12%	0.122	36%	0.36	C	S	.	.	H	α-helix	trans	-57.2	-50.2	176.9	-74.2	171.5	167.1	-122.8	0	111.7	I345 N346 T351 R352 Q353 A481 Y482 D485	I345-K349 HydrophobicContact CG2-CD 4.1Å; I345-K349 WeakPolarHBondContact O-CB 3.5Å; I345-K349 VanDerWaalsContact O-CG 3.3Å; I345-K349 WeakPolarHBondContact O-CG 3.11Å; I345-K349 PolarHBondContact O-N 3.46Å; N346-K349 WeakPolarHBondContact O-CB 3.13Å; N346-K349 PolarHBondContact O-N 3Å; K349-T351 PolarHBondContact O-N 3.28Å; K349-R352 PolarHBondContact O-N 2.67Å; K349-Q353 PolarHBondContact O-N 3.36Å; K349-A481 HydrophobicContact CB-CB 4.12Å; K349-Y482 HydrophobicContact CD-CD2 4.2Å; K349-Y482 HydrophobicContact CD-CE1 4.11Å; K349-Y482 HydrophobicContact CD-CE2 3.61Å; K349-Y482 VanDerWaalsContact NZ-CD1 3.35Å; K349-D485 VanDerWaalsContact CD-OD2 3.32Å; K349-D485 WeakPolarHBondContact CD-OD2 3.44Å; K349-D485 WeakPolarHBondContact CE-OD2 3.49Å; K349-D485 WeakPolarHBondContact CG-OD2 3.24Å; K349-D485 IonicContact NZ-OD2 3.98Å; K349-D485 PolarHBondContact NZ-OD2 2.8Å
350	C	96.4	Very high	94.7	Very high	18 Å²	18	72.6 Å²	72.6	12%	0.122	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-42	178.8	-65.1	0	0	0	0	112	N346 T347 Y348 Q353 I354 V477 E478	N346-C350 WeakPolarHBondContact O-CB 3.46Å; N346-C350 PolarHBondContact O-N 2.86Å; N346-C350 PolarHBondContact O-SG 3.39Å; T347-C350 PolarHBondContact O-N 3.35Å; Y348-C350 PolarHBondContact O-N 3.3Å; C350-Q353 PolarHBondContact O-N 3.49Å; C350-I354 WeakPolarHBondContact O-CG1 3.35Å; C350-I354 PolarHBondContact O-N 3.14Å; C350-V477 HydrophobicContact CB-CG1 3.71Å; C350-E478 VanDerWaalsContact SG-CG 3.58Å
351	T	96.9	Very high	94.6	Very high	43 Å²	43	78.5 Å²	78.5	26%	0.264	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-43.6	177	-52.7	0	0	0	0	111.1	T347 Y348 K349 Q353 I354 L355	T347-T351 WeakPolarHBondContact O-CB 3.36Å; T347-T351 PolarHBondContact O-N 3.1Å; T347-T351 PolarHBondContact O-OG1 3.46Å; Y348-T351 PolarHBondContact O-N 2.9Å; K349-T351 PolarHBondContact O-N 3.28Å; T351-Q353 VanDerWaalsContact C-N 3.32Å; T351-Q353 PolarHBondContact O-N 3.03Å; T351-I354 PolarHBondContact O-N 3.2Å; T351-L355 HydrophobicContact CG2-CD1 4.08Å; T351-L355 WeakPolarHBondContact O-CB 3.47Å; T351-L355 VanDerWaalsContact O-CG 3.29Å; T351-L355 WeakPolarHBondContact O-CG 3.4Å; T351-L355 PolarHBondContact O-N 3.11Å
352	R	96.6	Very high	94.3	Very high	64 Å²	64	73.5 Å²	73.5	24%	0.242	37%	0.366	C	S	.	.	H	α-helix	trans	-62.1	-38.2	174.1	-178.6	-176.9	61.3	155.5	-8.9	111.9	Y348 K349 S356 D485 E488	Y348-R352 WeakPolarHBondContact O-CB 3.4Å; Y348-R352 PolarHBondContact O-N 3.3Å; K349-R352 PolarHBondContact O-N 2.67Å; R352-S356 VanDerWaalsContact O-CB 3.31Å; R352-S356 WeakPolarHBondContact O-CB 3.46Å; R352-S356 PolarHBondContact O-N 3.04Å; R352-S356 PolarHBondContact O-OG 3.42Å; R352-D485 IonicContact CZ-OD1 2.76Å; R352-D485 VanDerWaalsContact NH2-CG 3.26Å; R352-D485 IonicContact NH2-OD1 2.76Å; R352-D485 PolarHBondContact NH2-OD1 3.07Å; R352-D485 IonicContact NH2-OD2 3.28Å; R352-D485 PolarHBondContact NH2-OD2 3.32Å; R352-E488 IonicContact CZ-OE1 2.8Å; R352-E488 IonicContact CZ-OE2 3.2Å; R352-E488 VanDerWaalsContact NH1-CD 3.31Å; R352-E488 IonicContact NH1-OE1 2.65Å; R352-E488 PolarHBondContact NH1-OE1 3.19Å; R352-E488 IonicContact NH1-OE2 2.66Å; R352-E488 PolarHBondContact NH1-OE2 3.47Å; R352-E488 IonicContact NH2-OE2 3.47Å
353	Q	97.6	Very high	94.4	Very high	5 Å²	5	70.7 Å²	70.7	2%	0.023	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-52.1	176	179	60	28.1	0	0	111.3	K349 C350 T351 L355 S356 E357 S363 V477 D480 A481 T484	K349-Q353 PolarHBondContact O-N 3.36Å; C350-Q353 PolarHBondContact O-N 3.49Å; T351-Q353 VanDerWaalsContact C-N 3.32Å; T351-Q353 PolarHBondContact O-N 3.03Å; Q353-L355 VanDerWaalsContact C-N 3.31Å; Q353-L355 PolarHBondContact O-N 2.92Å; Q353-S356 WeakPolarHBondContact O-CA 3.21Å; Q353-S356 WeakPolarHBondContact O-CB 3.35Å; Q353-S356 PolarHBondContact O-N 3.13Å; Q353-E357 PolarHBondContact NE2-OE1 3.09Å; Q353-E357 WeakPolarHBondContact O-CG 3.35Å; Q353-E357 PolarHBondContact O-N 2.96Å; Q353-S363 PolarHBondContact NE2-O 3.21Å; Q353-V477 HydrophobicContact CB-CG1 4.46Å; Q353-V477 HydrophobicContact CG-CG1 4.43Å; Q353-D480 HydrophobicContact CG-CB 3.96Å; Q353-A481 HydrophobicContact CB-CB 3.76Å; Q353-A481 HydrophobicContact CG-CB 4.19Å; Q353-T484 PolarHBondContact OE1-OG1 3.2Å
354	I	95.6	Very high	94.6	Very high	50 Å²	50	67.5 Å²	67.5	26%	0.256	35%	0.351	S	S	.	.	H	α-helix	trans	-56.4	-44.1	177.8	-69	163.1	0	0	0	111.3	C350 T351 E357 K358 V477	C350-I354 WeakPolarHBondContact O-CG1 3.35Å; C350-I354 PolarHBondContact O-N 3.14Å; T351-I354 PolarHBondContact O-N 3.2Å; I354-E357 PolarHBondContact O-N 3.4Å; I354-K358 HydrophobicContact CG2-CD 3.85Å; I354-K358 HydrophobicContact CG2-CG 4.37Å; I354-K358 WeakPolarHBondContact O-CB 3.26Å; I354-K358 WeakPolarHBondContact O-CG 3.39Å; I354-K358 PolarHBondContact O-N 3.02Å; I354-V477 HydrophobicContact CD1-CG1 3.92Å; I354-V477 HydrophobicContact CD1-CG2 4.43Å; I354-V477 HydrophobicContact CG1-CG1 3.7Å; I354-V477 HydrophobicContact CG1-CG2 4.01Å
355	L	96.1	Very high	94.6	Very high	86 Å²	86	66.4 Å²	66.4	45%	0.45	34%	0.343	S	S	.	.	H	α-helix	trans	-67.2	-36.5	177.1	-69.9	172.4	0	0	0	112.1	T351 Q353 L359	T351-L355 HydrophobicContact CG2-CD1 4.08Å; T351-L355 WeakPolarHBondContact O-CB 3.47Å; T351-L355 VanDerWaalsContact O-CG 3.29Å; T351-L355 WeakPolarHBondContact O-CG 3.4Å; T351-L355 PolarHBondContact O-N 3.11Å; Q353-L355 VanDerWaalsContact C-N 3.31Å; Q353-L355 PolarHBondContact O-N 2.92Å; L355-L359 VanDerWaalsContact O-CB 3.29Å; L355-L359 WeakPolarHBondContact O-CB 3.3Å; L355-L359 WeakPolarHBondContact O-CD1 3.47Å; L355-L359 WeakPolarHBondContact O-CG 3.47Å; L355-L359 PolarHBondContact O-N 3.45Å; L355-L359 VanDerWaalsContact O-N 3.08Å
356	S	95.5	Very high	94.8	Very high	36 Å²	36	66 Å²	66	25%	0.252	34%	0.344	S	S	.	.	H	α-helix	trans	-66.5	-43.1	174.7	-60.4	0	0	0	0	111.9	R352 Q353 L359 G360 R361 G362	R352-S356 VanDerWaalsContact O-CB 3.31Å; R352-S356 WeakPolarHBondContact O-CB 3.46Å; R352-S356 PolarHBondContact O-N 3.04Å; R352-S356 PolarHBondContact O-OG 3.42Å; Q353-S356 WeakPolarHBondContact O-CA 3.21Å; Q353-S356 WeakPolarHBondContact O-CB 3.35Å; Q353-S356 PolarHBondContact O-N 3.13Å; S356-L359 PolarHBondContact O-N 3.12Å; S356-G360 PolarHBondContact O-N 3.25Å; S356-R361 PolarHBondContact O-N 3.28Å; S356-G362 VanDerWaalsContact C-N 3.3Å; S356-G362 PolarHBondContact O-N 3Å
357	E	95.3	Very high	94.9	Very high	35 Å²	35	66.5 Å²	66.5	16%	0.164	35%	0.346	C	S	.	.	H	α-helix	trans	-60.2	-53.3	173.3	-70.7	177.3	-162.3	0	0	111	Q353 I354 L359 G360 R364 R476	Q353-E357 PolarHBondContact NE2-OE1 3.09Å; Q353-E357 WeakPolarHBondContact O-CG 3.35Å; Q353-E357 PolarHBondContact O-N 2.96Å; I354-E357 PolarHBondContact O-N 3.4Å; E357-L359 PolarHBondContact O-N 3Å; E357-L359 VanDerWaalsContact O-N 3.11Å; E357-G360 PolarHBondContact O-N 3.31Å; E357-R364 HydrophobicContact CG-CB 4.07Å; E357-R476 IonicContact OE1-CZ 2.82Å; E357-R476 IonicContact OE1-NH1 3.33Å; E357-R476 PolarHBondContact OE1-NH1 2.76Å; E357-R476 IonicContact OE1-NH2 2.66Å; E357-R476 IonicContact OE2-CZ 2.65Å; E357-R476 IonicContact OE2-NH1 2.63Å; E357-R476 PolarHBondContact OE2-NH1 3.41Å; E357-R476 IonicContact OE2-NH2 3.22Å; E357-R476 PolarHBondContact OE2-NH2 3.3Å
358	K	94	Very high	95	Very high	126 Å²	126	72.2 Å²	72.2	55%	0.548	38%	0.375	S	S	.	.	H	α-helix	trans	-59.9	-21.6	178.7	-74.1	176.1	177.1	173.8	0	113.6	E41 I354	E41-K358 VanDerWaalsContact CD-NZ 3.34Å; E41-K358 IonicContact OE1-NZ 2.74Å; E41-K358 PolarHBondContact OE1-NZ 3.41Å; E41-K358 IonicContact OE2-NZ 3.4Å; E41-K358 PolarHBondContact OE2-NZ 3.26Å; I354-K358 HydrophobicContact CG2-CD 3.85Å; I354-K358 HydrophobicContact CG2-CG 4.37Å; I354-K358 WeakPolarHBondContact O-CB 3.26Å; I354-K358 WeakPolarHBondContact O-CG 3.39Å; I354-K358 PolarHBondContact O-N 3.02Å
359	L	94.7	Very high	95	Very high	118 Å²	118	71 Å²	71	62%	0.618	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	6.5	177.1	-67.9	172.2	0	0	0	114	L355 S356 E357 R361	L355-L359 VanDerWaalsContact O-CB 3.29Å; L355-L359 WeakPolarHBondContact O-CB 3.3Å; L355-L359 WeakPolarHBondContact O-CD1 3.47Å; L355-L359 WeakPolarHBondContact O-CG 3.47Å; L355-L359 PolarHBondContact O-N 3.45Å; L355-L359 VanDerWaalsContact O-N 3.08Å; S356-L359 PolarHBondContact O-N 3.12Å; E357-L359 PolarHBondContact O-N 3Å; E357-L359 VanDerWaalsContact O-N 3.11Å; L359-R361 HydrophobicContact CB-CG 4.48Å; L359-R361 PolarHBondContact O-N 3.4Å
360	G	92.1	Very high	95.1	Very high	74 Å²	74	69.9 Å²	69.9	76%	0.763	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	21.9	-179.1	0	0	0	0	0	114.5	S356 E357	S356-G360 PolarHBondContact O-N 3.25Å; E357-G360 PolarHBondContact O-N 3.31Å
361	R	91.1	Very high	95.2	Very high	216 Å²	216	71.4 Å²	71.4	82%	0.815	38%	0.376	S	S	*	.			trans	-110.7	-19.2	-177.7	-66.8	178.5	-177.7	-177.3	-0.3	113.7	S356 L359	S356-R361 PolarHBondContact O-N 3.28Å; L359-R361 HydrophobicContact CB-CG 4.48Å; L359-R361 PolarHBondContact O-N 3.4Å
362	G	87.1	Confident	95.2	Very high	19 Å²	19	71.1 Å²	71.1	20%	0.196	38%	0.382	C	S	.	.	S	Bend	trans	-105.8	136.9	176.7	0	0	0	0	0	110.8	S356	S356-G362 VanDerWaalsContact C-N 3.3Å; S356-G362 PolarHBondContact O-N 3Å
363	S	92	Very high	95.3	Very high	80 Å²	80	70.8 Å²	70.8	56%	0.559	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-73.4	129.3	170.4	-176.1	0	0	0	0	110	Q353 R483	Q353-S363 PolarHBondContact NE2-O 3.21Å; S363-R483 PolarHBondContact O-NH2 3.47Å; S363-R483 VanDerWaalsContact O-NH2 3.13Å
364	R	95.6	Very high	95.3	Very high	79 Å²	79	70.6 Å²	70.6	30%	0.298	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-100.4	130.7	176.6	-179.4	177.1	-178.8	-94.3	-11.7	109.3	E357 V366 E371 E473	E357-R364 HydrophobicContact CG-CB 4.07Å; R364-V366 HydrophobicContact CG-CG2 4.3Å; R364-E371 IonicContact CZ-OE1 3.78Å; R364-E371 IonicContact NH1-OE1 2.64Å; R364-E371 PolarHBondContact NH1-OE1 3.04Å; R364-E371 IonicContact NH1-OE2 3.64Å; R364-E371 PolarHBondContact NH1-OE2 2.75Å; R364-E371 IonicContact NH2-OE1 3.59Å; R364-E371 PolarHBondContact NH2-OE1 3.37Å; R364-E473 IonicContact NH2-OE1 2.77Å; R364-E473 PolarHBondContact NH2-OE1 2.96Å; R364-E473 IonicContact NH2-OE2 3.97Å
365	T	96.8	Very high	95.5	Very high	30 Å²	30	72 Å²	72	18%	0.184	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-71.3	134.6	166.2	-67.5	0	0	0	0	110.1	R476 F479 D480 Y516	T365-R476 WeakPolarHBondContact O-CD 3.4Å; T365-F479 HydrophobicContact CG2-CE1 4.31Å; T365-F479 WeakPolarHBondContact OG1-CE1 3.48Å; T365-D480 VanDerWaalsContact CB-OD2 3.26Å; T365-D480 WeakPolarHBondContact CB-OD2 3.2Å; T365-D480 PolarHBondContact N-OD1 2.81Å; T365-D480 PolarHBondContact N-OD2 2.83Å; T365-D480 PolarHBondContact OG1-OD1 2.92Å; T365-D480 PolarHBondContact OG1-OD2 3.33Å; T365-Y516 HydrophobicContact CG2-CE1 4Å; T365-Y516 WeakPolarHBondContact CG2-OH 3.45Å
366	V	96.1	Very high	95.6	Very high	73 Å²	73	72 Å²	72	44%	0.442	39%	0.391	S	S	.	.			trans	-130.8	139.3	-175	-173.2	0	0	0	0	110.1	R364 L368	R364-V366 HydrophobicContact CG-CG2 4.3Å; V366-L368 HydrophobicContact CG1-CD2 3.73Å; V366-L368 HydrophobicContact CG1-CG 4.23Å
367	D	96.7	Very high	95.7	Very high	39 Å²	39	70.8 Å²	70.8	21%	0.209	38%	0.382	C	S	.	.			trans	-124.6	100	169.1	-172.2	-39.8	0	0	0	108.7	E369 L370 E371 R520	D367-E369 VanDerWaalsContact C-N 3.34Å; D367-E369 PolarHBondContact O-N 3.43Å; D367-E369 PolarHBondContact OD1-N 3.45Å; D367-L370 HydrophobicContact CB-CB 4Å; D367-L370 PolarHBondContact O-N 3.01Å; D367-L370 WeakPolarHBondContact OD1-CB 3.36Å; D367-L370 PolarHBondContact OD1-N 3.47Å; D367-E371 VanDerWaalsContact O-CB 3.28Å; D367-E371 WeakPolarHBondContact O-CB 3.4Å; D367-E371 VanDerWaalsContact O-CG 3.3Å; D367-E371 WeakPolarHBondContact O-CG 3.49Å; D367-E371 PolarHBondContact O-N 3.31Å; D367-R520 WeakPolarHBondContact OD2-CD 3.26Å
368	L	97.1	Very high	95.8	Very high	145 Å²	145	73.4 Å²	73.4	76%	0.759	39%	0.39	S	S	*	.	H	α-helix	trans	-67.5	-31.3	-171.6	-63.4	173.8	0	0	0	113.1	V366 G372	V366-L368 HydrophobicContact CG1-CD2 3.73Å; V366-L368 HydrophobicContact CG1-CG 4.23Å; L368-G372 PolarHBondContact O-N 2.81Å
369	E	96.9	Very high	96	Very high	126 Å²	126	69.7 Å²	69.7	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-72.2	-47.1	177.4	-166.3	-160.2	129.2	0	0	109.8	D367 G372 Q373	D367-E369 VanDerWaalsContact C-N 3.34Å; D367-E369 PolarHBondContact O-N 3.43Å; D367-E369 PolarHBondContact OD1-N 3.45Å; E369-G372 PolarHBondContact O-N 3.42Å; E369-Q373 WeakPolarHBondContact O-CG 3.39Å; E369-Q373 PolarHBondContact O-N 2.81Å; E369-Q373 PolarHBondContact OE1-NE2 3.46Å
370	L	97.3	Very high	96.1	Very high	5 Å²	5	65.5 Å²	65.5	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-69.5	-39.9	-178.2	-163	66.4	0	0	0	111.9	D367 Q373 I374 Y472 R520 V523 L527	D367-L370 HydrophobicContact CB-CB 4Å; D367-L370 PolarHBondContact O-N 3.01Å; D367-L370 WeakPolarHBondContact OD1-CB 3.36Å; D367-L370 PolarHBondContact OD1-N 3.47Å; L370-Q373 PolarHBondContact O-N 2.99Å; L370-I374 HydrophobicContact CG-CD1 4.01Å; L370-I374 WeakPolarHBondContact O-CB 3.43Å; L370-I374 WeakPolarHBondContact O-CD1 3.26Å; L370-I374 WeakPolarHBondContact O-CG1 3.5Å; L370-I374 PolarHBondContact O-N 2.95Å; L370-Y472 HydrophobicContact CD2-CD2 4.49Å; L370-Y472 HydrophobicContact CD2-CE1 4.18Å; L370-Y472 HydrophobicContact CD2-CE2 3.97Å; L370-R520 HydrophobicContact CD2-CG 3.7Å; L370-V523 HydrophobicContact CD1-CG1 4.23Å; L370-V523 HydrophobicContact CD2-CG1 4.4Å; L370-L527 HydrophobicContact CD1-CD1 3.68Å
371	E	97.6	Very high	96.4	Very high	50 Å²	50	63.6 Å²	63.6	23%	0.234	33%	0.325	C	S	.	.	H	α-helix	trans	-63.9	-39.2	175	-74.9	177.5	-162.8	0	0	111.9	R364 D367 I374 E375	R364-E371 IonicContact CZ-OE1 3.78Å; R364-E371 IonicContact NH1-OE1 2.64Å; R364-E371 PolarHBondContact NH1-OE1 3.04Å; R364-E371 IonicContact NH1-OE2 3.64Å; R364-E371 PolarHBondContact NH1-OE2 2.75Å; R364-E371 IonicContact NH2-OE1 3.59Å; R364-E371 PolarHBondContact NH2-OE1 3.37Å; D367-E371 VanDerWaalsContact O-CB 3.28Å; D367-E371 WeakPolarHBondContact O-CB 3.4Å; D367-E371 VanDerWaalsContact O-CG 3.3Å; D367-E371 WeakPolarHBondContact O-CG 3.49Å; D367-E371 PolarHBondContact O-N 3.31Å; E371-I374 PolarHBondContact O-N 3.19Å; E371-E375 PolarHBondContact O-N 2.93Å
372	G	98.2	Very high	96.8	Very high	38 Å²	38	58.9 Å²	58.9	39%	0.392	31%	0.307	S	S	.	.	H	α-helix	trans	-60.9	-45.6	172.1	0	0	0	0	0	112.8	L368 E369 I374 E375 V376	L368-G372 PolarHBondContact O-N 2.81Å; E369-G372 PolarHBondContact O-N 3.42Å; G372-I374 VanDerWaalsContact C-N 3.34Å; G372-I374 PolarHBondContact O-N 3.26Å; G372-E375 PolarHBondContact O-N 3.38Å; G372-V376 WeakPolarHBondContact O-CG2 3.4Å; G372-V376 PolarHBondContact O-N 3.2Å
373	Q	98.3	Very high	97.3	Very high	56 Å²	56	63.4 Å²	63.4	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-37.9	175.9	-69.5	170.1	22.2	0	0	112.2	E369 L370 L377 L527	E369-Q373 WeakPolarHBondContact O-CG 3.39Å; E369-Q373 PolarHBondContact O-N 2.81Å; E369-Q373 PolarHBondContact OE1-NE2 3.46Å; L370-Q373 PolarHBondContact O-N 2.99Å; Q373-L377 PolarHBondContact O-N 2.78Å; Q373-L527 HydrophobicContact CB-CD1 4.02Å
374	I	98.4	Very high	97.6	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-41.5	177.1	-73	165.6	0	0	0	111.5	L370 E371 G372 L377 R378 I469 Y472 V523 L527	L370-I374 HydrophobicContact CG-CD1 4.01Å; L370-I374 WeakPolarHBondContact O-CB 3.43Å; L370-I374 WeakPolarHBondContact O-CD1 3.26Å; L370-I374 WeakPolarHBondContact O-CG1 3.5Å; L370-I374 PolarHBondContact O-N 2.95Å; E371-I374 PolarHBondContact O-N 3.19Å; G372-I374 VanDerWaalsContact C-N 3.34Å; G372-I374 PolarHBondContact O-N 3.26Å; I374-L377 WeakPolarHBondContact O-CB 3.39Å; I374-L377 PolarHBondContact O-N 3.46Å; I374-R378 VanDerWaalsContact CG2-CZ 3.48Å; I374-R378 WeakPolarHBondContact O-CG 3.47Å; I374-R378 PolarHBondContact O-N 3.13Å; I374-I469 HydrophobicContact CD1-CG1 4.18Å; I374-I469 HydrophobicContact CD1-CG2 3.97Å; I374-I469 HydrophobicContact CG1-CD1 3.88Å; I374-I469 HydrophobicContact CG1-CG1 4.02Å; I374-I469 HydrophobicContact CG1-CG2 4.29Å; I374-I469 HydrophobicContact CG2-CD1 4.31Å; I374-I469 HydrophobicContact CG2-CG2 3.98Å; I374-Y472 HydrophobicContact CD1-CE1 4.44Å; I374-V523 HydrophobicContact CD1-CG1 4.48Å; I374-L527 HydrophobicContact CG1-CD1 4.19Å
375	E	98.2	Very high	97.7	Very high	78 Å²	78	60.1 Å²	60.1	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-72	-37	178.4	-165	55.1	-128.7	0	0	112.2	E371 G372 L377 R378 D379 R382	E371-E375 PolarHBondContact O-N 2.93Å; G372-E375 PolarHBondContact O-N 3.38Å; E375-L377 PolarHBondContact O-N 3.46Å; E375-R378 PolarHBondContact O-N 3.08Å; E375-R378 WeakPolarHBondContact OE2-CD 3.26Å; E375-R378 IonicContact OE2-CZ 3.33Å; E375-R378 IonicContact OE2-NE 2.8Å; E375-R378 IonicContact OE2-NH1 3.76Å; E375-R378 PolarHBondContact OE2-NH1 3.15Å; E375-D379 WeakPolarHBondContact O-CB 3.35Å; E375-D379 PolarHBondContact O-N 3.47Å; E375-R382 IonicContact OE1-CZ 2.8Å; E375-R382 IonicContact OE1-NH2 3.25Å; E375-R382 PolarHBondContact OE1-NH2 2.72Å
376	V	97.9	Very high	97.8	Very high	87 Å²	87	64 Å²	64	53%	0.527	32%	0.315	S	S	.	.	H	α-helix	trans	-59.5	-36.2	169.2	170.3	0	0	0	0	111.3	G372 N380	G372-V376 WeakPolarHBondContact O-CG2 3.4Å; G372-V376 PolarHBondContact O-N 3.2Å; V376-N380 WeakPolarHBondContact CG1-ND2 3.26Å; V376-N380 WeakPolarHBondContact O-CB 3.29Å; V376-N380 VanDerWaalsContact O-CG 3.26Å; V376-N380 PolarHBondContact O-N 3.24Å; V376-N380 PolarHBondContact O-ND2 3.04Å
377	L	98.3	Very high	97.9	Very high	11 Å²	11	63.3 Å²	63.3	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-47.2	173.4	178.5	59.5	0	0	0	112.4	Q373 I374 E375 D379 N380 K381 I462 T465 M466 I469 L527 L530	Q373-L377 PolarHBondContact O-N 2.78Å; I374-L377 WeakPolarHBondContact O-CB 3.39Å; I374-L377 PolarHBondContact O-N 3.46Å; E375-L377 PolarHBondContact O-N 3.46Å; L377-D379 VanDerWaalsContact C-N 3.28Å; L377-D379 PolarHBondContact O-N 3.06Å; L377-N380 PolarHBondContact O-N 3.33Å; L377-K381 PolarHBondContact O-N 2.85Å; L377-I462 HydrophobicContact CD1-CG1 4.23Å; L377-I462 HydrophobicContact CD1-CG2 3.89Å; L377-I462 HydrophobicContact CG-CG2 4.33Å; L377-T465 HydrophobicContact CD2-CG2 3.8Å; L377-M466 HydrophobicContact CD2-SD 3.93Å; L377-M466 HydrophobicContact CG-SD 4.22Å; L377-I469 HydrophobicContact CD2-CD1 3.88Å; L377-L527 HydrophobicContact CB-CD2 4.24Å; L377-L527 HydrophobicContact CD2-CD2 3.72Å; L377-L530 HydrophobicContact CD1-CD2 3.5Å; L377-L530 HydrophobicContact CD2-CD2 3.74Å; L377-L530 HydrophobicContact CG-CD2 4.29Å
378	R	98.4	Very high	98	Very high	90 Å²	90	62.1 Å²	62.1	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-57.2	-43.2	177	-71.7	163.8	-178.8	161.3	3.5	111.3	I374 E375 K381 R382 M466	I374-R378 VanDerWaalsContact CG2-CZ 3.48Å; I374-R378 WeakPolarHBondContact O-CG 3.47Å; I374-R378 PolarHBondContact O-N 3.13Å; E375-R378 PolarHBondContact O-N 3.08Å; E375-R378 WeakPolarHBondContact OE2-CD 3.26Å; E375-R378 IonicContact OE2-CZ 3.33Å; E375-R378 IonicContact OE2-NE 2.8Å; E375-R378 IonicContact OE2-NH1 3.76Å; E375-R378 PolarHBondContact OE2-NH1 3.15Å; R378-K381 PolarHBondContact O-N 3.3Å; R378-R382 WeakPolarHBondContact O-CG 3.39Å; R378-R382 PolarHBondContact O-N 2.89Å; R378-M466 HydrophobicContact CG-CE 3.82Å; R378-M466 HydrophobicContact CG-SD 4.36Å
379	D	98.3	Very high	98.1	Very high	47 Å²	47	61.4 Å²	61.4	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-43.1	179	-170.7	60.8	0	0	0	112.9	E375 L377 K381 R382 K383	E375-D379 WeakPolarHBondContact O-CB 3.35Å; E375-D379 PolarHBondContact O-N 3.47Å; L377-D379 VanDerWaalsContact C-N 3.28Å; L377-D379 PolarHBondContact O-N 3.06Å; D379-K381 VanDerWaalsContact C-N 3.33Å; D379-K381 PolarHBondContact O-N 2.95Å; D379-R382 PolarHBondContact O-N 3.33Å; D379-R382 IonicContact OD1-CZ 3.7Å; D379-R382 IonicContact OD1-NH1 3.72Å; D379-R382 PolarHBondContact OD1-NH1 3.12Å; D379-R382 IonicContact OD1-NH2 2.67Å; D379-K383 WeakPolarHBondContact O-CB 3.12Å; D379-K383 VanDerWaalsContact O-CG 3.32Å; D379-K383 WeakPolarHBondContact O-CG 3.48Å; D379-K383 PolarHBondContact O-N 3.48Å; D379-K383 WeakPolarHBondContact OD2-CE 3.35Å; D379-K383 IonicContact OD2-NZ 3.88Å; D379-K383 PolarHBondContact OD2-NZ 3Å
380	N	96.9	Very high	98.1	Very high	30 Å²	30	60.2 Å²	60.2	16%	0.16	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-41.6	171.1	-78.3	-43.7	0	0	0	111.9	V376 L377 K383 Y384	V376-N380 WeakPolarHBondContact CG1-ND2 3.26Å; V376-N380 WeakPolarHBondContact O-CB 3.29Å; V376-N380 VanDerWaalsContact O-CG 3.26Å; V376-N380 PolarHBondContact O-N 3.24Å; V376-N380 PolarHBondContact O-ND2 3.04Å; L377-N380 PolarHBondContact O-N 3.33Å; N380-K383 PolarHBondContact O-N 2.97Å; N380-Y384 HydrophobicContact CB-CE2 3.94Å; N380-Y384 WeakPolarHBondContact O-CD2 3.02Å; N380-Y384 PolarHBondContact O-N 2.92Å
381	K	97.7	Very high	98.2	Very high	35 Å²	35	60.5 Å²	60.5	15%	0.152	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-53.7	175.9	-161.4	-164.6	179.7	-162.7	0	111	L377 R378 D379 K383 Y384 E385 V458 I462 E463	L377-K381 PolarHBondContact O-N 2.85Å; R378-K381 PolarHBondContact O-N 3.3Å; D379-K381 VanDerWaalsContact C-N 3.33Å; D379-K381 PolarHBondContact O-N 2.95Å; K381-K383 VanDerWaalsContact C-N 3.26Å; K381-K383 PolarHBondContact O-N 3.41Å; K381-Y384 PolarHBondContact O-N 3.4Å; K381-Y384 VanDerWaalsContact O-N 3.12Å; K381-E385 VanDerWaalsContact CD-OE1 3.3Å; K381-E385 WeakPolarHBondContact CD-OE1 3.32Å; K381-E385 WeakPolarHBondContact CE-OE1 3.47Å; K381-E385 WeakPolarHBondContact CG-OE1 3.37Å; K381-E385 IonicContact NZ-OE1 3.62Å; K381-E385 PolarHBondContact NZ-OE1 3.35Å; K381-E385 WeakPolarHBondContact O-CG 3.35Å; K381-E385 PolarHBondContact O-N 3.15Å; K381-V458 HydrophobicContact CD-CG1 4.46Å; K381-V458 HydrophobicContact CG-CG1 3.92Å; K381-I462 HydrophobicContact CB-CG2 4.03Å; K381-I462 HydrophobicContact CD-CG2 3.95Å; K381-I462 HydrophobicContact CG-CG2 3.77Å; K381-E463 IonicContact NZ-OE2 3.88Å; K381-E463 PolarHBondContact NZ-OE2 3.33Å
382	R	98.4	Very high	98.2	Very high	117 Å²	117	62.2 Å²	62.2	44%	0.442	30%	0.303	S	S	.	.	H	α-helix	trans	-54.7	-40.1	177.5	-72.4	-176.3	-87	97.8	-5.9	112	E375 R378 D379 H386	E375-R382 IonicContact OE1-CZ 2.8Å; E375-R382 IonicContact OE1-NH2 3.25Å; E375-R382 PolarHBondContact OE1-NH2 2.72Å; R378-R382 WeakPolarHBondContact O-CG 3.39Å; R378-R382 PolarHBondContact O-N 2.89Å; D379-R382 PolarHBondContact O-N 3.33Å; D379-R382 IonicContact OD1-CZ 3.7Å; D379-R382 IonicContact OD1-NH1 3.72Å; D379-R382 PolarHBondContact OD1-NH1 3.12Å; D379-R382 IonicContact OD1-NH2 2.67Å; R382-H386 PolarHBondContact O-N 3.5Å; R382-H386 VanDerWaalsContact O-N 3.16Å
383	K	98.3	Very high	98.3	Very high	113 Å²	113	63.8 Å²	63.8	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-67.7	-43.2	176.5	-75.6	168.1	173.9	170.5	0	113	D379 N380 K381 H386 V387	D379-K383 WeakPolarHBondContact O-CB 3.12Å; D379-K383 VanDerWaalsContact O-CG 3.32Å; D379-K383 WeakPolarHBondContact O-CG 3.48Å; D379-K383 PolarHBondContact O-N 3.48Å; D379-K383 WeakPolarHBondContact OD2-CE 3.35Å; D379-K383 IonicContact OD2-NZ 3.88Å; D379-K383 PolarHBondContact OD2-NZ 3Å; N380-K383 PolarHBondContact O-N 2.97Å; K381-K383 VanDerWaalsContact C-N 3.26Å; K381-K383 PolarHBondContact O-N 3.41Å; K383-H386 PolarHBondContact O-N 3.19Å; K383-V387 WeakPolarHBondContact O-CG2 3.37Å; K383-V387 PolarHBondContact O-N 2.67Å
384	Y	98.1	Very high	98.3	Very high	35 Å²	35	64.4 Å²	64.4	14%	0.137	31%	0.31	C	S	.	.	H	α-helix	trans	-70.5	-37.9	178.2	-56.6	-29.8	0	0	0	112.4	N380 K381 H386 V387 V388 V458 I462 K534 L538	N380-Y384 HydrophobicContact CB-CE2 3.94Å; N380-Y384 WeakPolarHBondContact O-CD2 3.02Å; N380-Y384 PolarHBondContact O-N 2.92Å; K381-Y384 PolarHBondContact O-N 3.4Å; K381-Y384 VanDerWaalsContact O-N 3.12Å; Y384-H386 PolarHBondContact O-N 3.27Å; Y384-V387 PolarHBondContact O-N 3.02Å; Y384-V388 WeakPolarHBondContact O-CG2 3.36Å; Y384-V388 PolarHBondContact O-N 3.46Å; Y384-V458 HydrophobicContact CD2-CG2 4.45Å; Y384-I462 HydrophobicContact CD2-CD1 3.91Å; Y384-I462 HydrophobicContact CE2-CD1 4.18Å; Y384-K534 HydrophobicContact CE2-CD 3.91Å; Y384-K534 HydrophobicContact CE2-CG 4.07Å; Y384-K534 WeakPolarHBondContact OH-CD 3.44Å; Y384-K534 WeakPolarHBondContact OH-CE 3.48Å; Y384-L538 HydrophobicContact CD1-CD1 4.42Å; Y384-L538 HydrophobicContact CE1-CD1 3.73Å; Y384-L538 HydrophobicContact CE2-CD1 3.95Å; Y384-L538 VanDerWaalsContact CZ-CD1 3.47Å
385	E	98.3	Very high	98.3	Very high	55 Å²	55	64.4 Å²	64.4	26%	0.257	31%	0.31	S	S	.	.	H	α-helix	trans	-57	-37.6	169.9	-70.7	169.6	-173	0	0	112	K381 K389 V458	K381-E385 VanDerWaalsContact CD-OE1 3.3Å; K381-E385 WeakPolarHBondContact CD-OE1 3.32Å; K381-E385 WeakPolarHBondContact CE-OE1 3.47Å; K381-E385 WeakPolarHBondContact CG-OE1 3.37Å; K381-E385 IonicContact NZ-OE1 3.62Å; K381-E385 PolarHBondContact NZ-OE1 3.35Å; K381-E385 WeakPolarHBondContact O-CG 3.35Å; K381-E385 PolarHBondContact O-N 3.15Å; E385-K389 WeakPolarHBondContact O-CD 3.39Å; E385-K389 VanDerWaalsContact O-CG 3.26Å; E385-K389 WeakPolarHBondContact O-CG 3.35Å; E385-K389 PolarHBondContact O-N 2.88Å; E385-K389 VanDerWaalsContact O-N 3.12Å; E385-V458 HydrophobicContact CG-CG1 3.71Å
386	H	98.5	Very high	98.3	Very high	111 Å²	111	65 Å²	65	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-71	-42.5	175.6	-174.6	66	0	0	0	112.6	R382 K383 Y384 V388 K389 L390	R382-H386 PolarHBondContact O-N 3.5Å; R382-H386 VanDerWaalsContact O-N 3.16Å; K383-H386 PolarHBondContact O-N 3.19Å; Y384-H386 PolarHBondContact O-N 3.27Å; H386-V388 VanDerWaalsContact C-N 3.3Å; H386-V388 PolarHBondContact O-N 3.09Å; H386-K389 PolarHBondContact O-N 2.89Å; H386-L390 WeakPolarHBondContact O-CG 3.38Å; H386-L390 PolarHBondContact O-N 2.86Å
387	V	98.2	Very high	98.3	Very high	60 Å²	60	66.1 Å²	66.1	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-41.7	173.5	170.5	0	0	0	0	111.1	K383 Y384 L390 T391 F450	K383-V387 WeakPolarHBondContact O-CG2 3.37Å; K383-V387 PolarHBondContact O-N 2.67Å; Y384-V387 PolarHBondContact O-N 3.02Å; V387-L390 PolarHBondContact O-N 3.03Å; V387-T391 WeakPolarHBondContact O-CB 3.42Å; V387-T391 PolarHBondContact O-N 3.45Å; V387-T391 PolarHBondContact O-OG1 2.91Å; V387-F450 HydrophobicContact CG1-CE1 4.29Å; V387-F450 HydrophobicContact CG1-CZ 4.34Å
388	V	98.3	Very high	98.3	Very high	13 Å²	13	66.1 Å²	66.1	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-58.1	-51.8	173.6	164.2	0	0	0	0	111	Y384 H386 L390 T391 Q392 I451 V454 N455	Y384-V388 WeakPolarHBondContact O-CG2 3.36Å; Y384-V388 PolarHBondContact O-N 3.46Å; H386-V388 VanDerWaalsContact C-N 3.3Å; H386-V388 PolarHBondContact O-N 3.09Å; V388-L390 PolarHBondContact O-N 3.26Å; V388-T391 PolarHBondContact O-N 3.08Å; V388-T391 VanDerWaalsContact O-N 3.15Å; V388-Q392 WeakPolarHBondContact O-CB 3.3Å; V388-Q392 PolarHBondContact O-N 2.89Å; V388-I451 HydrophobicContact CG1-CG2 4.44Å; V388-V454 HydrophobicContact CG2-CB 3.96Å; V388-V454 HydrophobicContact CG2-CG1 3.53Å; V388-N455 WeakPolarHBondContact CG1-OD1 3.39Å; V388-N455 WeakPolarHBondContact CG2-OD1 3.44Å
389	K	98.6	Very high	98.3	Very high	130 Å²	130	64.7 Å²	64.7	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-57.5	-46.7	-179.7	-72.5	162.5	-175.1	168.9	0	111.8	E385 H386 Q392 T393	E385-K389 WeakPolarHBondContact O-CD 3.39Å; E385-K389 VanDerWaalsContact O-CG 3.26Å; E385-K389 WeakPolarHBondContact O-CG 3.35Å; E385-K389 PolarHBondContact O-N 2.88Å; E385-K389 VanDerWaalsContact O-N 3.12Å; H386-K389 PolarHBondContact O-N 2.89Å; K389-Q392 PolarHBondContact O-N 3.12Å; K389-T393 PolarHBondContact O-N 2.94Å; K389-T393 PolarHBondContact O-OG1 2.65Å; K389-T393 VanDerWaalsContact O-OG1 3.13Å
390	L	98.8	Very high	98.3	Very high	101 Å²	101	68.5 Å²	68.5	53%	0.529	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-44.7	175	-68.3	177.5	0	0	0	112.3	H386 V387 V388 Q392 T393 L394	H386-L390 WeakPolarHBondContact O-CG 3.38Å; H386-L390 PolarHBondContact O-N 2.86Å; V387-L390 PolarHBondContact O-N 3.03Å; V388-L390 PolarHBondContact O-N 3.26Å; L390-Q392 VanDerWaalsContact C-N 3.3Å; L390-Q392 PolarHBondContact O-N 3.46Å; L390-T393 WeakPolarHBondContact O-CB 3.39Å; L390-T393 PolarHBondContact O-N 2.87Å; L390-L394 PolarHBondContact O-N 3.45Å
391	T	98.5	Very high	98.3	Very high	11 Å²	11	71 Å²	71	7%	0.067	35%	0.345	C	S	.	.	H	α-helix	trans	-66.5	-33.6	-179	-50.1	0	0	0	0	112	V387 V388 L394 A395 I447 F450 I451 F545	V387-T391 WeakPolarHBondContact O-CB 3.42Å; V387-T391 PolarHBondContact O-N 3.45Å; V387-T391 PolarHBondContact O-OG1 2.91Å; V388-T391 PolarHBondContact O-N 3.08Å; V388-T391 VanDerWaalsContact O-N 3.15Å; T391-L394 WeakPolarHBondContact O-CB 3.39Å; T391-L394 PolarHBondContact O-N 3Å; T391-A395 PolarHBondContact O-N 3.15Å; T391-I447 HydrophobicContact CG2-CG2 3.73Å; T391-F450 HydrophobicContact CG2-CD1 3.82Å; T391-F450 HydrophobicContact CG2-CE1 4.11Å; T391-I451 HydrophobicContact CG2-CD1 4.14Å; T391-I451 HydrophobicContact CG2-CG1 3.85Å; T391-F545 HydrophobicContact CG2-CD2 4.48Å; T391-F545 HydrophobicContact CG2-CE2 3.64Å; T391-F545 HydrophobicContact CG2-CZ 4.23Å
392	Q	98.7	Very high	98.3	Very high	86 Å²	86	69.7 Å²	69.7	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-77	-32.7	177.1	-162.6	157	6.7	0	0	112.2	V388 K389 L390 A395 N396 I451	V388-Q392 WeakPolarHBondContact O-CB 3.3Å; V388-Q392 PolarHBondContact O-N 2.89Å; K389-Q392 PolarHBondContact O-N 3.12Å; L390-Q392 VanDerWaalsContact C-N 3.3Å; L390-Q392 PolarHBondContact O-N 3.46Å; Q392-A395 PolarHBondContact O-N 2.96Å; Q392-N396 VanDerWaalsContact O-CG 3.22Å; Q392-N396 PolarHBondContact O-N 3.34Å; Q392-N396 PolarHBondContact O-ND2 3.01Å; Q392-I451 HydrophobicContact CB-CD1 3.93Å; Q392-I451 HydrophobicContact CG-CD1 4.19Å
393	T	98.8	Very high	98.3	Very high	72 Å²	72	69.2 Å²	69.2	44%	0.442	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-45.7	165.4	-63.2	0	0	0	0	111.2	K389 L390 A395 N396 Q397	K389-T393 PolarHBondContact O-N 2.94Å; K389-T393 PolarHBondContact O-OG1 2.65Å; K389-T393 VanDerWaalsContact O-OG1 3.13Å; L390-T393 WeakPolarHBondContact O-CB 3.39Å; L390-T393 PolarHBondContact O-N 2.87Å; T393-A395 PolarHBondContact O-N 3.35Å; T393-N396 PolarHBondContact O-N 3.27Å; T393-Q397 HydrophobicContact CG2-CG 4.44Å; T393-Q397 WeakPolarHBondContact O-CG 3.28Å; T393-Q397 PolarHBondContact O-N 2.94Å
394	L	98.4	Very high	98.3	Very high	68 Å²	68	67.8 Å²	67.8	36%	0.356	34%	0.343	S	S	.	.	H	α-helix	trans	-60.3	-42.5	175.6	178.2	64.6	0	0	0	112.1	L390 T391 N396 Q397 L398 I447 F545	L390-L394 PolarHBondContact O-N 3.45Å; T391-L394 WeakPolarHBondContact O-CB 3.39Å; T391-L394 PolarHBondContact O-N 3Å; L394-N396 VanDerWaalsContact C-N 3.35Å; L394-N396 PolarHBondContact O-N 3.2Å; L394-Q397 PolarHBondContact O-N 3.32Å; L394-L398 VanDerWaalsContact O-CB 3.26Å; L394-L398 WeakPolarHBondContact O-CB 3.16Å; L394-L398 PolarHBondContact O-N 3.26Å; L394-I447 HydrophobicContact CD2-CD1 4.27Å; L394-I447 HydrophobicContact CG-CD1 4.44Å; L394-F545 HydrophobicContact CD2-CZ 4.23Å
395	A	98.4	Very high	98.3	Very high	2 Å²	2	67.1 Å²	67.1	2%	0.017	34%	0.341	C	S	.	.	H	α-helix	trans	-60.4	-42.6	175.5	0	0	0	0	0	112.4	T391 Q392 T393 T399 L444 I447 I451	T391-A395 PolarHBondContact O-N 3.15Å; Q392-A395 PolarHBondContact O-N 2.96Å; T393-A395 PolarHBondContact O-N 3.35Å; A395-T399 WeakPolarHBondContact O-CB 3.42Å; A395-T399 PolarHBondContact O-N 3.16Å; A395-T399 PolarHBondContact O-OG1 3.42Å; A395-L444 HydrophobicContact CB-CD1 3.96Å; A395-L444 WeakPolarHBondContact O-CD1 3.42Å; A395-I447 HydrophobicContact CB-CG2 3.81Å; A395-I451 HydrophobicContact CB-CD1 4.29Å
396	N	98.5	Very high	98.2	Very high	91 Å²	91	69.6 Å²	69.6	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-66.1	-44.6	177.4	-68.1	-21	0	0	0	111.6	Q392 T393 L394 T399 Q400	Q392-N396 VanDerWaalsContact O-CG 3.22Å; Q392-N396 PolarHBondContact O-N 3.34Å; Q392-N396 PolarHBondContact O-ND2 3.01Å; T393-N396 PolarHBondContact O-N 3.27Å; L394-N396 VanDerWaalsContact C-N 3.35Å; L394-N396 PolarHBondContact O-N 3.2Å; N396-T399 WeakPolarHBondContact O-CB 3.4Å; N396-T399 PolarHBondContact O-N 2.74Å; N396-Q400 WeakPolarHBondContact O-CG 3.47Å; N396-Q400 PolarHBondContact O-N 3.27Å
397	Q	98.3	Very high	98.2	Very high	110 Å²	110	69.8 Å²	69.8	51%	0.514	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-43	176.7	-73	172.3	-26.5	0	0	112.1	T393 L394 T399 Q400 M401	T393-Q397 HydrophobicContact CG2-CG 4.44Å; T393-Q397 WeakPolarHBondContact O-CG 3.28Å; T393-Q397 PolarHBondContact O-N 2.94Å; L394-Q397 PolarHBondContact O-N 3.32Å; Q397-T399 VanDerWaalsContact C-N 3.32Å; Q397-T399 PolarHBondContact O-N 3.34Å; Q397-Q400 PolarHBondContact O-N 2.92Å; Q397-M401 WeakPolarHBondContact O-CB 3.42Å; Q397-M401 PolarHBondContact O-N 2.94Å
398	L	97.8	Very high	98.2	Very high	12 Å²	12	70.1 Å²	70.1	6%	0.063	35%	0.349	C	S	.	.	H	α-helix	trans	-58.8	-44	173.5	175	58.8	0	0	0	111.1	L394 Q400 M401 M402 L443 L444 I447	L394-L398 VanDerWaalsContact O-CB 3.26Å; L394-L398 WeakPolarHBondContact O-CB 3.16Å; L394-L398 PolarHBondContact O-N 3.26Å; L398-Q400 PolarHBondContact O-N 3.12Å; L398-M401 HydrophobicContact CD1-CE 3.77Å; L398-M401 PolarHBondContact O-N 3.44Å; L398-M402 HydrophobicContact CD1-CG 4.05Å; L398-M402 HydrophobicContact CD1-SD 3.86Å; L398-M402 HydrophobicContact CG-CG 4.48Å; L398-M402 HydrophobicContact CG-SD 3.75Å; L398-M402 WeakPolarHBondContact O-CB 3.03Å; L398-M402 WeakPolarHBondContact O-CG 3.3Å; L398-M402 PolarHBondContact O-N 3.35Å; L398-L443 HydrophobicContact CD2-CB 4.27Å; L398-L443 HydrophobicContact CD2-CD2 3.85Å; L398-L443 HydrophobicContact CD2-CG 3.83Å; L398-L444 HydrophobicContact CD2-CB 3.95Å; L398-L444 HydrophobicContact CD2-CD1 4.26Å; L398-I447 HydrophobicContact CD2-CD1 3.83Å
399	T	98.4	Very high	98.2	Very high	60 Å²	60	69.5 Å²	69.5	37%	0.368	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-44.8	177.4	-55.4	0	0	0	0	111.9	A395 N396 Q397 M402 Q403 L444	A395-T399 WeakPolarHBondContact O-CB 3.42Å; A395-T399 PolarHBondContact O-N 3.16Å; A395-T399 PolarHBondContact O-OG1 3.42Å; N396-T399 WeakPolarHBondContact O-CB 3.4Å; N396-T399 PolarHBondContact O-N 2.74Å; Q397-T399 VanDerWaalsContact C-N 3.32Å; Q397-T399 PolarHBondContact O-N 3.34Å; T399-M402 PolarHBondContact O-N 3.02Å; T399-Q403 PolarHBondContact O-N 2.89Å; T399-Q403 VanDerWaalsContact O-N 3.09Å; T399-L444 WeakPolarHBondContact OG1-CD2 3.14Å
400	Q	98.4	Very high	98.2	Very high	127 Å²	127	67.5 Å²	67.5	59%	0.593	34%	0.34	S	S	*	.	H	α-helix	trans	-64.1	-45.5	176.4	-69.6	170.6	5	0	0	111.5	N396 Q397 L398 M402 Q403 T404	N396-Q400 WeakPolarHBondContact O-CG 3.47Å; N396-Q400 PolarHBondContact O-N 3.27Å; Q397-Q400 PolarHBondContact O-N 2.92Å; L398-Q400 PolarHBondContact O-N 3.12Å; Q400-M402 PolarHBondContact O-N 2.95Å; Q400-Q403 WeakPolarHBondContact O-CB 3.38Å; Q400-Q403 PolarHBondContact O-N 2.92Å; Q400-T404 PolarHBondContact O-N 3.22Å; Q400-T404 PolarHBondContact O-OG1 2.92Å
401	M	97.8	Very high	98.2	Very high	83 Å²	83	64.9 Å²	64.9	41%	0.409	33%	0.334	S	S	.	.	H	α-helix	trans	-58.5	-47	175.8	-173	-173.4	69.5	0	0	111.5	Q397 L398 Q403 T404 Q405	Q397-M401 WeakPolarHBondContact O-CB 3.42Å; Q397-M401 PolarHBondContact O-N 2.94Å; L398-M401 HydrophobicContact CD1-CE 3.77Å; L398-M401 PolarHBondContact O-N 3.44Å; M401-Q403 VanDerWaalsContact C-N 3.29Å; M401-Q403 PolarHBondContact O-N 3.39Å; M401-T404 PolarHBondContact O-N 3.39Å; M401-Q405 HydrophobicContact CG-CG 4.47Å; M401-Q405 VanDerWaalsContact O-CG 3.29Å; M401-Q405 WeakPolarHBondContact O-CG 3.37Å; M401-Q405 PolarHBondContact O-N 3.18Å
402	M	97.4	Very high	98.1	Very high	7 Å²	7	66.5 Å²	66.5	3%	0.034	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-35.5	177.8	-74	163.9	53.9	0	0	112.8	L398 T399 Q400 R406 S437 E441 L444	L398-M402 HydrophobicContact CD1-CG 4.05Å; L398-M402 HydrophobicContact CD1-SD 3.86Å; L398-M402 HydrophobicContact CG-CG 4.48Å; L398-M402 HydrophobicContact CG-SD 3.75Å; L398-M402 WeakPolarHBondContact O-CB 3.03Å; L398-M402 WeakPolarHBondContact O-CG 3.3Å; L398-M402 PolarHBondContact O-N 3.35Å; T399-M402 PolarHBondContact O-N 3.02Å; Q400-M402 PolarHBondContact O-N 2.95Å; M402-R406 WeakPolarHBondContact O-CG 3.44Å; M402-R406 PolarHBondContact O-N 3.13Å; M402-R406 VanDerWaalsContact O-N 3.17Å; M402-S437 PolarHBondContact O-OG 3.48Å; M402-E441 HydrophobicContact CE-CB 4.21Å; M402-E441 HydrophobicContact CE-CG 3.49Å; M402-E441 VanDerWaalsContact CE-CG 3.49Å; M402-L444 HydrophobicContact CE-CD2 4.24Å; M402-L444 HydrophobicContact SD-CB 4.39Å; M402-L444 HydrophobicContact SD-CD2 4.26Å
403	Q	97.8	Very high	98.1	Very high	106 Å²	106	63.9 Å²	63.9	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-47.6	174.5	179.3	176	-15.2	0	0	111.1	T399 Q400 M401 Q405 R406 Q407	T399-Q403 PolarHBondContact O-N 2.89Å; T399-Q403 VanDerWaalsContact O-N 3.09Å; Q400-Q403 WeakPolarHBondContact O-CB 3.38Å; Q400-Q403 PolarHBondContact O-N 2.92Å; M401-Q403 VanDerWaalsContact C-N 3.29Å; M401-Q403 PolarHBondContact O-N 3.39Å; Q403-Q405 VanDerWaalsContact C-N 3.3Å; Q403-Q405 PolarHBondContact O-N 3.4Å; Q403-R406 PolarHBondContact O-N 2.9Å; Q403-Q407 WeakPolarHBondContact O-CG 3.48Å; Q403-Q407 PolarHBondContact O-N 3.18Å; Q403-Q407 VanDerWaalsContact O-N 3.09Å
404	T	98.3	Very high	98	Very high	84 Å²	84	63.9 Å²	63.9	52%	0.515	33%	0.33	S	S	.	.	H	α-helix	trans	-60.4	-39.8	175.7	-54.9	0	0	0	0	111.7	Q400 M401 R406 Q407 L408	Q400-T404 PolarHBondContact O-N 3.22Å; Q400-T404 PolarHBondContact O-OG1 2.92Å; M401-T404 PolarHBondContact O-N 3.39Å; T404-R406 PolarHBondContact O-N 2.96Å; T404-Q407 PolarHBondContact O-N 3.4Å; T404-L408 VanDerWaalsContact O-CB 3.27Å; T404-L408 WeakPolarHBondContact O-CB 3.38Å; T404-L408 PolarHBondContact O-N 3.39Å
405	Q	97.5	Very high	98	Very high	21 Å²	21	64.1 Å²	64.1	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-42.6	175.1	-73.8	174	-24.8	0	0	112.3	M401 Q403 G409 Q433	M401-Q405 HydrophobicContact CG-CG 4.47Å; M401-Q405 VanDerWaalsContact O-CG 3.29Å; M401-Q405 WeakPolarHBondContact O-CG 3.37Å; M401-Q405 PolarHBondContact O-N 3.18Å; Q403-Q405 VanDerWaalsContact C-N 3.3Å; Q403-Q405 PolarHBondContact O-N 3.4Å; Q405-G409 PolarHBondContact O-N 3.04Å; Q405-Q433 WeakPolarHBondContact O-CB 3.29Å
406	R	97.8	Very high	97.9	Very high	106 Å²	106	64.1 Å²	64.1	40%	0.4	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-50.9	174.8	-66.8	174	-168.1	151.8	-4.2	111.3	M402 Q403 T404 L408 G409 D410 S437 E441	M402-R406 WeakPolarHBondContact O-CG 3.44Å; M402-R406 PolarHBondContact O-N 3.13Å; M402-R406 VanDerWaalsContact O-N 3.17Å; Q403-R406 PolarHBondContact O-N 2.9Å; T404-R406 PolarHBondContact O-N 2.96Å; R406-L408 VanDerWaalsContact C-N 3.31Å; R406-L408 PolarHBondContact O-N 2.96Å; R406-G409 CarbonylContact O-C 3.59Å; R406-G409 PolarHBondContact O-N 3.06Å; R406-G409 VanDerWaalsContact O-N 3.1Å; R406-D410 PolarHBondContact O-N 3.31Å; R406-S437 VanDerWaalsContact CG-OG 3.28Å; R406-S437 WeakPolarHBondContact CG-OG 3.45Å; R406-S437 PolarHBondContact NE-OG 3.44Å; R406-E441 IonicContact CZ-OE1 3.03Å; R406-E441 IonicContact NH2-OE1 2.7Å; R406-E441 PolarHBondContact NH2-OE1 3.35Å
407	Q	98.3	Very high	97.8	Very high	115 Å²	115	66.2 Å²	66.2	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-59	-41.8	-179.5	-69.5	176.9	-16.4	0	0	112.2	Q403 T404 D410 A411	Q403-Q407 WeakPolarHBondContact O-CG 3.48Å; Q403-Q407 PolarHBondContact O-N 3.18Å; Q403-Q407 VanDerWaalsContact O-N 3.09Å; T404-Q407 PolarHBondContact O-N 3.4Å; Q407-D410 PolarHBondContact O-N 3.33Å; Q407-A411 WeakPolarHBondContact O-CB 3.43Å; Q407-A411 PolarHBondContact O-N 2.98Å
408	L	98.2	Very high	97.7	Very high	68 Å²	68	67.4 Å²	67.4	36%	0.356	35%	0.345	S	S	.	.	H	α-helix	trans	-66.5	-41.5	175.1	-177.5	59.9	0	0	0	111.8	T404 R406 D410 A411 F412 Q433	T404-L408 VanDerWaalsContact O-CB 3.27Å; T404-L408 WeakPolarHBondContact O-CB 3.38Å; T404-L408 PolarHBondContact O-N 3.39Å; R406-L408 VanDerWaalsContact C-N 3.31Å; R406-L408 PolarHBondContact O-N 2.96Å; L408-D410 VanDerWaalsContact C-N 3.34Å; L408-D410 PolarHBondContact O-N 2.96Å; L408-A411 PolarHBondContact O-N 3.34Å; L408-F412 HydrophobicContact CD1-CD2 4.19Å; L408-F412 HydrophobicContact CD1-CE1 4.14Å; L408-F412 HydrophobicContact CD1-CE2 3.67Å; L408-F412 HydrophobicContact CD1-CZ 3.64Å; L408-F412 HydrophobicContact CD2-CE2 4.01Å; L408-F412 HydrophobicContact CD2-CZ 4.43Å; L408-F412 HydrophobicContact CG-CD2 3.98Å; L408-F412 HydrophobicContact CG-CE2 3.53Å; L408-F412 HydrophobicContact CG-CZ 4.03Å; L408-F412 VanDerWaalsContact O-CD2 3.31Å; L408-F412 WeakPolarHBondContact O-CD2 3.48Å; L408-F412 WeakPolarHBondContact O-CG 3.29Å; L408-F412 PolarHBondContact O-N 3.03Å; L408-Q433 HydrophobicContact CD2-CG 4.16Å; L408-Q433 HydrophobicContact CG-CG 4.28Å
409	G	97.6	Very high	97.6	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-66.5	-32.7	176	0	0	0	0	0	113.8	Q405 R406 A413 A430 K434	Q405-G409 PolarHBondContact O-N 3.04Å; R406-G409 CarbonylContact O-C 3.59Å; R406-G409 PolarHBondContact O-N 3.06Å; R406-G409 VanDerWaalsContact O-N 3.1Å; G409-A413 WeakPolarHBondContact O-CB 3.11Å; G409-A413 PolarHBondContact O-N 3.02Å; G409-A413 VanDerWaalsContact O-N 3.14Å; G409-A430 WeakPolarHBondContact O-CB 3.36Å; G409-K434 VanDerWaalsContact C-CE 3.49Å; G409-K434 WeakPolarHBondContact O-CE 3.48Å
410	D	98.2	Very high	97.2	Very high	87 Å²	87	71 Å²	71	47%	0.465	37%	0.372	S	S	.	.	H	α-helix	trans	-75.2	-39	174	-70.1	-35.9	0	0	0	111.9	R406 Q407 L408 A413 D414 K434	R406-D410 PolarHBondContact O-N 3.31Å; Q407-D410 PolarHBondContact O-N 3.33Å; L408-D410 VanDerWaalsContact C-N 3.34Å; L408-D410 PolarHBondContact O-N 2.96Å; D410-A413 PolarHBondContact O-N 3.31Å; D410-D414 WeakPolarHBondContact O-CB 3.4Å; D410-D414 PolarHBondContact O-N 3.23Å; D410-K434 WeakPolarHBondContact OD1-CE 3.25Å; D410-K434 IonicContact OD1-NZ 2.75Å; D410-K434 PolarHBondContact OD1-NZ 3.29Å
411	A	98.3	Very high	97	Very high	47 Å²	47	73.9 Å²	73.9	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-41.7	172.9	0	0	0	0	0	112.4	Q407 L408 D414 L415	Q407-A411 WeakPolarHBondContact O-CB 3.43Å; Q407-A411 PolarHBondContact O-N 2.98Å; L408-A411 PolarHBondContact O-N 3.34Å; A411-D414 PolarHBondContact O-N 3.49Å; A411-L415 WeakPolarHBondContact O-CB 3.29Å; A411-L415 VanDerWaalsContact O-CG 3.32Å; A411-L415 WeakPolarHBondContact O-CG 3.32Å; A411-L415 PolarHBondContact O-N 2.98Å
412	F	98.1	Very high	96.7	Very high	45 Å²	45	73.9 Å²	73.9	20%	0.197	39%	0.387	C	S	.	.	H	α-helix	trans	-64	-42.3	173.2	-72.1	-38.1	0	0	0	112.1	L408 D414 L415 G416 F426 N429 A430 Q433	L408-F412 HydrophobicContact CD1-CD2 4.19Å; L408-F412 HydrophobicContact CD1-CE1 4.14Å; L408-F412 HydrophobicContact CD1-CE2 3.67Å; L408-F412 HydrophobicContact CD1-CZ 3.64Å; L408-F412 HydrophobicContact CD2-CE2 4.01Å; L408-F412 HydrophobicContact CD2-CZ 4.43Å; L408-F412 HydrophobicContact CG-CD2 3.98Å; L408-F412 HydrophobicContact CG-CE2 3.53Å; L408-F412 HydrophobicContact CG-CZ 4.03Å; L408-F412 VanDerWaalsContact O-CD2 3.31Å; L408-F412 WeakPolarHBondContact O-CD2 3.48Å; L408-F412 WeakPolarHBondContact O-CG 3.29Å; L408-F412 PolarHBondContact O-N 3.03Å; F412-D414 PolarHBondContact O-N 2.95Å; F412-L415 PolarHBondContact O-N 3.05Å; F412-G416 PolarHBondContact O-N 3.48Å; F412-F426 HydrophobicContact CB-CD1 4.33Å; F412-F426 AromaticContact CD1-CD1 3.72Å; F412-F426 HydrophobicContact CD1-CD1 3.72Å; F412-F426 AromaticContact CD1-CE1 3.95Å; F412-F426 HydrophobicContact CD1-CE1 3.95Å; F412-F426 HydrophobicContact CE1-CD1 4.49Å; F412-F426 HydrophobicContact CE1-CE1 4.41Å; F412-F426 HydrophobicContact CG-CD1 4.39Å; F412-F426 WeakPolarHBondContact O-CB 3.19Å; F412-N429 HydrophobicContact CD2-CB 3.64Å; F412-N429 HydrophobicContact CE2-CB 3.77Å; F412-N429 HydrophobicContact CG-CB 4.15Å; F412-N429 HydrophobicContact CZ-CB 4.38Å; F412-A430 HydrophobicContact CB-CB 3.87Å; F412-Q433 HydrophobicContact CD2-CG 4.41Å; F412-Q433 HydrophobicContact CE2-CG 4.3Å
413	A	97.5	Very high	96.5	Very high	31 Å²	31	78.1 Å²	78.1	26%	0.256	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-42	177.2	0	0	0	0	0	112.5	G409 D410 G416 L417 A430	G409-A413 WeakPolarHBondContact O-CB 3.11Å; G409-A413 PolarHBondContact O-N 3.02Å; G409-A413 VanDerWaalsContact O-N 3.14Å; D410-A413 PolarHBondContact O-N 3.31Å; A413-G416 PolarHBondContact O-N 3.49Å; A413-L417 WeakPolarHBondContact O-CG 3.46Å; A413-L417 PolarHBondContact O-N 3.42Å; A413-L417 VanDerWaalsContact O-N 3.13Å; A413-A430 HydrophobicContact CB-CB 4.08Å
414	D	98	Very high	96.1	Very high	72 Å²	72	80.9 Å²	80.9	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-41.6	175.7	175	70.7	0	0	0	112.6	D410 A411 F412 L417 K418	D410-D414 WeakPolarHBondContact O-CB 3.4Å; D410-D414 PolarHBondContact O-N 3.23Å; A411-D414 PolarHBondContact O-N 3.49Å; F412-D414 PolarHBondContact O-N 2.95Å; D414-L417 PolarHBondContact O-N 3.44Å; D414-K418 WeakPolarHBondContact O-CG 3.04Å; D414-K418 PolarHBondContact O-N 2.87Å; D414-K418 WeakPolarHBondContact OD1-CE 3.35Å; D414-K418 IonicContact OD1-NZ 2.64Å; D414-K418 PolarHBondContact OD1-NZ 2.96Å; D414-K418 WeakPolarHBondContact OD2-CE 3.2Å; D414-K418 IonicContact OD2-NZ 2.67Å; D414-K418 PolarHBondContact OD2-NZ 3.07Å
415	L	97.6	Very high	95.7	Very high	72 Å²	72	81.9 Å²	81.9	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-65.2	-41.3	173.8	-72.6	171.3	0	0	0	112.2	A411 F412 L417 K418 S419 F426	A411-L415 WeakPolarHBondContact O-CB 3.29Å; A411-L415 VanDerWaalsContact O-CG 3.32Å; A411-L415 WeakPolarHBondContact O-CG 3.32Å; A411-L415 PolarHBondContact O-N 2.98Å; F412-L415 PolarHBondContact O-N 3.05Å; L415-L417 VanDerWaalsContact C-N 3.27Å; L415-L417 PolarHBondContact O-N 2.87Å; L415-K418 CarbonylContact O-C 3.57Å; L415-K418 PolarHBondContact O-N 3.34Å; L415-S419 WeakPolarHBondContact O-CB 3.29Å; L415-S419 PolarHBondContact O-N 3.28Å; L415-F426 HydrophobicContact CB-CD1 3.96Å; L415-F426 HydrophobicContact CB-CD2 4.15Å; L415-F426 HydrophobicContact CB-CE1 3.83Å; L415-F426 HydrophobicContact CB-CE2 4.03Å; L415-F426 HydrophobicContact CB-CG 4.14Å; L415-F426 HydrophobicContact CB-CZ 3.87Å; L415-F426 HydrophobicContact CD1-CD1 4.49Å; L415-F426 HydrophobicContact CD1-CE1 3.79Å; L415-F426 HydrophobicContact CD1-CZ 4.09Å; L415-F426 HydrophobicContact CG-CE1 4.46Å
416	G	96.9	Very high	95.5	Very high	2 Å²	2	83 Å²	83	2%	0.021	42%	0.422	C	S	.	.	H	α-helix	trans	-61.6	-33	175.8	0	0	0	0	0	113.3	F412 A413 H423 F426	F412-G416 PolarHBondContact O-N 3.48Å; A413-G416 PolarHBondContact O-N 3.49Å; G416-H423 PolarHBondContact O-ND1 3.41Å; G416-F426 VanDerWaalsContact CA-CB 3.5Å
417	L	95.9	Very high	95.2	Very high	135 Å²	135	79 Å²	79	71%	0.707	41%	0.414	S	S	*	.	H	α-helix	trans	-74.1	-24.9	173.3	-69.1	171.8	0	0	0	113.3	A413 D414 L415	A413-L417 WeakPolarHBondContact O-CG 3.46Å; A413-L417 PolarHBondContact O-N 3.42Å; A413-L417 VanDerWaalsContact O-N 3.13Å; D414-L417 PolarHBondContact O-N 3.44Å; L415-L417 VanDerWaalsContact C-N 3.27Å; L415-L417 PolarHBondContact O-N 2.87Å
418	K	96.4	Very high	94.8	Very high	135 Å²	135	75.8 Å²	75.8	59%	0.587	40%	0.398	S	S	*	.	H	α-helix	trans	-92.1	-19.8	-179.9	-70.5	168.6	-175	168.7	0	113.8	D414 L415 P420	D414-K418 WeakPolarHBondContact O-CG 3.04Å; D414-K418 PolarHBondContact O-N 2.87Å; D414-K418 WeakPolarHBondContact OD1-CE 3.35Å; D414-K418 IonicContact OD1-NZ 2.64Å; D414-K418 PolarHBondContact OD1-NZ 2.96Å; D414-K418 WeakPolarHBondContact OD2-CE 3.2Å; D414-K418 IonicContact OD2-NZ 2.67Å; D414-K418 PolarHBondContact OD2-NZ 3.07Å; L415-K418 CarbonylContact O-C 3.57Å; L415-K418 PolarHBondContact O-N 3.34Å; K418-P420 WeakPolarHBondContact O-CD 3.35Å
419	S	94.3	Very high	94.5	Very high	42 Å²	42	75.2 Å²	75.2	29%	0.294	40%	0.395	S	S	.	.			trans	-123.7	80	-177	-61.2	0	0	0	0	110.8	L415 E421 L422 H423	L415-S419 WeakPolarHBondContact O-CB 3.29Å; L415-S419 PolarHBondContact O-N 3.28Å; S419-E421 PolarHBondContact O-N 3.36Å; S419-E421 VanDerWaalsContact O-N 3.11Å; S419-L422 CarbonylContact O-C 3.53Å; S419-L422 PolarHBondContact O-N 2.98Å; S419-H423 PolarHBondContact O-N 3.47Å
420	P	91.6	Very high	94.4	Very high	107 Å²	107	75.3 Å²	75.3	70%	0.695	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-57.7	-28.1	-176.2	-26.2	35.5	0	0	0	114.4	K418 L422	K418-P420 WeakPolarHBondContact O-CD 3.35Å; P420-L422 PolarHBondContact O-N 3.2Å
421	E	93.7	Very high	94.1	Very high	187 Å²	187	76.4 Å²	76.4	87%	0.874	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-71.6	-12.3	177.5	-61.5	177.5	178.1	0	0	113.8	S419	S419-E421 PolarHBondContact O-N 3.36Å; S419-E421 VanDerWaalsContact O-N 3.11Å
422	L	91.6	Very high	93.8	Very high	83 Å²	83	75.1 Å²	75.1	44%	0.435	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-130	20.9	-179.5	-63.9	173.5	0	0	0	111.8	S419 P420 E424 E425 F426	S419-L422 CarbonylContact O-C 3.53Å; S419-L422 PolarHBondContact O-N 2.98Å; P420-L422 PolarHBondContact O-N 3.2Å; L422-E424 PolarHBondContact O-N 3.36Å; L422-E425 VanDerWaalsContact CA-OE2 3.29Å; L422-E425 WeakPolarHBondContact CA-OE2 3.45Å; L422-F426 HydrophobicContact CB-CD2 3.74Å; L422-F426 HydrophobicContact CB-CE2 3.79Å; L422-F426 HydrophobicContact CD1-CE2 4.03Å; L422-F426 WeakPolarHBondContact O-CB 3.37Å; L422-F426 VanDerWaalsContact O-CD2 3.23Å; L422-F426 WeakPolarHBondContact O-CD2 3.3Å; L422-F426 PolarHBondContact O-N 3.45Å; L422-F426 VanDerWaalsContact O-N 3.08Å
423	H	92.6	Very high	93.7	Very high	96 Å²	96	74.8 Å²	74.8	44%	0.444	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-40.6	-170.2	-176.5	75	0	0	0	112.6	G416 S419 G427	G416-H423 PolarHBondContact O-ND1 3.41Å; S419-H423 PolarHBondContact O-N 3.47Å; H423-G427 PolarHBondContact O-N 3.47Å
424	E	89.6	Confident	93.5	Very high	164 Å²	164	76.6 Å²	76.6	77%	0.766	39%	0.39	S	S	*	.	H	α-helix	trans	-73.5	-40	-176.4	-61.5	-169.6	175.7	0	0	111.5	L422 G427 Y428	L422-E424 PolarHBondContact O-N 3.36Å; E424-G427 PolarHBondContact O-N 3.01Å; E424-Y428 VanDerWaalsContact O-CB 3.31Å; E424-Y428 WeakPolarHBondContact O-CB 3.28Å; E424-Y428 PolarHBondContact O-N 3.27Å
425	E	89.2	Confident	93.3	Very high	105 Å²	105	76.3 Å²	76.3	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-65.8	-44.9	177	-61.7	88.7	159	0	0	111.5	L422 N429	L422-E425 VanDerWaalsContact CA-OE2 3.29Å; L422-E425 WeakPolarHBondContact CA-OE2 3.45Å; E425-N429 PolarHBondContact O-N 3.03Å; E425-N429 PolarHBondContact O-ND2 2.62Å
426	F	94.1	Very high	93.1	Very high	43 Å²	43	74.8 Å²	74.8	19%	0.189	38%	0.38	C	S	.	.	H	α-helix	trans	-66.1	-42.2	174.6	-82.7	-54.8	0	0	0	111.8	F412 L415 G416 L422 N429 A430	F412-F426 HydrophobicContact CB-CD1 4.33Å; F412-F426 AromaticContact CD1-CD1 3.72Å; F412-F426 HydrophobicContact CD1-CD1 3.72Å; F412-F426 AromaticContact CD1-CE1 3.95Å; F412-F426 HydrophobicContact CD1-CE1 3.95Å; F412-F426 HydrophobicContact CE1-CD1 4.49Å; F412-F426 HydrophobicContact CE1-CE1 4.41Å; F412-F426 HydrophobicContact CG-CD1 4.39Å; F412-F426 WeakPolarHBondContact O-CB 3.19Å; L415-F426 HydrophobicContact CB-CD1 3.96Å; L415-F426 HydrophobicContact CB-CD2 4.15Å; L415-F426 HydrophobicContact CB-CE1 3.83Å; L415-F426 HydrophobicContact CB-CE2 4.03Å; L415-F426 HydrophobicContact CB-CG 4.14Å; L415-F426 HydrophobicContact CB-CZ 3.87Å; L415-F426 HydrophobicContact CD1-CD1 4.49Å; L415-F426 HydrophobicContact CD1-CE1 3.79Å; L415-F426 HydrophobicContact CD1-CZ 4.09Å; L415-F426 HydrophobicContact CG-CE1 4.46Å; G416-F426 VanDerWaalsContact CA-CB 3.5Å; L422-F426 HydrophobicContact CB-CD2 3.74Å; L422-F426 HydrophobicContact CB-CE2 3.79Å; L422-F426 HydrophobicContact CD1-CE2 4.03Å; L422-F426 WeakPolarHBondContact O-CB 3.37Å; L422-F426 VanDerWaalsContact O-CD2 3.23Å; L422-F426 WeakPolarHBondContact O-CD2 3.3Å; L422-F426 PolarHBondContact O-N 3.45Å; L422-F426 VanDerWaalsContact O-N 3.08Å; F426-N429 PolarHBondContact O-N 3.26Å; F426-A430 VanDerWaalsContact O-CB 3.31Å; F426-A430 WeakPolarHBondContact O-CB 3.21Å; F426-A430 PolarHBondContact O-N 2.72Å
427	G	92.1	Very high	93	Very high	23 Å²	23	74.8 Å²	74.8	24%	0.237	38%	0.38	C	S	.	.	H	α-helix	trans	-60.2	-48	175.6	0	0	0	0	0	112.8	H423 E424 N429 A430 D431	H423-G427 PolarHBondContact O-N 3.47Å; E424-G427 PolarHBondContact O-N 3.01Å; G427-N429 VanDerWaalsContact C-N 3.33Å; G427-N429 PolarHBondContact O-N 2.77Å; G427-A430 WeakPolarHBondContact O-CB 3.34Å; G427-A430 PolarHBondContact O-N 2.77Å; G427-A430 VanDerWaalsContact O-N 3.13Å; G427-D431 PolarHBondContact O-N 3.2Å
428	Y	89.9	Confident	92.9	Very high	47 Å²	47	75 Å²	75	18%	0.184	38%	0.375	C	S	.	.	H	α-helix	trans	-61.6	-39.4	179.2	-173.1	-100.8	0	0	0	112.8	E424 T432 Q559 Q562 T563	E424-Y428 VanDerWaalsContact O-CB 3.31Å; E424-Y428 WeakPolarHBondContact O-CB 3.28Å; E424-Y428 PolarHBondContact O-N 3.27Å; Y428-T432 VanDerWaalsContact O-CB 3.29Å; Y428-T432 WeakPolarHBondContact O-CB 3.35Å; Y428-T432 PolarHBondContact O-N 2.98Å; Y428-T432 VanDerWaalsContact O-N 3.1Å; Y428-T432 PolarHBondContact O-OG1 2.64Å; Y428-Q559 PolarHBondContact OH-NE2 3.38Å; Y428-Q559 PolarHBondContact OH-O 3.15Å; Y428-Q562 WeakPolarHBondContact OH-CB 3.42Å; Y428-T563 HydrophobicContact CE1-CG2 4.32Å; Y428-T563 WeakPolarHBondContact CE1-OG1 3.33Å; Y428-T563 PolarHBondContact OH-N 2.96Å; Y428-T563 PolarHBondContact OH-OG1 2.98Å
429	N	91.6	Very high	92.8	Very high	56 Å²	56	70.8 Å²	70.8	30%	0.299	36%	0.359	S	S	.	.	H	α-helix	trans	-69.4	-40.5	173.7	-80.4	-85.1	0	0	0	112	F412 E425 F426 G427 T432 Q433	F412-N429 HydrophobicContact CD2-CB 3.64Å; F412-N429 HydrophobicContact CE2-CB 3.77Å; F412-N429 HydrophobicContact CG-CB 4.15Å; F412-N429 HydrophobicContact CZ-CB 4.38Å; E425-N429 PolarHBondContact O-N 3.03Å; E425-N429 PolarHBondContact O-ND2 2.62Å; F426-N429 PolarHBondContact O-N 3.26Å; G427-N429 VanDerWaalsContact C-N 3.33Å; G427-N429 PolarHBondContact O-N 2.77Å; N429-T432 PolarHBondContact O-N 3.24Å; N429-Q433 WeakPolarHBondContact O-CG 3.42Å; N429-Q433 PolarHBondContact O-N 2.82Å
430	A	94.9	Very high	92.9	Very high	3 Å²	3	68.8 Å²	68.8	3%	0.025	35%	0.345	C	S	.	.	H	α-helix	trans	-58.7	-51	176.7	0	0	0	0	0	112.2	G409 F412 A413 F426 G427 Q433 K434	G409-A430 WeakPolarHBondContact O-CB 3.36Å; F412-A430 HydrophobicContact CB-CB 3.87Å; A413-A430 HydrophobicContact CB-CB 4.08Å; F426-A430 VanDerWaalsContact O-CB 3.31Å; F426-A430 WeakPolarHBondContact O-CB 3.21Å; F426-A430 PolarHBondContact O-N 2.72Å; G427-A430 WeakPolarHBondContact O-CB 3.34Å; G427-A430 PolarHBondContact O-N 2.77Å; G427-A430 VanDerWaalsContact O-N 3.13Å; A430-Q433 PolarHBondContact O-N 3.02Å; A430-K434 WeakPolarHBondContact O-CB 3.41Å; A430-K434 VanDerWaalsContact O-CG 3.3Å; A430-K434 WeakPolarHBondContact O-CG 3.28Å; A430-K434 PolarHBondContact O-N 3.4Å
431	D	92.4	Very high	93.1	Very high	110 Å²	110	68.2 Å²	68.2	59%	0.588	33%	0.333	S	S	*	.	H	α-helix	trans	-66.8	-38.1	-179.6	-75.4	-18.6	0	0	0	111.9	G427 K434 L435	G427-D431 PolarHBondContact O-N 3.2Å; D431-K434 PolarHBondContact O-N 2.88Å; D431-L435 WeakPolarHBondContact O-CB 3.43Å; D431-L435 PolarHBondContact O-N 3.38Å
432	T	92.8	Very high	93.1	Very high	19 Å²	19	64.6 Å²	64.6	12%	0.117	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-46.2	175.5	-62.1	0	0	0	0	111.5	Y428 N429 K434 L435 L436 Q559	Y428-T432 VanDerWaalsContact O-CB 3.29Å; Y428-T432 WeakPolarHBondContact O-CB 3.35Å; Y428-T432 PolarHBondContact O-N 2.98Å; Y428-T432 VanDerWaalsContact O-N 3.1Å; Y428-T432 PolarHBondContact O-OG1 2.64Å; N429-T432 PolarHBondContact O-N 3.24Å; T432-K434 PolarHBondContact O-N 3.32Å; T432-L435 PolarHBondContact O-N 3.45Å; T432-L436 HydrophobicContact CG2-CD1 4.3Å; T432-L436 VanDerWaalsContact O-CG 3.31Å; T432-L436 WeakPolarHBondContact O-CG 3.47Å; T432-L436 PolarHBondContact O-N 3.38Å; T432-Q559 HydrophobicContact CG2-CG 3.97Å; T432-Q559 PolarHBondContact OG1-NE2 3.2Å
433	Q	94.9	Very high	93.4	Very high	39 Å²	39	61.1 Å²	61.1	18%	0.182	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-37.4	177.9	-63.8	-64.4	-12.9	0	0	112.3	Q405 L408 F412 N429 A430 L436 S437	Q405-Q433 WeakPolarHBondContact O-CB 3.29Å; L408-Q433 HydrophobicContact CD2-CG 4.16Å; L408-Q433 HydrophobicContact CG-CG 4.28Å; F412-Q433 HydrophobicContact CD2-CG 4.41Å; F412-Q433 HydrophobicContact CE2-CG 4.3Å; N429-Q433 WeakPolarHBondContact O-CG 3.42Å; N429-Q433 PolarHBondContact O-N 2.82Å; A430-Q433 PolarHBondContact O-N 3.02Å; Q433-L436 PolarHBondContact O-N 3.34Å; Q433-S437 WeakPolarHBondContact O-CB 3.26Å; Q433-S437 PolarHBondContact O-N 2.88Å; Q433-S437 VanDerWaalsContact O-N 3.08Å
434	K	94.4	Very high	93.7	Very high	69 Å²	69	57.9 Å²	57.9	30%	0.3	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-38.9	176	-72.6	171.4	-179.8	-176.1	0	112.2	G409 D410 A430 D431 T432 K438	G409-K434 VanDerWaalsContact C-CE 3.49Å; G409-K434 WeakPolarHBondContact O-CE 3.48Å; D410-K434 WeakPolarHBondContact OD1-CE 3.25Å; D410-K434 IonicContact OD1-NZ 2.75Å; D410-K434 PolarHBondContact OD1-NZ 3.29Å; A430-K434 WeakPolarHBondContact O-CB 3.41Å; A430-K434 VanDerWaalsContact O-CG 3.3Å; A430-K434 WeakPolarHBondContact O-CG 3.28Å; A430-K434 PolarHBondContact O-N 3.4Å; D431-K434 PolarHBondContact O-N 2.88Å; T432-K434 PolarHBondContact O-N 3.32Å; K434-K438 WeakPolarHBondContact O-CB 3.32Å; K434-K438 PolarHBondContact O-N 3.03Å
435	L	92.4	Very high	94.1	Very high	65 Å²	65	52 Å²	52	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-47.6	174	179.6	61.4	0	0	0	112.1	D431 T432 S437 K438 N439 Q559	D431-L435 WeakPolarHBondContact O-CB 3.43Å; D431-L435 PolarHBondContact O-N 3.38Å; T432-L435 PolarHBondContact O-N 3.45Å; L435-S437 VanDerWaalsContact C-N 3.31Å; L435-S437 PolarHBondContact O-N 3.44Å; L435-K438 PolarHBondContact O-N 2.87Å; L435-N439 WeakPolarHBondContact O-CB 3.4Å; L435-N439 PolarHBondContact O-N 3.22Å; L435-Q559 HydrophobicContact CD2-CB 4.35Å; L435-Q559 HydrophobicContact CD2-CG 4.36Å
436	L	93.9	Very high	94.5	Very high	41 Å²	41	48.5 Å²	48.5	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-41.7	178.3	-71.9	174.3	0	0	0	112.2	T432 Q433 G440 Y552 N556	T432-L436 HydrophobicContact CG2-CD1 4.3Å; T432-L436 VanDerWaalsContact O-CG 3.31Å; T432-L436 WeakPolarHBondContact O-CG 3.47Å; T432-L436 PolarHBondContact O-N 3.38Å; Q433-L436 PolarHBondContact O-N 3.34Å; L436-G440 PolarHBondContact O-N 3.44Å; L436-G440 VanDerWaalsContact O-N 3.1Å; L436-Y552 PolarHBondContact O-OH 2.93Å; L436-N556 HydrophobicContact CD2-CB 3.84Å; L436-N556 VanDerWaalsContact CD2-CG 3.5Å
437	S	95.4	Very high	94.7	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-66.1	-47.7	176.5	-172	0	0	0	0	111.8	M402 R406 Q433 L435 N439 G440 E441	M402-S437 PolarHBondContact O-OG 3.48Å; R406-S437 VanDerWaalsContact CG-OG 3.28Å; R406-S437 WeakPolarHBondContact CG-OG 3.45Å; R406-S437 PolarHBondContact NE-OG 3.44Å; Q433-S437 WeakPolarHBondContact O-CB 3.26Å; Q433-S437 PolarHBondContact O-N 2.88Å; Q433-S437 VanDerWaalsContact O-N 3.08Å; L435-S437 VanDerWaalsContact C-N 3.31Å; L435-S437 PolarHBondContact O-N 3.44Å; S437-N439 PolarHBondContact O-N 3.48Å; S437-G440 WeakPolarHBondContact O-CA 3.38Å; S437-G440 PolarHBondContact O-N 3.26Å; S437-E441 PolarHBondContact O-N 3.37Å
438	K	93.8	Very high	95	Very high	139 Å²	139	49 Å²	49	60%	0.604	26%	0.263	S	S	*	.	H	α-helix	trans	-60.4	-44.6	178.3	-176.8	-177.9	178.2	-176.7	0	112.4	K434 L435 G440 E441	K434-K438 WeakPolarHBondContact O-CB 3.32Å; K434-K438 PolarHBondContact O-N 3.03Å; L435-K438 PolarHBondContact O-N 2.87Å; K438-G440 PolarHBondContact O-N 3.28Å; K438-E441 WeakPolarHBondContact O-CB 3.46Å; K438-E441 PolarHBondContact O-N 2.94Å
439	N	93.1	Very high	95.3	Very high	47 Å²	47	52 Å²	52	25%	0.251	28%	0.277	S	S	.	.	H	α-helix	trans	-65.7	-27	175.6	-71.5	-8.4	0	0	0	111.6	L435 S437 E441 T442 L443 Y552 N556	L435-N439 WeakPolarHBondContact O-CB 3.4Å; L435-N439 PolarHBondContact O-N 3.22Å; S437-N439 PolarHBondContact O-N 3.48Å; N439-E441 VanDerWaalsContact C-N 3.31Å; N439-E441 PolarHBondContact O-N 2.8Å; N439-T442 PolarHBondContact O-N 2.76Å; N439-L443 PolarHBondContact O-N 3.34Å; N439-Y552 HydrophobicContact CB-CD2 4.02Å; N439-Y552 HydrophobicContact CB-CE2 3.92Å; N439-N556 PolarHBondContact ND2-OD1 3.24Å
440	G	96.5	Very high	95.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-29.9	174.3	0	0	0	0	0	113.4	L436 S437 K438 T442 L443 L444	L436-G440 PolarHBondContact O-N 3.44Å; L436-G440 VanDerWaalsContact O-N 3.1Å; S437-G440 WeakPolarHBondContact O-CA 3.38Å; S437-G440 PolarHBondContact O-N 3.26Å; K438-G440 PolarHBondContact O-N 3.28Å; G440-T442 PolarHBondContact O-N 3.28Å; G440-L443 PolarHBondContact O-N 3.18Å; G440-L444 VanDerWaalsContact O-CB 3.26Å; G440-L444 WeakPolarHBondContact O-CB 3.31Å; G440-L444 PolarHBondContact O-N 2.99Å
441	E	96.1	Very high	95.8	Very high	96 Å²	96	49.9 Å²	49.9	45%	0.449	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-43	177.1	-61.5	173.5	-166.3	0	0	111.7	M402 R406 S437 K438 N439 L444 G445	M402-E441 HydrophobicContact CE-CB 4.21Å; M402-E441 HydrophobicContact CE-CG 3.49Å; M402-E441 VanDerWaalsContact CE-CG 3.49Å; R406-E441 IonicContact CZ-OE1 3.03Å; R406-E441 IonicContact NH2-OE1 2.7Å; R406-E441 PolarHBondContact NH2-OE1 3.35Å; S437-E441 PolarHBondContact O-N 3.37Å; K438-E441 WeakPolarHBondContact O-CB 3.46Å; K438-E441 PolarHBondContact O-N 2.94Å; N439-E441 VanDerWaalsContact C-N 3.31Å; N439-E441 PolarHBondContact O-N 2.8Å; E441-L444 PolarHBondContact O-N 3.02Å; E441-G445 PolarHBondContact O-N 3.08Å
442	T	95.1	Very high	96.1	Very high	110 Å²	110	47.2 Å²	47.2	68%	0.675	26%	0.258	S	S	*	.	H	α-helix	trans	-63.9	-43.1	175.8	-54.9	0	0	0	0	111.5	N439 G440 G445 A446	N439-T442 PolarHBondContact O-N 2.76Å; G440-T442 PolarHBondContact O-N 3.28Å; T442-G445 PolarHBondContact O-N 3Å; T442-A446 PolarHBondContact O-N 3.42Å; T442-A446 VanDerWaalsContact O-N 3.15Å
443	L	97.4	Very high	96.3	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-46.3	176.3	176.7	60.3	0	0	0	111.3	L398 N439 G440 G445 A446 I447 A548 I549 Y552	L398-L443 HydrophobicContact CD2-CB 4.27Å; L398-L443 HydrophobicContact CD2-CD2 3.85Å; L398-L443 HydrophobicContact CD2-CG 3.83Å; N439-L443 PolarHBondContact O-N 3.34Å; G440-L443 PolarHBondContact O-N 3.18Å; L443-G445 VanDerWaalsContact C-N 3.27Å; L443-G445 PolarHBondContact O-N 3.06Å; L443-A446 PolarHBondContact O-N 2.91Å; L443-A446 VanDerWaalsContact O-N 3.08Å; L443-I447 HydrophobicContact CD1-CD1 3.95Å; L443-I447 HydrophobicContact CD1-CG1 4.03Å; L443-I447 HydrophobicContact CD2-CD1 4.32Å; L443-I447 HydrophobicContact CG-CD1 3.79Å; L443-I447 HydrophobicContact CG-CG1 4.28Å; L443-I447 WeakPolarHBondContact O-CG1 3.48Å; L443-I447 PolarHBondContact O-N 3.43Å; L443-A548 HydrophobicContact CD1-CB 4.07Å; L443-I549 HydrophobicContact CD1-CD1 3.85Å; L443-I549 HydrophobicContact CD1-CG1 4.18Å; L443-I549 HydrophobicContact CD2-CD1 4.25Å; L443-Y552 HydrophobicContact CB-CD2 4.17Å; L443-Y552 HydrophobicContact CB-CG 4.27Å; L443-Y552 HydrophobicContact CD2-CD1 3.73Å; L443-Y552 HydrophobicContact CD2-CD2 4.22Å; L443-Y552 HydrophobicContact CD2-CE1 4.29Å; L443-Y552 HydrophobicContact CD2-CG 3.69Å
444	L	98.2	Very high	96.4	Very high	29 Å²	29	46.6 Å²	46.6	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-37.9	178.3	-177.2	62	0	0	0	111.5	A395 L398 T399 M402 G440 E441 N448	A395-L444 HydrophobicContact CB-CD1 3.96Å; A395-L444 WeakPolarHBondContact O-CD1 3.42Å; L398-L444 HydrophobicContact CD2-CB 3.95Å; L398-L444 HydrophobicContact CD2-CD1 4.26Å; T399-L444 WeakPolarHBondContact OG1-CD2 3.14Å; M402-L444 HydrophobicContact CE-CD2 4.24Å; M402-L444 HydrophobicContact SD-CB 4.39Å; M402-L444 HydrophobicContact SD-CD2 4.26Å; G440-L444 VanDerWaalsContact O-CB 3.26Å; G440-L444 WeakPolarHBondContact O-CB 3.31Å; G440-L444 PolarHBondContact O-N 2.99Å; E441-L444 PolarHBondContact O-N 3.02Å; L444-N448 WeakPolarHBondContact CD1-ND2 3.48Å; L444-N448 WeakPolarHBondContact O-CB 3.41Å; L444-N448 PolarHBondContact O-N 2.84Å; L444-N448 PolarHBondContact O-ND2 3Å
445	G	97.7	Very high	96.5	Very high	41 Å²	41	45.4 Å²	45.4	42%	0.423	25%	0.253	S	S	.	.	H	α-helix	trans	-60	-46.7	171.2	0	0	0	0	0	112.9	E441 T442 L443 N448 F449	E441-G445 PolarHBondContact O-N 3.08Å; T442-G445 PolarHBondContact O-N 3Å; L443-G445 VanDerWaalsContact C-N 3.27Å; L443-G445 PolarHBondContact O-N 3.06Å; G445-N448 PolarHBondContact O-N 3.24Å; G445-F449 WeakPolarHBondContact O-CB 3.5Å; G445-F449 PolarHBondContact O-N 2.78Å
446	A	97.8	Very high	96.8	Very high	31 Å²	31	45 Å²	45	26%	0.256	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-39.2	178.1	0	0	0	0	0	113.2	T442 L443 F449 F450 A548	T442-A446 PolarHBondContact O-N 3.42Å; T442-A446 VanDerWaalsContact O-N 3.15Å; L443-A446 PolarHBondContact O-N 2.91Å; L443-A446 VanDerWaalsContact O-N 3.08Å; A446-F449 PolarHBondContact O-N 3.06Å; A446-F450 PolarHBondContact O-N 3.05Å; A446-A548 HydrophobicContact CB-CB 3.44Å; A446-A548 VanDerWaalsContact CB-CB 3.44Å
447	I	98.3	Very high	96.9	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-45.3	175.4	-67.9	176.6	0	0	0	110.6	T391 L394 A395 L398 L443 F449 F450 I451 F545 I549	T391-I447 HydrophobicContact CG2-CG2 3.73Å; L394-I447 HydrophobicContact CD2-CD1 4.27Å; L394-I447 HydrophobicContact CG-CD1 4.44Å; A395-I447 HydrophobicContact CB-CG2 3.81Å; L398-I447 HydrophobicContact CD2-CD1 3.83Å; L443-I447 HydrophobicContact CD1-CD1 3.95Å; L443-I447 HydrophobicContact CD1-CG1 4.03Å; L443-I447 HydrophobicContact CD2-CD1 4.32Å; L443-I447 HydrophobicContact CG-CD1 3.79Å; L443-I447 HydrophobicContact CG-CG1 4.28Å; L443-I447 WeakPolarHBondContact O-CG1 3.48Å; L443-I447 PolarHBondContact O-N 3.43Å; I447-F449 VanDerWaalsContact C-N 3.34Å; I447-F449 PolarHBondContact O-N 3.43Å; I447-F450 WeakPolarHBondContact O-CB 3.33Å; I447-F450 PolarHBondContact O-N 3.23Å; I447-I451 HydrophobicContact CG2-CD1 4.09Å; I447-I451 WeakPolarHBondContact O-CG1 3.42Å; I447-I451 PolarHBondContact O-N 3.32Å; I447-F545 HydrophobicContact CG1-CD2 4.46Å; I447-F545 HydrophobicContact CG1-CE2 3.94Å; I447-F545 HydrophobicContact CG2-CE2 4.47Å; I447-I549 HydrophobicContact CD1-CD1 4.46Å
448	N	98.1	Very high	97	Very high	75 Å²	75	43.3 Å²	43.3	40%	0.401	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-35.4	176.1	-77.4	-62.1	0	0	0	112.7	L444 G445 I451 A452	L444-N448 WeakPolarHBondContact CD1-ND2 3.48Å; L444-N448 WeakPolarHBondContact O-CB 3.41Å; L444-N448 PolarHBondContact O-N 2.84Å; L444-N448 PolarHBondContact O-ND2 3Å; G445-N448 PolarHBondContact O-N 3.24Å; N448-I451 PolarHBondContact O-N 3.45Å; N448-A452 PolarHBondContact O-N 2.91Å
449	F	97.6	Very high	97.2	Very high	110 Å²	110	41 Å²	41	48%	0.482	24%	0.239	S	C	.	.	H	α-helix	trans	-62.7	-44.3	172.2	-179.6	-99.1	0	0	0	111.9	G445 A446 I447 A452 N453 L544	G445-F449 WeakPolarHBondContact O-CB 3.5Å; G445-F449 PolarHBondContact O-N 2.78Å; A446-F449 PolarHBondContact O-N 3.06Å; I447-F449 VanDerWaalsContact C-N 3.34Å; I447-F449 PolarHBondContact O-N 3.43Å; F449-A452 PolarHBondContact O-N 3.04Å; F449-N453 VanDerWaalsContact CE1-ND2 3.32Å; F449-N453 WeakPolarHBondContact CE1-ND2 3.34Å; F449-N453 WeakPolarHBondContact CE2-ND2 3.16Å; F449-N453 VanDerWaalsContact CZ-ND2 3.25Å; F449-N453 WeakPolarHBondContact CZ-ND2 3.21Å; F449-N453 PolarHBondContact O-N 2.94Å; F449-N453 VanDerWaalsContact O-N 3.15Å; F449-N453 PolarHBondContact O-ND2 2.72Å; F449-L544 HydrophobicContact CE1-CD1 4.1Å
450	F	98.1	Very high	97.3	Very high	6 Å²	6	45 Å²	45	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-49.8	174.4	174	-92.5	0	0	0	111.6	V387 T391 A446 I447 A452 N453 V454 Q541 L542 F545	V387-F450 HydrophobicContact CG1-CE1 4.29Å; V387-F450 HydrophobicContact CG1-CZ 4.34Å; T391-F450 HydrophobicContact CG2-CD1 3.82Å; T391-F450 HydrophobicContact CG2-CE1 4.11Å; A446-F450 PolarHBondContact O-N 3.05Å; I447-F450 WeakPolarHBondContact O-CB 3.33Å; I447-F450 PolarHBondContact O-N 3.23Å; F450-A452 PolarHBondContact O-N 3.36Å; F450-N453 PolarHBondContact O-N 3.08Å; F450-V454 HydrophobicContact CD1-CG2 4.25Å; F450-V454 HydrophobicContact CD2-CG2 4.28Å; F450-V454 HydrophobicContact CE1-CG2 3.9Å; F450-V454 HydrophobicContact CE2-CG2 3.93Å; F450-V454 HydrophobicContact CG-CG2 4.44Å; F450-V454 HydrophobicContact CZ-CG2 3.74Å; F450-V454 WeakPolarHBondContact O-CG2 3.44Å; F450-V454 PolarHBondContact O-N 3.11Å; F450-Q541 HydrophobicContact CD2-CB 3.83Å; F450-Q541 WeakPolarHBondContact CD2-O 3.38Å; F450-Q541 HydrophobicContact CE2-CB 3.96Å; F450-L542 HydrophobicContact CE2-CD2 4.13Å; F450-L542 HydrophobicContact CZ-CD2 4.26Å; F450-F545 HydrophobicContact CB-CD2 3.98Å; F450-F545 AromaticContact CD1-CD2 3.95Å; F450-F545 HydrophobicContact CD1-CD2 3.95Å; F450-F545 HydrophobicContact CD1-CE2 4.37Å; F450-F545 HydrophobicContact CD2-CB 3.67Å; F450-F545 HydrophobicContact CD2-CD2 4.13Å; F450-F545 HydrophobicContact CD2-CG 4.16Å; F450-F545 HydrophobicContact CE1-CD2 4.45Å; F450-F545 HydrophobicContact CE2-CB 4.05Å; F450-F545 HydrophobicContact CE2-CG 4.4Å; F450-F545 HydrophobicContact CG-CB 4.16Å; F450-F545 AromaticContact CG-CD2 3.76Å; F450-F545 HydrophobicContact CG-CD2 3.76Å; F450-F545 HydrophobicContact CG-CG 4.26Å
451	I	98.2	Very high	97.3	Very high	8 Å²	8	47.3 Å²	47.3	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-54.4	-50.6	177.5	-67.2	163.7	0	0	0	110.8	V388 T391 Q392 A395 I447 N448 N453 V454 N455	V388-I451 HydrophobicContact CG1-CG2 4.44Å; T391-I451 HydrophobicContact CG2-CD1 4.14Å; T391-I451 HydrophobicContact CG2-CG1 3.85Å; Q392-I451 HydrophobicContact CB-CD1 3.93Å; Q392-I451 HydrophobicContact CG-CD1 4.19Å; A395-I451 HydrophobicContact CB-CD1 4.29Å; I447-I451 HydrophobicContact CG2-CD1 4.09Å; I447-I451 WeakPolarHBondContact O-CG1 3.42Å; I447-I451 PolarHBondContact O-N 3.32Å; N448-I451 PolarHBondContact O-N 3.45Å; I451-N453 VanDerWaalsContact C-N 3.28Å; I451-N453 PolarHBondContact O-N 2.85Å; I451-V454 PolarHBondContact O-N 3.4Å; I451-N455 WeakPolarHBondContact O-CB 3.48Å; I451-N455 PolarHBondContact O-N 3.01Å; I451-N455 PolarHBondContact O-OD1 3.06Å; I451-N455 VanDerWaalsContact O-OD1 3.13Å
452	A	98	Very high	97.4	Very high	54 Å²	54	42.7 Å²	42.7	45%	0.446	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-32.8	-178.2	0	0	0	0	0	113.8	N448 F449 F450 T456	N448-A452 PolarHBondContact O-N 2.91Å; F449-A452 PolarHBondContact O-N 3.04Å; F450-A452 PolarHBondContact O-N 3.36Å; A452-T456 WeakPolarHBondContact O-CB 3.34Å; A452-T456 PolarHBondContact O-N 2.98Å; A452-T456 PolarHBondContact O-OG1 2.91Å
453	N	96.8	Very high	97.6	Very high	43 Å²	43	39.4 Å²	39.4	23%	0.23	22%	0.223	C	C	.	.	H	α-helix	trans	-76.7	-42.4	176.6	-78.1	-85.5	0	0	0	112.3	F449 F450 I451 T456 L457 Q541	F449-N453 VanDerWaalsContact CE1-ND2 3.32Å; F449-N453 WeakPolarHBondContact CE1-ND2 3.34Å; F449-N453 WeakPolarHBondContact CE2-ND2 3.16Å; F449-N453 VanDerWaalsContact CZ-ND2 3.25Å; F449-N453 WeakPolarHBondContact CZ-ND2 3.21Å; F449-N453 PolarHBondContact O-N 2.94Å; F449-N453 VanDerWaalsContact O-N 3.15Å; F449-N453 PolarHBondContact O-ND2 2.72Å; F450-N453 PolarHBondContact O-N 3.08Å; I451-N453 VanDerWaalsContact C-N 3.28Å; I451-N453 PolarHBondContact O-N 2.85Å; N453-T456 WeakPolarHBondContact O-CB 3.34Å; N453-T456 PolarHBondContact O-N 3.22Å; N453-L457 PolarHBondContact O-N 3.32Å; N453-Q541 HydrophobicContact CB-CG 3.87Å; N453-Q541 PolarHBondContact OD1-NE2 3.32Å
454	V	97.6	Very high	97.5	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-67.8	-40.3	177.3	-178.9	0	0	0	0	111	V388 F450 I451 T456 L457 V458 L538	V388-V454 HydrophobicContact CG2-CB 3.96Å; V388-V454 HydrophobicContact CG2-CG1 3.53Å; F450-V454 HydrophobicContact CD1-CG2 4.25Å; F450-V454 HydrophobicContact CD2-CG2 4.28Å; F450-V454 HydrophobicContact CE1-CG2 3.9Å; F450-V454 HydrophobicContact CE2-CG2 3.93Å; F450-V454 HydrophobicContact CG-CG2 4.44Å; F450-V454 HydrophobicContact CZ-CG2 3.74Å; F450-V454 WeakPolarHBondContact O-CG2 3.44Å; F450-V454 PolarHBondContact O-N 3.11Å; I451-V454 PolarHBondContact O-N 3.4Å; V454-T456 VanDerWaalsContact C-N 3.27Å; V454-T456 PolarHBondContact O-N 3.34Å; V454-L457 WeakPolarHBondContact O-CB 3.3Å; V454-L457 PolarHBondContact O-N 3.24Å; V454-L457 VanDerWaalsContact O-N 3.08Å; V454-V458 HydrophobicContact CG1-CG2 4.34Å; V454-V458 WeakPolarHBondContact O-CG2 3.45Å; V454-V458 PolarHBondContact O-N 3.46Å; V454-L538 HydrophobicContact CG2-CD2 4.45Å
455	N	97.6	Very high	97.5	Very high	44 Å²	44	41.3 Å²	41.3	24%	0.235	23%	0.234	C	C	.	.	H	α-helix	trans	-59.1	-39.5	171.6	-68	13.7	0	0	0	111.2	V388 I451 L457 V458 D459	V388-N455 WeakPolarHBondContact CG1-OD1 3.39Å; V388-N455 WeakPolarHBondContact CG2-OD1 3.44Å; I451-N455 WeakPolarHBondContact O-CB 3.48Å; I451-N455 PolarHBondContact O-N 3.01Å; I451-N455 PolarHBondContact O-OD1 3.06Å; I451-N455 VanDerWaalsContact O-OD1 3.13Å; N455-L457 VanDerWaalsContact C-N 3.33Å; N455-L457 PolarHBondContact O-N 2.94Å; N455-V458 PolarHBondContact O-N 2.88Å; N455-D459 WeakPolarHBondContact CB-OD2 3.45Å; N455-D459 VanDerWaalsContact O-CB 3.28Å; N455-D459 WeakPolarHBondContact O-CB 3.49Å; N455-D459 VanDerWaalsContact O-CG 3.29Å; N455-D459 PolarHBondContact O-N 2.91Å
456	T	97.4	Very high	97.6	Very high	57 Å²	57	40.5 Å²	40.5	35%	0.35	22%	0.22	S	C	.	.	H	α-helix	trans	-64.5	-34.9	175.1	-72.1	0	0	0	0	112.8	A452 N453 V454 K460 T461	A452-T456 WeakPolarHBondContact O-CB 3.34Å; A452-T456 PolarHBondContact O-N 2.98Å; A452-T456 PolarHBondContact O-OG1 2.91Å; N453-T456 WeakPolarHBondContact O-CB 3.34Å; N453-T456 PolarHBondContact O-N 3.22Å; V454-T456 VanDerWaalsContact C-N 3.27Å; V454-T456 PolarHBondContact O-N 3.34Å; T456-K460 HydrophobicContact CG2-CD 4.25Å; T456-K460 WeakPolarHBondContact O-CB 3.41Å; T456-K460 PolarHBondContact OG1-NZ 2.65Å; T456-T461 PolarHBondContact O-N 2.96Å; T456-T461 PolarHBondContact O-OG1 2.66Å
457	L	96.4	Very high	97.5	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	23%	0.226	C	C	.	.	I	π-helix	trans	-67.8	-43.5	172.6	177.6	65.2	0	0	0	112	N453 V454 N455 T461 I462 K534 V537 L538	N453-L457 PolarHBondContact O-N 3.32Å; V454-L457 WeakPolarHBondContact O-CB 3.3Å; V454-L457 PolarHBondContact O-N 3.24Å; V454-L457 VanDerWaalsContact O-N 3.08Å; N455-L457 VanDerWaalsContact C-N 3.33Å; N455-L457 PolarHBondContact O-N 2.94Å; L457-T461 WeakPolarHBondContact O-CB 3.47Å; L457-T461 PolarHBondContact O-N 2.99Å; L457-I462 HydrophobicContact CG-CD1 4.34Å; L457-I462 WeakPolarHBondContact O-CG1 3.39Å; L457-I462 PolarHBondContact O-N 3.43Å; L457-K534 HydrophobicContact CD1-CB 4.45Å; L457-K534 HydrophobicContact CD2-CG 4.24Å; L457-V537 HydrophobicContact CB-CG1 4.46Å; L457-V537 HydrophobicContact CD2-CG1 4.3Å; L457-L538 HydrophobicContact CD2-CD1 4.11Å; L457-L538 HydrophobicContact CD2-CD2 3.68Å; L457-L538 HydrophobicContact CD2-CG 3.64Å
458	V	97.4	Very high	97.5	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	23%	0.231	C	C	.	.	I	π-helix	trans	-75.2	-57.5	-176.4	173.5	0	0	0	0	112.2	K381 Y384 E385 V454 N455 K460 E463	K381-V458 HydrophobicContact CD-CG1 4.46Å; K381-V458 HydrophobicContact CG-CG1 3.92Å; Y384-V458 HydrophobicContact CD2-CG2 4.45Å; E385-V458 HydrophobicContact CG-CG1 3.71Å; V454-V458 HydrophobicContact CG1-CG2 4.34Å; V454-V458 WeakPolarHBondContact O-CG2 3.45Å; V454-V458 PolarHBondContact O-N 3.46Å; N455-V458 PolarHBondContact O-N 2.88Å; V458-K460 VanDerWaalsContact C-N 3.29Å; V458-K460 PolarHBondContact O-N 3.46Å; V458-E463 PolarHBondContact O-N 3.48Å
459	D	97.1	Very high	97.5	Very high	92 Å²	92	40.2 Å²	40.2	49%	0.492	21%	0.213	S	C	.	.	I	π-helix	trans	-79.7	-11	-167.5	-52.9	-31.4	0	0	0	113.3	N455	N455-D459 WeakPolarHBondContact CB-OD2 3.45Å; N455-D459 VanDerWaalsContact O-CB 3.28Å; N455-D459 WeakPolarHBondContact O-CB 3.49Å; N455-D459 VanDerWaalsContact O-CG 3.29Å; N455-D459 PolarHBondContact O-N 2.91Å
460	K	96.6	Very high	97.6	Very high	129 Å²	129	40 Å²	40	56%	0.561	21%	0.212	S	C	*	.	I	π-helix	trans	-126.8	-60.4	-177.6	-51.2	172.3	-166.9	151.8	0	111.9	T456 V458 D464	T456-K460 HydrophobicContact CG2-CD 4.25Å; T456-K460 WeakPolarHBondContact O-CB 3.41Å; T456-K460 PolarHBondContact OG1-NZ 2.65Å; V458-K460 VanDerWaalsContact C-N 3.29Å; V458-K460 PolarHBondContact O-N 3.46Å; K460-D464 PolarHBondContact O-N 2.91Å
461	T	96.8	Very high	97.5	Very high	49 Å²	49	44.3 Å²	44.3	30%	0.301	23%	0.232	S	C	.	.	I	π-helix	trans	-71.4	-45.6	-173.3	-41.5	0	0	0	0	112.3	T456 L457 T465 L530	T456-T461 PolarHBondContact O-N 2.96Å; T456-T461 PolarHBondContact O-OG1 2.66Å; L457-T461 WeakPolarHBondContact O-CB 3.47Å; L457-T461 PolarHBondContact O-N 2.99Å; T461-T465 PolarHBondContact O-OG1 2.99Å; T461-L530 HydrophobicContact CG2-CD1 3.71Å
462	I	97.9	Very high	97.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-71	-44.5	174	-69	171	0	0	0	110.3	L377 K381 Y384 L457 D464 T465 M466 L530	L377-I462 HydrophobicContact CD1-CG1 4.23Å; L377-I462 HydrophobicContact CD1-CG2 3.89Å; L377-I462 HydrophobicContact CG-CG2 4.33Å; K381-I462 HydrophobicContact CB-CG2 4.03Å; K381-I462 HydrophobicContact CD-CG2 3.95Å; K381-I462 HydrophobicContact CG-CG2 3.77Å; Y384-I462 HydrophobicContact CD2-CD1 3.91Å; Y384-I462 HydrophobicContact CE2-CD1 4.18Å; L457-I462 HydrophobicContact CG-CD1 4.34Å; L457-I462 WeakPolarHBondContact O-CG1 3.39Å; L457-I462 PolarHBondContact O-N 3.43Å; I462-D464 PolarHBondContact O-N 3.47Å; I462-T465 WeakPolarHBondContact O-CA 3.38Å; I462-T465 WeakPolarHBondContact O-CB 3.35Å; I462-T465 PolarHBondContact O-N 3.31Å; I462-M466 HydrophobicContact CG2-CG 4.16Å; I462-M466 WeakPolarHBondContact O-CG 3.3Å; I462-M466 PolarHBondContact O-N 3.49Å; I462-L530 HydrophobicContact CG1-CD1 4.06Å; I462-L530 HydrophobicContact CG1-CD2 4.26Å
463	E	97.7	Very high	97.6	Very high	40 Å²	40	43.6 Å²	43.6	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-67.2	-30.7	-177.4	-165.1	60.4	-143.2	0	0	113.9	K381 V458 T465 M466 I467 K470	K381-E463 IonicContact NZ-OE2 3.88Å; K381-E463 PolarHBondContact NZ-OE2 3.33Å; V458-E463 PolarHBondContact O-N 3.48Å; E463-T465 VanDerWaalsContact C-N 3.31Å; E463-T465 PolarHBondContact O-N 2.69Å; E463-M466 PolarHBondContact O-N 2.9Å; E463-I467 HydrophobicContact CG-CD1 4.39Å; E463-I467 VanDerWaalsContact O-CG1 3.3Å; E463-I467 WeakPolarHBondContact O-CG1 3.5Å; E463-I467 PolarHBondContact O-N 2.94Å; E463-K470 IonicContact OE1-NZ 2.62Å; E463-K470 PolarHBondContact OE1-NZ 3.46Å
464	D	96.9	Very high	97.6	Very high	73 Å²	73	45.1 Å²	45.1	39%	0.39	23%	0.23	S	C	.	.	H	α-helix	trans	-56.8	-47.9	167.2	173.9	73.3	0	0	0	110.5	K460 I462 M466 I467 N468 K526	K460-D464 PolarHBondContact O-N 2.91Å; I462-D464 PolarHBondContact O-N 3.47Å; D464-M466 VanDerWaalsContact C-N 3.29Å; D464-M466 PolarHBondContact O-N 3.49Å; D464-I467 WeakPolarHBondContact O-CB 3.44Å; D464-I467 PolarHBondContact O-N 3.47Å; D464-N468 PolarHBondContact O-N 2.85Å; D464-N468 PolarHBondContact O-ND2 3.36Å; D464-N468 PolarHBondContact OD1-ND2 2.93Å; D464-N468 PolarHBondContact OD2-ND2 3.35Å; D464-K526 IonicContact OD1-NZ 2.76Å; D464-K526 IonicContact OD2-NZ 3.31Å; D464-K526 PolarHBondContact OD2-NZ 3Å
465	T	98.2	Very high	97.6	Very high	7 Å²	7	45 Å²	45	4%	0.043	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-38.5	179.1	-55.2	0	0	0	0	111.1	L377 T461 I462 E463 I467 N468 I469 K526 L527 L530	L377-T465 HydrophobicContact CD2-CG2 3.8Å; T461-T465 PolarHBondContact O-OG1 2.99Å; I462-T465 WeakPolarHBondContact O-CA 3.38Å; I462-T465 WeakPolarHBondContact O-CB 3.35Å; I462-T465 PolarHBondContact O-N 3.31Å; E463-T465 VanDerWaalsContact C-N 3.31Å; E463-T465 PolarHBondContact O-N 2.69Å; T465-I467 PolarHBondContact O-N 3.07Å; T465-N468 PolarHBondContact O-N 3.32Å; T465-I469 HydrophobicContact CG2-CD1 4.14Å; T465-I469 WeakPolarHBondContact O-CD1 3.44Å; T465-I469 WeakPolarHBondContact O-CG1 3.39Å; T465-I469 PolarHBondContact O-N 3.43Å; T465-K526 HydrophobicContact CG2-CB 4.34Å; T465-L527 HydrophobicContact CG2-CD2 4.07Å; T465-L527 HydrophobicContact CG2-CG 4.38Å; T465-L530 HydrophobicContact CG2-CD2 3.92Å
466	M	98.3	Very high	97.7	Very high	24 Å²	24	43.3 Å²	43.3	12%	0.118	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-36.9	172.4	-65.6	-59.1	-63	0	0	113.2	L377 R378 I462 E463 D464 N468 I469 K470	L377-M466 HydrophobicContact CD2-SD 3.93Å; L377-M466 HydrophobicContact CG-SD 4.22Å; R378-M466 HydrophobicContact CG-CE 3.82Å; R378-M466 HydrophobicContact CG-SD 4.36Å; I462-M466 HydrophobicContact CG2-CG 4.16Å; I462-M466 WeakPolarHBondContact O-CG 3.3Å; I462-M466 PolarHBondContact O-N 3.49Å; E463-M466 PolarHBondContact O-N 2.9Å; D464-M466 VanDerWaalsContact C-N 3.29Å; D464-M466 PolarHBondContact O-N 3.49Å; M466-N468 VanDerWaalsContact C-N 3.34Å; M466-I469 PolarHBondContact O-N 3.36Å; M466-I469 HydrophobicContact SD-CD1 3.99Å; M466-K470 VanDerWaalsContact O-CG 3.3Å; M466-K470 WeakPolarHBondContact O-CG 3.18Å; M466-K470 PolarHBondContact O-N 3.41Å
467	I	97.6	Very high	97.7	Very high	75 Å²	75	41.2 Å²	41.2	39%	0.385	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-38.8	173.2	-69.7	162.7	0	0	0	110.9	E463 D464 T465 K470 Q471	E463-I467 HydrophobicContact CG-CD1 4.39Å; E463-I467 VanDerWaalsContact O-CG1 3.3Å; E463-I467 WeakPolarHBondContact O-CG1 3.5Å; E463-I467 PolarHBondContact O-N 2.94Å; D464-I467 WeakPolarHBondContact O-CB 3.44Å; D464-I467 PolarHBondContact O-N 3.47Å; T465-I467 PolarHBondContact O-N 3.07Å; I467-K470 PolarHBondContact O-N 2.88Å; I467-Q471 WeakPolarHBondContact O-CG 3.38Å; I467-Q471 PolarHBondContact O-N 3.37Å
468	N	97.8	Very high	97.8	Very high	21 Å²	21	41.8 Å²	41.8	11%	0.112	21%	0.21	C	C	.	.	H	α-helix	trans	-71.1	-34.5	177.2	-71.1	-113.1	0	0	0	111.2	D464 T465 M466 Q471 Y472 V523 K526	D464-N468 PolarHBondContact O-N 2.85Å; D464-N468 PolarHBondContact O-ND2 3.36Å; D464-N468 PolarHBondContact OD1-ND2 2.93Å; D464-N468 PolarHBondContact OD2-ND2 3.35Å; T465-N468 PolarHBondContact O-N 3.32Å; M466-N468 VanDerWaalsContact C-N 3.34Å; N468-Q471 WeakPolarHBondContact O-CB 3.5Å; N468-Q471 PolarHBondContact O-N 2.9Å; N468-Y472 PolarHBondContact O-N 3.36Å; N468-V523 HydrophobicContact CB-CG2 4.24Å; N468-V523 WeakPolarHBondContact O-CG2 3.3Å; N468-K526 HydrophobicContact CB-CD 4.08Å; N468-K526 PolarHBondContact ND2-NZ 3.23Å; N468-K526 WeakPolarHBondContact OD1-CE 3.28Å; N468-K526 PolarHBondContact OD1-NZ 3.04Å
469	I	98.5	Very high	97.8	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-43.2	170.6	-69.3	158.7	0	0	0	111.4	I374 L377 T465 M466 Q471 Y472 E473 V523 L527	I374-I469 HydrophobicContact CD1-CG1 4.18Å; I374-I469 HydrophobicContact CD1-CG2 3.97Å; I374-I469 HydrophobicContact CG1-CD1 3.88Å; I374-I469 HydrophobicContact CG1-CG1 4.02Å; I374-I469 HydrophobicContact CG1-CG2 4.29Å; I374-I469 HydrophobicContact CG2-CD1 4.31Å; I374-I469 HydrophobicContact CG2-CG2 3.98Å; L377-I469 HydrophobicContact CD2-CD1 3.88Å; T465-I469 HydrophobicContact CG2-CD1 4.14Å; T465-I469 WeakPolarHBondContact O-CD1 3.44Å; T465-I469 WeakPolarHBondContact O-CG1 3.39Å; T465-I469 PolarHBondContact O-N 3.43Å; M466-I469 PolarHBondContact O-N 3.36Å; M466-I469 HydrophobicContact SD-CD1 3.99Å; I469-Q471 VanDerWaalsContact C-N 3.29Å; I469-Q471 PolarHBondContact O-N 3.47Å; I469-Y472 WeakPolarHBondContact O-CB 3.31Å; I469-Y472 PolarHBondContact O-N 2.96Å; I469-Y472 VanDerWaalsContact O-N 3.16Å; I469-E473 PolarHBondContact O-N 2.96Å; I469-V523 HydrophobicContact CG1-CG1 3.7Å; I469-V523 HydrophobicContact CG1-CG2 4.47Å; I469-L527 HydrophobicContact CD1-CD2 4.49Å
470	K	98	Very high	97.9	Very high	105 Å²	105	38.3 Å²	38.3	46%	0.457	19%	0.19	S	C	.	.	H	α-helix	trans	-58.9	-39.3	173.3	-70.3	161.5	-177.9	166.2	0	111.5	E463 M466 I467 T474	E463-K470 IonicContact OE1-NZ 2.62Å; E463-K470 PolarHBondContact OE1-NZ 3.46Å; M466-K470 VanDerWaalsContact O-CG 3.3Å; M466-K470 WeakPolarHBondContact O-CG 3.18Å; M466-K470 PolarHBondContact O-N 3.41Å; I467-K470 PolarHBondContact O-N 2.88Å; K470-T474 PolarHBondContact O-N 3.17Å; K470-T474 VanDerWaalsContact O-N 3.11Å; K470-T474 PolarHBondContact O-OG1 3.4Å
471	Q	97.9	Very high	98	Very high	97 Å²	97	32.2 Å²	32.2	45%	0.453	16%	0.164	S	C	.	.	H	α-helix	trans	-69.1	-35.9	174.4	-68.9	173	13.7	0	0	113.2	I467 N468 I469 T474 A475 M519	I467-Q471 WeakPolarHBondContact O-CG 3.38Å; I467-Q471 PolarHBondContact O-N 3.37Å; N468-Q471 WeakPolarHBondContact O-CB 3.5Å; N468-Q471 PolarHBondContact O-N 2.9Å; I469-Q471 VanDerWaalsContact C-N 3.29Å; I469-Q471 PolarHBondContact O-N 3.47Å; Q471-T474 WeakPolarHBondContact O-CB 3.39Å; Q471-T474 PolarHBondContact O-N 3.36Å; Q471-A475 PolarHBondContact O-N 3.13Å; Q471-M519 HydrophobicContact CB-CE 3.65Å
472	Y	98.5	Very high	98	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-49.2	173.8	158.5	-97.9	0	0	0	112.1	L370 I374 N468 I469 T474 A475 R476 Y516 M519 R520 V523	L370-Y472 HydrophobicContact CD2-CD2 4.49Å; L370-Y472 HydrophobicContact CD2-CE1 4.18Å; L370-Y472 HydrophobicContact CD2-CE2 3.97Å; I374-Y472 HydrophobicContact CD1-CE1 4.44Å; N468-Y472 PolarHBondContact O-N 3.36Å; I469-Y472 WeakPolarHBondContact O-CB 3.31Å; I469-Y472 PolarHBondContact O-N 2.96Å; I469-Y472 VanDerWaalsContact O-N 3.16Å; Y472-T474 VanDerWaalsContact C-N 3.26Å; Y472-T474 PolarHBondContact O-N 3.19Å; Y472-A475 PolarHBondContact O-N 3.04Å; Y472-R476 PolarHBondContact O-N 3.15Å; Y472-Y516 HydrophobicContact CD2-CD2 4.47Å; Y472-Y516 HydrophobicContact CD2-CE2 4.21Å; Y472-Y516 HydrophobicContact CE2-CD2 4.09Å; Y472-Y516 AromaticContact CE2-CE2 3.42Å; Y472-Y516 HydrophobicContact CE2-CE2 3.42Å; Y472-Y516 VanDerWaalsContact CE2-CE2 3.42Å; Y472-Y516 AromaticContact CZ-CE2 3.98Å; Y472-M519 HydrophobicContact CD2-CB 4.39Å; Y472-R520 HydrophobicContact CD2-CB 4.01Å; Y472-R520 HydrophobicContact CE2-CB 3.67Å; Y472-R520 HydrophobicContact CE2-CG 3.81Å; Y472-V523 HydrophobicContact CG-CG2 4.46Å
473	E	98.1	Very high	98	Very high	46 Å²	46	32.3 Å²	32.3	22%	0.215	16%	0.158	C	C	.	.	H	α-helix	trans	-61.2	-36	175.2	-78.3	-63.7	145.8	0	0	111.9	R364 I469 R476 V477	R364-E473 IonicContact NH2-OE1 2.77Å; R364-E473 PolarHBondContact NH2-OE1 2.96Å; R364-E473 IonicContact NH2-OE2 3.97Å; I469-E473 PolarHBondContact O-N 2.96Å; E473-R476 WeakPolarHBondContact O-CB 3.43Å; E473-R476 PolarHBondContact O-N 3.27Å; E473-R476 IonicContact OE2-CZ 2.77Å; E473-R476 IonicContact OE2-NE 3.58Å; E473-R476 PolarHBondContact OE2-NE 3.28Å; E473-R476 IonicContact OE2-NH2 3.21Å; E473-V477 WeakPolarHBondContact O-CG2 3.49Å; E473-V477 PolarHBondContact O-N 2.76Å
474	T	97.6	Very high	97.9	Very high	75 Å²	75	31.8 Å²	31.8	46%	0.46	16%	0.158	S	C	.	.	H	α-helix	trans	-62	-43.5	173.1	-54.6	0	0	0	0	111.4	K470 Q471 Y472 E478	K470-T474 PolarHBondContact O-N 3.17Å; K470-T474 VanDerWaalsContact O-N 3.11Å; K470-T474 PolarHBondContact O-OG1 3.4Å; Q471-T474 WeakPolarHBondContact O-CB 3.39Å; Q471-T474 PolarHBondContact O-N 3.36Å; Y472-T474 VanDerWaalsContact C-N 3.26Å; Y472-T474 PolarHBondContact O-N 3.19Å; T474-E478 WeakPolarHBondContact O-CG 3.22Å; T474-E478 PolarHBondContact O-N 3.32Å; T474-E478 VanDerWaalsContact O-N 3.13Å
475	A	98.3	Very high	97.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-68.8	-33.8	176.8	0	0	0	0	0	112.8	Q471 Y472 F479 K515 M519	Q471-A475 PolarHBondContact O-N 3.13Å; Y472-A475 PolarHBondContact O-N 3.04Å; A475-F479 WeakPolarHBondContact O-CB 3.37Å; A475-F479 PolarHBondContact O-N 3.3Å; A475-K515 HydrophobicContact CB-CD 4.37Å; A475-K515 HydrophobicContact CB-CG 4.17Å; A475-M519 HydrophobicContact CB-CB 4.22Å; A475-M519 HydrophobicContact CB-CG 3.96Å
476	R	98.4	Very high	97.7	Very high	9 Å²	9	29.9 Å²	29.9	3%	0.034	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-50.9	173.6	-174.7	-155.5	65.2	75.8	-19.7	111.5	E357 T365 Y472 E473 E478 F479 D480 Y516	E357-R476 IonicContact OE1-CZ 2.82Å; E357-R476 IonicContact OE1-NH1 3.33Å; E357-R476 PolarHBondContact OE1-NH1 2.76Å; E357-R476 IonicContact OE1-NH2 2.66Å; E357-R476 IonicContact OE2-CZ 2.65Å; E357-R476 IonicContact OE2-NH1 2.63Å; E357-R476 PolarHBondContact OE2-NH1 3.41Å; E357-R476 IonicContact OE2-NH2 3.22Å; E357-R476 PolarHBondContact OE2-NH2 3.3Å; T365-R476 WeakPolarHBondContact O-CD 3.4Å; Y472-R476 PolarHBondContact O-N 3.15Å; E473-R476 WeakPolarHBondContact O-CB 3.43Å; E473-R476 PolarHBondContact O-N 3.27Å; E473-R476 IonicContact OE2-CZ 2.77Å; E473-R476 IonicContact OE2-NE 3.58Å; E473-R476 PolarHBondContact OE2-NE 3.28Å; E473-R476 IonicContact OE2-NH2 3.21Å; R476-E478 VanDerWaalsContact C-N 3.32Å; R476-E478 PolarHBondContact O-N 3.33Å; R476-F479 WeakPolarHBondContact O-CB 3.39Å; R476-F479 PolarHBondContact O-N 2.77Å; R476-D480 IonicContact NH1-OD2 3.5Å; R476-D480 PolarHBondContact NH1-OD2 3.31Å; R476-D480 PolarHBondContact O-N 2.99Å; R476-Y516 HydrophobicContact CB-CD2 3.86Å; R476-Y516 HydrophobicContact CB-CE2 3.79Å; R476-Y516 HydrophobicContact CG-CD2 4.35Å; R476-Y516 HydrophobicContact CG-CE2 3.9Å
477	V	98.3	Very high	97.6	Very high	14 Å²	14	33.3 Å²	33.3	9%	0.085	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-41.8	178.3	169.2	0	0	0	0	111.4	C350 Q353 I354 E473 A481	C350-V477 HydrophobicContact CB-CG1 3.71Å; Q353-V477 HydrophobicContact CB-CG1 4.46Å; Q353-V477 HydrophobicContact CG-CG1 4.43Å; I354-V477 HydrophobicContact CD1-CG1 3.92Å; I354-V477 HydrophobicContact CD1-CG2 4.43Å; I354-V477 HydrophobicContact CG1-CG1 3.7Å; I354-V477 HydrophobicContact CG1-CG2 4.01Å; E473-V477 WeakPolarHBondContact O-CG2 3.49Å; E473-V477 PolarHBondContact O-N 2.76Å; V477-A481 VanDerWaalsContact O-CB 3.27Å; V477-A481 WeakPolarHBondContact O-CB 3.2Å; V477-A481 PolarHBondContact O-N 3.23Å
478	E	97.9	Very high	97.4	Very high	14 Å²	14	34.4 Å²	34.4	7%	0.065	17%	0.167	C	C	.	.	H	α-helix	trans	-60.8	-48.1	173.1	-78.2	-178.2	-179.2	0	0	112	N346 C350 T474 R476 D480 A481 Y482 H512 K515	N346-E478 PolarHBondContact ND2-OE1 2.88Å; N346-E478 VanDerWaalsContact ND2-OE1 3.08Å; C350-E478 VanDerWaalsContact SG-CG 3.58Å; T474-E478 WeakPolarHBondContact O-CG 3.22Å; T474-E478 PolarHBondContact O-N 3.32Å; T474-E478 VanDerWaalsContact O-N 3.13Å; R476-E478 VanDerWaalsContact C-N 3.32Å; R476-E478 PolarHBondContact O-N 3.33Å; E478-D480 PolarHBondContact O-N 3.44Å; E478-A481 PolarHBondContact O-N 2.8Å; E478-Y482 WeakPolarHBondContact O-CD2 3.43Å; E478-Y482 PolarHBondContact O-N 2.98Å; E478-H512 IonicContact OE2-CE1 2.87Å; E478-H512 PolarHBondContact OE2-CE1 2.96Å; E478-H512 VanDerWaalsContact OE2-CE1 3.22Å; E478-H512 IonicContact OE2-ND1 3.69Å; E478-H512 PolarHBondContact OE2-ND1 3.3Å; E478-K515 IonicContact OE1-NZ 3.4Å; E478-K515 PolarHBondContact OE1-NZ 3.48Å; E478-K515 WeakPolarHBondContact OE2-CD 3.48Å; E478-K515 WeakPolarHBondContact OE2-CE 3.32Å; E478-K515 IonicContact OE2-NZ 3.21Å; E478-K515 PolarHBondContact OE2-NZ 2.87Å
479	F	98.4	Very high	97.2	Very high	22 Å²	22	35.9 Å²	35.9	10%	0.096	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-50.3	178.1	166.9	-109.3	0	0	0	111.7	T365 A475 R476 A481 Y482 R483 F509 R513 Y516	T365-F479 HydrophobicContact CG2-CE1 4.31Å; T365-F479 WeakPolarHBondContact OG1-CE1 3.48Å; A475-F479 WeakPolarHBondContact O-CB 3.37Å; A475-F479 PolarHBondContact O-N 3.3Å; R476-F479 WeakPolarHBondContact O-CB 3.39Å; R476-F479 PolarHBondContact O-N 2.77Å; F479-A481 VanDerWaalsContact C-N 3.31Å; F479-A481 PolarHBondContact O-N 2.87Å; F479-Y482 PolarHBondContact O-N 3.04Å; F479-R483 WeakPolarHBondContact O-CB 3.21Å; F479-R483 PolarHBondContact O-N 2.81Å; F479-F509 HydrophobicContact CD2-CE2 4.12Å; F479-F509 HydrophobicContact CE2-CD2 4.23Å; F479-F509 AromaticContact CE2-CE2 3.42Å; F479-F509 HydrophobicContact CE2-CE2 3.42Å; F479-F509 VanDerWaalsContact CE2-CE2 3.42Å; F479-F509 AromaticContact CE2-CZ 3.93Å; F479-F509 HydrophobicContact CE2-CZ 3.93Å; F479-F509 HydrophobicContact CZ-CE2 4.14Å; F479-R513 HydrophobicContact CD2-CB 3.78Å; F479-R513 HydrophobicContact CD2-CG 4.23Å; F479-R513 HydrophobicContact CE2-CB 3.69Å; F479-R513 HydrophobicContact CE2-CG 3.75Å; F479-Y516 HydrophobicContact CB-CG 4.18Å; F479-Y516 AromaticContact CD1-CD1 3.98Å; F479-Y516 HydrophobicContact CD1-CD1 3.98Å; F479-Y516 HydrophobicContact CD1-CE1 4.39Å; F479-Y516 HydrophobicContact CD1-CG 4.28Å; F479-Y516 HydrophobicContact CE1-CD1 4.34Å; F479-Y516 HydrophobicContact CG-CD1 4.21Å; F479-Y516 HydrophobicContact CG-CG 4.26Å
480	D	98.4	Very high	97	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-35.3	178.4	-81.5	-47.4	0	0	0	112.7	Q353 T365 R476 E478 R483 T484	Q353-D480 HydrophobicContact CG-CB 3.96Å; T365-D480 VanDerWaalsContact CB-OD2 3.26Å; T365-D480 WeakPolarHBondContact CB-OD2 3.2Å; T365-D480 PolarHBondContact N-OD1 2.81Å; T365-D480 PolarHBondContact N-OD2 2.83Å; T365-D480 PolarHBondContact OG1-OD1 2.92Å; T365-D480 PolarHBondContact OG1-OD2 3.33Å; R476-D480 IonicContact NH1-OD2 3.5Å; R476-D480 PolarHBondContact NH1-OD2 3.31Å; R476-D480 PolarHBondContact O-N 2.99Å; E478-D480 PolarHBondContact O-N 3.44Å; D480-R483 IonicContact OD1-CZ 3.87Å; D480-R483 IonicContact OD1-NE 2.8Å; D480-R483 PolarHBondContact OD1-NE 2.78Å; D480-R483 IonicContact OD1-NH2 3.77Å; D480-R483 PolarHBondContact OD1-NH2 3.39Å; D480-T484 WeakPolarHBondContact O-CB 3.49Å; D480-T484 PolarHBondContact O-N 3.05Å; D480-T484 PolarHBondContact O-OG1 3.4Å
481	A	97.8	Very high	96.8	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-67.6	-46.1	176.8	0	0	0	0	0	112.4	K349 Q353 V477 E478 F479 T484 D485	K349-A481 HydrophobicContact CB-CB 4.12Å; Q353-A481 HydrophobicContact CB-CB 3.76Å; Q353-A481 HydrophobicContact CG-CB 4.19Å; V477-A481 VanDerWaalsContact O-CB 3.27Å; V477-A481 WeakPolarHBondContact O-CB 3.2Å; V477-A481 PolarHBondContact O-N 3.23Å; E478-A481 PolarHBondContact O-N 2.8Å; F479-A481 VanDerWaalsContact C-N 3.31Å; F479-A481 PolarHBondContact O-N 2.87Å; A481-T484 PolarHBondContact O-N 3.42Å; A481-D485 PolarHBondContact O-N 3.41Å
482	Y	97.6	Very high	96.4	Very high	16 Å²	16	37.5 Å²	37.5	6%	0.063	20%	0.197	C	C	.	.	H	α-helix	trans	-75.6	-25.9	178.3	-80.2	-101.4	0	0	0	113.2	N346 K349 E478 F479 L486 Q508 H512	N346-Y482 WeakPolarHBondContact OD1-CE2 3.3Å; K349-Y482 HydrophobicContact CD-CD2 4.2Å; K349-Y482 HydrophobicContact CD-CE1 4.11Å; K349-Y482 HydrophobicContact CD-CE2 3.61Å; K349-Y482 VanDerWaalsContact NZ-CD1 3.35Å; E478-Y482 WeakPolarHBondContact O-CD2 3.43Å; E478-Y482 PolarHBondContact O-N 2.98Å; F479-Y482 PolarHBondContact O-N 3.04Å; Y482-L486 WeakPolarHBondContact O-CB 3.49Å; Y482-L486 PolarHBondContact O-N 3.18Å; Y482-L486 VanDerWaalsContact O-N 3.15Å; Y482-Q508 HydrophobicContact CD1-CB 3.48Å; Y482-Q508 VanDerWaalsContact CD1-CB 3.48Å; Y482-Q508 HydrophobicContact CD1-CG 4.42Å; Y482-Q508 HydrophobicContact CE1-CB 3.56Å; Y482-Q508 HydrophobicContact CE1-CG 4.06Å; Y482-H512 AromaticContact CD1-CD2 3.97Å; Y482-H512 AromaticContact CD2-CD2 3.67Å; Y482-H512 AromaticContact CD2-NE2 3.89Å; Y482-H512 AromaticContact CE2-CD2 3.8Å; Y482-H512 AromaticContact CE2-CE1 3.97Å; Y482-H512 AromaticContact CE2-NE2 3.5Å; Y482-H512 WeakPolarHBondContact CE2-NE2 3.27Å; Y482-H512 AromaticContact CG-CD2 3.75Å; Y482-H512 AromaticContact CZ-CD2 3.95Å; Y482-H512 AromaticContact CZ-NE2 3.52Å
483	R	97.9	Very high	95.9	Very high	34 Å²	34	42.5 Å²	42.5	13%	0.128	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-51.7	166.3	-174.6	-172.8	57.7	58.1	11.2	110	S363 F479 D480 L486 E487 F509	S363-R483 PolarHBondContact O-NH2 3.47Å; S363-R483 VanDerWaalsContact O-NH2 3.13Å; F479-R483 WeakPolarHBondContact O-CB 3.21Å; F479-R483 PolarHBondContact O-N 2.81Å; D480-R483 IonicContact OD1-CZ 3.87Å; D480-R483 IonicContact OD1-NE 2.8Å; D480-R483 PolarHBondContact OD1-NE 2.78Å; D480-R483 IonicContact OD1-NH2 3.77Å; D480-R483 PolarHBondContact OD1-NH2 3.39Å; R483-L486 PolarHBondContact O-N 3.2Å; R483-E487 VanDerWaalsContact CG-OE1 3.32Å; R483-E487 WeakPolarHBondContact CG-OE1 3.49Å; R483-E487 IonicContact CZ-OE1 3.77Å; R483-E487 IonicContact NH1-OE1 2.99Å; R483-E487 PolarHBondContact NH1-OE1 2.99Å; R483-E487 IonicContact NH1-OE2 2.81Å; R483-E487 PolarHBondContact NH1-OE2 3.43Å; R483-E487 WeakPolarHBondContact O-CG 3.5Å; R483-E487 PolarHBondContact O-N 2.67Å; R483-F509 HydrophobicContact CB-CD2 3.98Å; R483-F509 HydrophobicContact CB-CE2 3.78Å; R483-F509 HydrophobicContact CG-CD2 4.48Å; R483-F509 HydrophobicContact CG-CE2 3.89Å
484	T	96.3	Very high	95.6	Very high	29 Å²	29	48.2 Å²	48.2	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-41.7	-180	-54.6	0	0	0	0	112.3	Q353 D480 A481 L486 E487 E488	Q353-T484 PolarHBondContact OE1-OG1 3.2Å; D480-T484 WeakPolarHBondContact O-CB 3.49Å; D480-T484 PolarHBondContact O-N 3.05Å; D480-T484 PolarHBondContact O-OG1 3.4Å; A481-T484 PolarHBondContact O-N 3.42Å; T484-L486 VanDerWaalsContact C-N 3.31Å; T484-L486 PolarHBondContact O-N 3.32Å; T484-E487 PolarHBondContact O-N 3.47Å; T484-E488 WeakPolarHBondContact O-CB 3.27Å; T484-E488 WeakPolarHBondContact O-CG 3.44Å; T484-E488 PolarHBondContact O-N 3.28Å
485	D	94.8	Very high	95.4	Very high	21 Å²	21	47.5 Å²	47.5	11%	0.112	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-38.3	173.3	-81.9	-57	0	0	0	113.2	K349 R352 A481 L489	K349-D485 VanDerWaalsContact CD-OD2 3.32Å; K349-D485 WeakPolarHBondContact CD-OD2 3.44Å; K349-D485 WeakPolarHBondContact CE-OD2 3.49Å; K349-D485 WeakPolarHBondContact CG-OD2 3.24Å; K349-D485 IonicContact NZ-OD2 3.98Å; K349-D485 PolarHBondContact NZ-OD2 2.8Å; R352-D485 IonicContact CZ-OD1 2.76Å; R352-D485 VanDerWaalsContact NH2-CG 3.26Å; R352-D485 IonicContact NH2-OD1 2.76Å; R352-D485 PolarHBondContact NH2-OD1 3.07Å; R352-D485 IonicContact NH2-OD2 3.28Å; R352-D485 PolarHBondContact NH2-OD2 3.32Å; A481-D485 PolarHBondContact O-N 3.41Å; D485-L489 WeakPolarHBondContact O-CB 3.49Å; D485-L489 WeakPolarHBondContact O-CG 3.5Å; D485-L489 PolarHBondContact O-N 3.27Å
486	L	96.3	Very high	95.1	Very high	20 Å²	20	51.7 Å²	51.7	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-70.7	-36.2	177.6	177.2	59.2	0	0	0	111.5	Y482 R483 T484 N490 Q506 F509	Y482-L486 WeakPolarHBondContact O-CB 3.49Å; Y482-L486 PolarHBondContact O-N 3.18Å; Y482-L486 VanDerWaalsContact O-N 3.15Å; R483-L486 PolarHBondContact O-N 3.2Å; T484-L486 VanDerWaalsContact C-N 3.31Å; T484-L486 PolarHBondContact O-N 3.32Å; L486-N490 WeakPolarHBondContact CD1-ND2 3.49Å; L486-N490 WeakPolarHBondContact O-CB 3.46Å; L486-N490 PolarHBondContact O-N 2.98Å; L486-N490 VanDerWaalsContact O-N 3.07Å; L486-N490 PolarHBondContact O-ND2 3.45Å; L486-Q506 HydrophobicContact CD1-CB 4.5Å; L486-Q506 HydrophobicContact CD1-CG 3.55Å; L486-Q506 HydrophobicContact CD2-CG 4.08Å; L486-Q506 HydrophobicContact CG-CG 4.49Å; L486-F509 HydrophobicContact CD2-CB 3.79Å; L486-F509 HydrophobicContact CD2-CD1 3.83Å; L486-F509 HydrophobicContact CD2-CD2 4.46Å; L486-F509 HydrophobicContact CD2-CG 3.76Å
487	E	95.4	Very high	94.8	Very high	96 Å²	96	55.5 Å²	55.5	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-48.7	172.7	-71.3	163.8	-169.5	0	0	111	R483 T484 L489 N490 L491	R483-E487 VanDerWaalsContact CG-OE1 3.32Å; R483-E487 WeakPolarHBondContact CG-OE1 3.49Å; R483-E487 IonicContact CZ-OE1 3.77Å; R483-E487 IonicContact NH1-OE1 2.99Å; R483-E487 PolarHBondContact NH1-OE1 2.99Å; R483-E487 IonicContact NH1-OE2 2.81Å; R483-E487 PolarHBondContact NH1-OE2 3.43Å; R483-E487 WeakPolarHBondContact O-CG 3.5Å; R483-E487 PolarHBondContact O-N 2.67Å; T484-E487 PolarHBondContact O-N 3.47Å; E487-L489 VanDerWaalsContact C-N 3.35Å; E487-L489 PolarHBondContact O-N 2.9Å; E487-N490 PolarHBondContact O-N 3.47Å; E487-N490 VanDerWaalsContact O-N 3.16Å; E487-L491 PolarHBondContact O-N 3.16Å
488	E	93.6	Very high	94.4	Very high	97 Å²	97	55.8 Å²	55.8	45%	0.453	30%	0.302	S	S	.	.	H	α-helix	trans	-53.4	-47.5	174	-76.4	179.5	-179.5	0	0	111.7	R352 T484 L491	R352-E488 IonicContact CZ-OE1 2.8Å; R352-E488 IonicContact CZ-OE2 3.2Å; R352-E488 VanDerWaalsContact NH1-CD 3.31Å; R352-E488 IonicContact NH1-OE1 2.65Å; R352-E488 PolarHBondContact NH1-OE1 3.19Å; R352-E488 IonicContact NH1-OE2 2.66Å; R352-E488 PolarHBondContact NH1-OE2 3.47Å; R352-E488 IonicContact NH2-OE2 3.47Å; T484-E488 WeakPolarHBondContact O-CB 3.27Å; T484-E488 WeakPolarHBondContact O-CG 3.44Å; T484-E488 PolarHBondContact O-N 3.28Å; E488-L491 PolarHBondContact O-N 3.07Å
489	L	93.4	Very high	94.2	Very high	52 Å²	52	59 Å²	59	27%	0.272	32%	0.32	S	S	.	.	H	α-helix	trans	-69.6	-30.2	179.5	-75	170.7	0	0	0	113.7	D485 E487 L491 G492 I502	D485-L489 WeakPolarHBondContact O-CB 3.49Å; D485-L489 WeakPolarHBondContact O-CG 3.5Å; D485-L489 PolarHBondContact O-N 3.27Å; E487-L489 VanDerWaalsContact C-N 3.35Å; E487-L489 PolarHBondContact O-N 2.9Å; L489-L491 VanDerWaalsContact C-N 3.3Å; L489-L491 PolarHBondContact O-N 2.98Å; L489-G492 PolarHBondContact O-N 2.77Å; L489-I502 HydrophobicContact CB-CG1 4.11Å
490	N	93.6	Very high	94	Very high	55 Å²	55	61.5 Å²	61.5	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-73.2	-20.9	178.3	-89.4	-66.6	0	0	0	113.7	L486 E487 G492 R494	L486-N490 WeakPolarHBondContact CD1-ND2 3.49Å; L486-N490 WeakPolarHBondContact O-CB 3.46Å; L486-N490 PolarHBondContact O-N 2.98Å; L486-N490 VanDerWaalsContact O-N 3.07Å; L486-N490 PolarHBondContact O-ND2 3.45Å; E487-N490 PolarHBondContact O-N 3.47Å; E487-N490 VanDerWaalsContact O-N 3.16Å; N490-G492 VanDerWaalsContact C-N 3.26Å; N490-R494 PolarHBondContact OD1-NH2 3.13Å; N490-R494 VanDerWaalsContact OD1-NH2 3.08Å
491	L	93.3	Very high	93.7	Very high	161 Å²	161	66.7 Å²	66.7	84%	0.843	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.8	171.1	-63.3	172.6	0	0	0	112.7	E487 E488 L489	E487-L491 PolarHBondContact O-N 3.16Å; E488-L491 PolarHBondContact O-N 3.07Å; L489-L491 VanDerWaalsContact C-N 3.3Å; L489-L491 PolarHBondContact O-N 2.98Å
492	G	89.9	Confident	93.6	Very high	26 Å²	26	67 Å²	67	27%	0.268	36%	0.362	S	S	.	.	S	Bend	trans	-77.2	161.9	179.9	0	0	0	0	0	114.5	L489 N490 R494	L489-G492 PolarHBondContact O-N 2.77Å; N490-G492 VanDerWaalsContact C-N 3.26Å; G492-R494 PolarHBondContact O-N 3.42Å
493	P	89.4	Confident	93.5	Very high	104 Å²	104	71.8 Å²	71.8	68%	0.675	39%	0.385	S	S	*	.			trans	-59.1	134.3	172.9	-22	33.6	0	0	0	111.8	D495 T498	P493-D495 PolarHBondContact O-N 3.33Å; P493-T498 WeakPolarHBondContact O-CB 3.4Å
494	R	91.9	Very high	93.4	Very high	167 Å²	167	76.1 Å²	76.1	63%	0.63	40%	0.402	S	S	*	.			trans	-83.8	58.9	177.1	-67.7	-172.6	175.4	-167.1	-4.5	112	N490 G492 L499 I502	N490-R494 PolarHBondContact OD1-NH2 3.13Å; N490-R494 VanDerWaalsContact OD1-NH2 3.08Å; G492-R494 PolarHBondContact O-N 3.42Å; R494-L499 HydrophobicContact CB-CD2 4.09Å; R494-L499 HydrophobicContact CB-CG 4.35Å; R494-L499 HydrophobicContact CG-CD2 4.34Å; R494-I502 HydrophobicContact CG-CD1 4.39Å
495	D	93.1	Very high	93.3	Very high	60 Å²	60	75.1 Å²	75.1	32%	0.321	40%	0.396	S	S	.	.			trans	-85.1	171.5	174.6	87.7	-62.2	0	0	0	112.1	P493 T497 T498 L499	P493-D495 PolarHBondContact O-N 3.33Å; D495-T497 PolarHBondContact O-N 3.11Å; D495-T497 PolarHBondContact OD1-OG1 3.32Å; D495-T497 WeakPolarHBondContact OD2-CA 3.38Å; D495-T497 VanDerWaalsContact OD2-CB 3.28Å; D495-T497 WeakPolarHBondContact OD2-CB 3.44Å; D495-T497 WeakPolarHBondContact OD2-CG2 3.26Å; D495-T497 PolarHBondContact OD2-N 2.98Å; D495-T497 PolarHBondContact OD2-OG1 2.85Å; D495-T498 PolarHBondContact O-N 3.16Å; D495-T498 WeakPolarHBondContact OD1-CB 3.47Å; D495-T498 PolarHBondContact OD1-N 2.91Å; D495-T498 PolarHBondContact OD1-OG1 3.05Å; D495-L499 WeakPolarHBondContact O-CG 3.35Å; D495-L499 PolarHBondContact O-N 3.27Å
496	A	91.1	Very high	93.4	Very high	88 Å²	88	78.6 Å²	78.6	73%	0.727	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21	179.9	0	0	0	0	0	114.3	P500	A496-P500 VanDerWaalsContact O-CD 3.3Å; A496-P500 WeakPolarHBondContact O-CD 3.28Å
497	T	91.4	Very high	93.5	Very high	88 Å²	88	82.5 Å²	82.5	54%	0.54	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-18.6	178	75.9	0	0	0	0	113.9	D495 K501	D495-T497 PolarHBondContact O-N 3.11Å; D495-T497 PolarHBondContact OD1-OG1 3.32Å; D495-T497 WeakPolarHBondContact OD2-CA 3.38Å; D495-T497 VanDerWaalsContact OD2-CB 3.28Å; D495-T497 WeakPolarHBondContact OD2-CB 3.44Å; D495-T497 WeakPolarHBondContact OD2-CG2 3.26Å; D495-T497 PolarHBondContact OD2-N 2.98Å; D495-T497 PolarHBondContact OD2-OG1 2.85Å; T497-K501 WeakPolarHBondContact O-CD 3.36Å; T497-K501 WeakPolarHBondContact O-CE 3.41Å; T497-K501 PolarHBondContact O-NZ 2.83Å; T497-K501 VanDerWaalsContact O-NZ 3.12Å
498	T	90.8	Very high	93.6	Very high	20 Å²	20	79.6 Å²	79.6	12%	0.123	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-32.9	179.2	-54.6	0	0	0	0	112.3	P493 D495 K501 I502	P493-T498 WeakPolarHBondContact O-CB 3.4Å; D495-T498 PolarHBondContact O-N 3.16Å; D495-T498 WeakPolarHBondContact OD1-CB 3.47Å; D495-T498 PolarHBondContact OD1-N 2.91Å; D495-T498 PolarHBondContact OD1-OG1 3.05Å; T498-K501 WeakPolarHBondContact O-CA 3.32Å; T498-K501 WeakPolarHBondContact O-CB 3.36Å; T498-K501 PolarHBondContact O-N 3.39Å; T498-I502 HydrophobicContact CG2-CD1 4.01Å; T498-I502 HydrophobicContact CG2-CG1 4.19Å; T498-I502 PolarHBondContact O-N 3.13Å
499	L	93.1	Very high	93.8	Very high	83 Å²	83	77 Å²	77	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-52.4	-47	177.3	-77.6	167.2	0	0	0	113.9	R494 D495 K501 I502 E503	R494-L499 HydrophobicContact CB-CD2 4.09Å; R494-L499 HydrophobicContact CB-CG 4.35Å; R494-L499 HydrophobicContact CG-CD2 4.34Å; D495-L499 WeakPolarHBondContact O-CG 3.35Å; D495-L499 PolarHBondContact O-N 3.27Å; L499-K501 VanDerWaalsContact C-N 3.26Å; L499-K501 PolarHBondContact O-N 2.91Å; L499-I502 PolarHBondContact O-N 2.97Å; L499-E503 PolarHBondContact O-N 3.18Å
500	P	94.1	Very high	94	Very high	74 Å²	74	78 Å²	78	48%	0.481	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-25.9	176.4	-21.4	34.3	0	0	0	113.9	A496 Y504	A496-P500 VanDerWaalsContact O-CD 3.3Å; A496-P500 WeakPolarHBondContact O-CD 3.28Å; P500-Y504 WeakPolarHBondContact O-CB 3.41Å; P500-Y504 PolarHBondContact O-N 2.85Å
501	K	93.6	Very high	94.2	Very high	108 Å²	108	79.7 Å²	79.7	47%	0.47	42%	0.415	S	S	.	.	H	α-helix	trans	-75.1	-38.8	176.1	-57.9	173	-170.5	145.8	0	111	T497 T498 L499 S505	T497-K501 WeakPolarHBondContact O-CD 3.36Å; T497-K501 WeakPolarHBondContact O-CE 3.41Å; T497-K501 PolarHBondContact O-NZ 2.83Å; T497-K501 VanDerWaalsContact O-NZ 3.12Å; T498-K501 WeakPolarHBondContact O-CA 3.32Å; T498-K501 WeakPolarHBondContact O-CB 3.36Å; T498-K501 PolarHBondContact O-N 3.39Å; L499-K501 VanDerWaalsContact C-N 3.26Å; L499-K501 PolarHBondContact O-N 2.91Å; K501-S505 VanDerWaalsContact O-CB 3.31Å; K501-S505 WeakPolarHBondContact O-CB 3.34Å; K501-S505 PolarHBondContact O-N 3.05Å
502	I	95.1	Very high	94.4	Very high	8 Å²	8	73 Å²	73	4%	0.041	38%	0.379	C	S	.	.	H	α-helix	trans	-61.8	-49.7	173.2	-66.9	166.6	0	0	0	109.4	L489 R494 T498 L499 Y504 S505 Q506	L489-I502 HydrophobicContact CB-CG1 4.11Å; R494-I502 HydrophobicContact CG-CD1 4.39Å; T498-I502 HydrophobicContact CG2-CD1 4.01Å; T498-I502 HydrophobicContact CG2-CG1 4.19Å; T498-I502 PolarHBondContact O-N 3.13Å; L499-I502 PolarHBondContact O-N 2.97Å; I502-Y504 PolarHBondContact O-N 3.08Å; I502-S505 PolarHBondContact O-N 3.03Å; I502-S505 VanDerWaalsContact O-N 3.15Å; I502-Q506 HydrophobicContact CG2-CG 4.43Å; I502-Q506 WeakPolarHBondContact O-CG 3.38Å; I502-Q506 PolarHBondContact O-N 2.87Å
503	E	95.5	Very high	94.9	Very high	116 Å²	116	76.1 Å²	76.1	54%	0.542	38%	0.383	S	S	.	.	H	α-helix	trans	-57.9	-47.8	177.8	-175.6	178.2	-171.8	0	0	112	L499 S505 Q506 Q507	L499-E503 PolarHBondContact O-N 3.18Å; E503-S505 VanDerWaalsContact C-N 3.35Å; E503-S505 PolarHBondContact O-N 3.44Å; E503-Q506 WeakPolarHBondContact O-CB 3.26Å; E503-Q506 PolarHBondContact O-N 2.71Å; E503-Q507 WeakPolarHBondContact O-CG 3.33Å; E503-Q507 PolarHBondContact O-N 3.01Å; E503-Q507 VanDerWaalsContact O-N 3.14Å
504	Y	94.8	Very high	95.3	Very high	126 Å²	126	76.3 Å²	76.3	49%	0.494	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-42	174.7	177.8	-111.1	0	0	0	112.4	P500 I502 Q506 Q507 Q508	P500-Y504 WeakPolarHBondContact O-CB 3.41Å; P500-Y504 PolarHBondContact O-N 2.85Å; I502-Y504 PolarHBondContact O-N 3.08Å; Y504-Q506 VanDerWaalsContact C-N 3.34Å; Y504-Q506 PolarHBondContact O-N 2.98Å; Y504-Q507 WeakPolarHBondContact O-CB 3.43Å; Y504-Q507 PolarHBondContact O-N 3.12Å; Y504-Q508 HydrophobicContact CD1-CG 4.35Å; Y504-Q508 HydrophobicContact CD2-CG 4.45Å; Y504-Q508 HydrophobicContact CE1-CG 3.86Å; Y504-Q508 HydrophobicContact CE2-CG 3.94Å; Y504-Q508 WeakPolarHBondContact O-CG 3.38Å; Y504-Q508 PolarHBondContact O-N 3.2Å; Y504-Q508 PolarHBondContact OH-OE1 2.9Å
505	S	95.6	Very high	95.6	Very high	7 Å²	7	72.4 Å²	72.4	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-68.7	-31.2	178.8	-158.2	0	0	0	0	112.8	K501 I502 E503 Q508 F509	K501-S505 VanDerWaalsContact O-CB 3.31Å; K501-S505 WeakPolarHBondContact O-CB 3.34Å; K501-S505 PolarHBondContact O-N 3.05Å; I502-S505 PolarHBondContact O-N 3.03Å; I502-S505 VanDerWaalsContact O-N 3.15Å; E503-S505 VanDerWaalsContact C-N 3.35Å; E503-S505 PolarHBondContact O-N 3.44Å; S505-Q508 PolarHBondContact O-N 3.26Å; S505-F509 VanDerWaalsContact O-CB 3.31Å; S505-F509 WeakPolarHBondContact O-CB 3.21Å; S505-F509 PolarHBondContact O-N 3.48Å
506	Q	97.6	Very high	95.9	Very high	94 Å²	94	70 Å²	70	44%	0.439	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-44.2	171.2	-72.4	172.8	-2.6	0	0	111.2	L486 I502 E503 Y504 F509 Q510	L486-Q506 HydrophobicContact CD1-CB 4.5Å; L486-Q506 HydrophobicContact CD1-CG 3.55Å; L486-Q506 HydrophobicContact CD2-CG 4.08Å; L486-Q506 HydrophobicContact CG-CG 4.49Å; I502-Q506 HydrophobicContact CG2-CG 4.43Å; I502-Q506 WeakPolarHBondContact O-CG 3.38Å; I502-Q506 PolarHBondContact O-N 2.87Å; E503-Q506 WeakPolarHBondContact O-CB 3.26Å; E503-Q506 PolarHBondContact O-N 2.71Å; Y504-Q506 VanDerWaalsContact C-N 3.34Å; Y504-Q506 PolarHBondContact O-N 2.98Å; Q506-F509 PolarHBondContact O-N 2.87Å; Q506-Q510 PolarHBondContact O-N 2.7Å
507	Q	97.6	Very high	96.2	Very high	102 Å²	102	68.9 Å²	68.9	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-44.5	175.6	-64.9	170.9	14.7	0	0	111.6	E503 Y504 Q510 I511	E503-Q507 WeakPolarHBondContact O-CG 3.33Å; E503-Q507 PolarHBondContact O-N 3.01Å; E503-Q507 VanDerWaalsContact O-N 3.14Å; Y504-Q507 WeakPolarHBondContact O-CB 3.43Å; Y504-Q507 PolarHBondContact O-N 3.12Å; Q507-Q510 PolarHBondContact O-N 3.35Å; Q507-I511 WeakPolarHBondContact O-CD1 3.41Å; Q507-I511 WeakPolarHBondContact O-CG1 3.49Å; Q507-I511 PolarHBondContact O-N 3.34Å; Q507-I511 VanDerWaalsContact O-N 3.17Å
508	Q	96.4	Very high	96.5	Very high	36 Å²	36	71 Å²	71	17%	0.168	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-42.8	177.5	-60.8	-56.8	-91.6	0	0	112.3	Y482 Y504 S505 Q510 I511 H512	Y482-Q508 HydrophobicContact CD1-CB 3.48Å; Y482-Q508 VanDerWaalsContact CD1-CB 3.48Å; Y482-Q508 HydrophobicContact CD1-CG 4.42Å; Y482-Q508 HydrophobicContact CE1-CB 3.56Å; Y482-Q508 HydrophobicContact CE1-CG 4.06Å; Y504-Q508 HydrophobicContact CD1-CG 4.35Å; Y504-Q508 HydrophobicContact CD2-CG 4.45Å; Y504-Q508 HydrophobicContact CE1-CG 3.86Å; Y504-Q508 HydrophobicContact CE2-CG 3.94Å; Y504-Q508 WeakPolarHBondContact O-CG 3.38Å; Y504-Q508 PolarHBondContact O-N 3.2Å; Y504-Q508 PolarHBondContact OH-OE1 2.9Å; S505-Q508 PolarHBondContact O-N 3.26Å; Q508-Q510 VanDerWaalsContact C-N 3.33Å; Q508-Q510 PolarHBondContact O-N 3.48Å; Q508-I511 PolarHBondContact O-N 3.25Å; Q508-H512 PolarHBondContact O-CD2 3.48Å; Q508-H512 VanDerWaalsContact O-CD2 3.26Å; Q508-H512 PolarHBondContact O-N 2.87Å
509	F	98.1	Very high	96.9	Very high	42 Å²	42	71.2 Å²	71.2	18%	0.184	33%	0.33	C	S	.	.	H	α-helix	trans	-55.1	-47	174.6	165.8	-103.2	0	0	0	111.8	F479 R483 L486 S505 Q506 I511 H512 R513	F479-F509 HydrophobicContact CD2-CE2 4.12Å; F479-F509 HydrophobicContact CE2-CD2 4.23Å; F479-F509 AromaticContact CE2-CE2 3.42Å; F479-F509 HydrophobicContact CE2-CE2 3.42Å; F479-F509 VanDerWaalsContact CE2-CE2 3.42Å; F479-F509 AromaticContact CE2-CZ 3.93Å; F479-F509 HydrophobicContact CE2-CZ 3.93Å; F479-F509 HydrophobicContact CZ-CE2 4.14Å; R483-F509 HydrophobicContact CB-CD2 3.98Å; R483-F509 HydrophobicContact CB-CE2 3.78Å; R483-F509 HydrophobicContact CG-CD2 4.48Å; R483-F509 HydrophobicContact CG-CE2 3.89Å; L486-F509 HydrophobicContact CD2-CB 3.79Å; L486-F509 HydrophobicContact CD2-CD1 3.83Å; L486-F509 HydrophobicContact CD2-CD2 4.46Å; L486-F509 HydrophobicContact CD2-CG 3.76Å; S505-F509 VanDerWaalsContact O-CB 3.31Å; S505-F509 WeakPolarHBondContact O-CB 3.21Å; S505-F509 PolarHBondContact O-N 3.48Å; Q506-F509 PolarHBondContact O-N 2.87Å; F509-I511 PolarHBondContact O-N 2.89Å; F509-H512 PolarHBondContact O-N 3.38Å; F509-R513 VanDerWaalsContact O-CB 3.27Å; F509-R513 WeakPolarHBondContact O-CB 3.37Å; F509-R513 PolarHBondContact O-N 3.04Å
510	Q	98.3	Very high	97.1	Very high	72 Å²	72	70.9 Å²	70.9	34%	0.336	32%	0.323	S	S	.	.	H	α-helix	trans	-63.4	-40.5	179.4	-175.1	59.3	26.6	0	0	112.3	Q506 Q507 Q508 R513 E514	Q506-Q510 PolarHBondContact O-N 2.7Å; Q507-Q510 PolarHBondContact O-N 3.35Å; Q508-Q510 VanDerWaalsContact C-N 3.33Å; Q508-Q510 PolarHBondContact O-N 3.48Å; Q510-R513 WeakPolarHBondContact O-CB 3.43Å; Q510-R513 PolarHBondContact O-N 3.1Å; Q510-E514 WeakPolarHBondContact CG-OE1 3.38Å; Q510-E514 PolarHBondContact NE2-OE1 3.2Å; Q510-E514 WeakPolarHBondContact O-CG 3.5Å; Q510-E514 PolarHBondContact O-N 2.98Å
511	I	97.9	Very high	97.3	Very high	91 Å²	91	71.2 Å²	71.2	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-61.9	-46.6	176	-68.7	163.3	0	0	0	111.7	Q507 Q508 F509 R513 E514 K515	Q507-I511 WeakPolarHBondContact O-CD1 3.41Å; Q507-I511 WeakPolarHBondContact O-CG1 3.49Å; Q507-I511 PolarHBondContact O-N 3.34Å; Q507-I511 VanDerWaalsContact O-N 3.17Å; Q508-I511 PolarHBondContact O-N 3.25Å; F509-I511 PolarHBondContact O-N 2.89Å; I511-R513 VanDerWaalsContact C-N 3.35Å; I511-E514 PolarHBondContact O-N 2.85Å; I511-K515 WeakPolarHBondContact O-CB 3.11Å; I511-K515 PolarHBondContact O-N 3.28Å
512	H	98.3	Very high	97.5	Very high	20 Å²	20	69 Å²	69	9%	0.093	31%	0.314	C	S	.	.	H	α-helix	trans	-72.2	-29.6	179	-72.8	-80.8	0	0	0	112.3	E478 Y482 Q508 F509 K515 Y516	E478-H512 IonicContact OE2-CE1 2.87Å; E478-H512 PolarHBondContact OE2-CE1 2.96Å; E478-H512 VanDerWaalsContact OE2-CE1 3.22Å; E478-H512 IonicContact OE2-ND1 3.69Å; E478-H512 PolarHBondContact OE2-ND1 3.3Å; Y482-H512 AromaticContact CD1-CD2 3.97Å; Y482-H512 AromaticContact CD2-CD2 3.67Å; Y482-H512 AromaticContact CD2-NE2 3.89Å; Y482-H512 AromaticContact CE2-CD2 3.8Å; Y482-H512 AromaticContact CE2-CE1 3.97Å; Y482-H512 AromaticContact CE2-NE2 3.5Å; Y482-H512 WeakPolarHBondContact CE2-NE2 3.27Å; Y482-H512 AromaticContact CG-CD2 3.75Å; Y482-H512 AromaticContact CZ-CD2 3.95Å; Y482-H512 AromaticContact CZ-NE2 3.52Å; Q508-H512 PolarHBondContact O-CD2 3.48Å; Q508-H512 VanDerWaalsContact O-CD2 3.26Å; Q508-H512 PolarHBondContact O-N 2.87Å; F509-H512 PolarHBondContact O-N 3.38Å; H512-K515 PolarHBondContact O-N 3.42Å; H512-Y516 WeakPolarHBondContact O-CB 3.32Å; H512-Y516 PolarHBondContact O-N 2.8Å
513	R	98.5	Very high	97.7	Very high	92 Å²	92	68.6 Å²	68.6	35%	0.347	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-50.9	170.3	-177.6	-177	171.7	-165.9	-7.6	111.9	F479 F509 Q510 I511 K515 Y516 E517	F479-R513 HydrophobicContact CD2-CB 3.78Å; F479-R513 HydrophobicContact CD2-CG 4.23Å; F479-R513 HydrophobicContact CE2-CB 3.69Å; F479-R513 HydrophobicContact CE2-CG 3.75Å; F509-R513 VanDerWaalsContact O-CB 3.27Å; F509-R513 WeakPolarHBondContact O-CB 3.37Å; F509-R513 PolarHBondContact O-N 3.04Å; Q510-R513 WeakPolarHBondContact O-CB 3.43Å; Q510-R513 PolarHBondContact O-N 3.1Å; I511-R513 VanDerWaalsContact C-N 3.35Å; R513-K515 VanDerWaalsContact C-N 3.3Å; R513-K515 PolarHBondContact O-N 3.33Å; R513-Y516 PolarHBondContact O-N 2.8Å; R513-E517 HydrophobicContact CG-CG 4.38Å; R513-E517 IonicContact CZ-OE1 2.74Å; R513-E517 IonicContact NE-OE1 3.18Å; R513-E517 PolarHBondContact NE-OE1 3.25Å; R513-E517 IonicContact NH2-OE1 2.57Å; R513-E517 PolarHBondContact NH2-OE1 2.68Å; R513-E517 IonicContact NH2-OE2 2.79Å; R513-E517 WeakPolarHBondContact O-CG 3.36Å; R513-E517 PolarHBondContact O-N 2.98Å
514	E	98.6	Very high	97.8	Very high	108 Å²	108	64.1 Å²	64.1	51%	0.505	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-39.2	178	-73.6	169.2	-165.3	0	0	111.6	Q510 I511 K518	Q510-E514 WeakPolarHBondContact CG-OE1 3.38Å; Q510-E514 PolarHBondContact NE2-OE1 3.2Å; Q510-E514 WeakPolarHBondContact O-CG 3.5Å; Q510-E514 PolarHBondContact O-N 2.98Å; I511-E514 PolarHBondContact O-N 2.85Å; E514-K518 VanDerWaalsContact O-CB 3.25Å; E514-K518 WeakPolarHBondContact O-CB 3.34Å; E514-K518 PolarHBondContact O-N 3.34Å
515	K	98.3	Very high	98	Very high	85 Å²	85	62.3 Å²	62.3	37%	0.37	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-46.9	172.4	-176.1	-174	174	-175.8	0	111.9	A475 E478 I511 H512 R513 M519	A475-K515 HydrophobicContact CB-CD 4.37Å; A475-K515 HydrophobicContact CB-CG 4.17Å; E478-K515 IonicContact OE1-NZ 3.4Å; E478-K515 PolarHBondContact OE1-NZ 3.48Å; E478-K515 WeakPolarHBondContact OE2-CD 3.48Å; E478-K515 WeakPolarHBondContact OE2-CE 3.32Å; E478-K515 IonicContact OE2-NZ 3.21Å; E478-K515 PolarHBondContact OE2-NZ 2.87Å; I511-K515 WeakPolarHBondContact O-CB 3.11Å; I511-K515 PolarHBondContact O-N 3.28Å; H512-K515 PolarHBondContact O-N 3.42Å; R513-K515 VanDerWaalsContact C-N 3.3Å; R513-K515 PolarHBondContact O-N 3.33Å; K515-M519 WeakPolarHBondContact O-CB 3.38Å; K515-M519 WeakPolarHBondContact O-CG 3.49Å; K515-M519 PolarHBondContact O-N 2.85Å
516	Y	98.6	Very high	98.1	Very high	11 Å²	11	65 Å²	65	4%	0.043	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-51.7	178.6	167	-107.1	0	0	0	112.3	T365 Y472 R476 F479 H512 R513 K518 M519 R520	T365-Y516 HydrophobicContact CG2-CE1 4Å; T365-Y516 WeakPolarHBondContact CG2-OH 3.45Å; Y472-Y516 HydrophobicContact CD2-CD2 4.47Å; Y472-Y516 HydrophobicContact CD2-CE2 4.21Å; Y472-Y516 HydrophobicContact CE2-CD2 4.09Å; Y472-Y516 AromaticContact CE2-CE2 3.42Å; Y472-Y516 HydrophobicContact CE2-CE2 3.42Å; Y472-Y516 VanDerWaalsContact CE2-CE2 3.42Å; Y472-Y516 AromaticContact CZ-CE2 3.98Å; R476-Y516 HydrophobicContact CB-CD2 3.86Å; R476-Y516 HydrophobicContact CB-CE2 3.79Å; R476-Y516 HydrophobicContact CG-CD2 4.35Å; R476-Y516 HydrophobicContact CG-CE2 3.9Å; F479-Y516 HydrophobicContact CB-CG 4.18Å; F479-Y516 AromaticContact CD1-CD1 3.98Å; F479-Y516 HydrophobicContact CD1-CD1 3.98Å; F479-Y516 HydrophobicContact CD1-CE1 4.39Å; F479-Y516 HydrophobicContact CD1-CG 4.28Å; F479-Y516 HydrophobicContact CE1-CD1 4.34Å; F479-Y516 HydrophobicContact CG-CD1 4.21Å; F479-Y516 HydrophobicContact CG-CG 4.26Å; H512-Y516 WeakPolarHBondContact O-CB 3.32Å; H512-Y516 PolarHBondContact O-N 2.8Å; R513-Y516 PolarHBondContact O-N 2.8Å; Y516-K518 VanDerWaalsContact C-N 3.26Å; Y516-K518 PolarHBondContact O-N 3.33Å; Y516-M519 PolarHBondContact O-N 3.41Å; Y516-M519 VanDerWaalsContact O-N 3.15Å; Y516-R520 WeakPolarHBondContact O-CB 3.49Å; Y516-R520 PolarHBondContact O-N 2.78Å
517	E	98.4	Very high	98.1	Very high	64 Å²	64	61.3 Å²	61.3	30%	0.299	29%	0.285	S	S	.	.	H	α-helix	trans	-59	-38.4	179.4	-72.7	-178.1	179.6	0	0	111.4	R513 N521	R513-E517 HydrophobicContact CG-CG 4.38Å; R513-E517 IonicContact CZ-OE1 2.74Å; R513-E517 IonicContact NE-OE1 3.18Å; R513-E517 PolarHBondContact NE-OE1 3.25Å; R513-E517 IonicContact NH2-OE1 2.57Å; R513-E517 PolarHBondContact NH2-OE1 2.68Å; R513-E517 IonicContact NH2-OE2 2.79Å; R513-E517 WeakPolarHBondContact O-CG 3.36Å; R513-E517 PolarHBondContact O-N 2.98Å; E517-N521 PolarHBondContact O-N 3.23Å; E517-N521 PolarHBondContact O-ND2 2.76Å; E517-N521 PolarHBondContact O-OD1 3.37Å
518	K	98.3	Very high	98	Very high	131 Å²	131	61.8 Å²	61.8	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-63.3	-55.2	171.5	-178.7	-179.7	173.6	-177.9	0	112.2	E514 Y516 R520 N521 D522	E514-K518 VanDerWaalsContact O-CB 3.25Å; E514-K518 WeakPolarHBondContact O-CB 3.34Å; E514-K518 PolarHBondContact O-N 3.34Å; Y516-K518 VanDerWaalsContact C-N 3.26Å; Y516-K518 PolarHBondContact O-N 3.33Å; K518-R520 PolarHBondContact O-N 2.96Å; K518-N521 PolarHBondContact O-N 3.38Å; K518-N521 VanDerWaalsContact O-N 3.07Å; K518-D522 WeakPolarHBondContact CE-OD2 3.5Å; K518-D522 WeakPolarHBondContact CG-OD2 3.48Å; K518-D522 PolarHBondContact O-N 2.99Å
519	M	98.2	Very high	98	Very high	26 Å²	26	66.8 Å²	66.8	13%	0.128	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-36.2	-176.9	-75.9	-56.3	-48.1	0	0	112.6	Q471 Y472 A475 K515 Y516 D522 V523	Q471-M519 HydrophobicContact CB-CE 3.65Å; Y472-M519 HydrophobicContact CD2-CB 4.39Å; A475-M519 HydrophobicContact CB-CB 4.22Å; A475-M519 HydrophobicContact CB-CG 3.96Å; K515-M519 WeakPolarHBondContact O-CB 3.38Å; K515-M519 WeakPolarHBondContact O-CG 3.49Å; K515-M519 PolarHBondContact O-N 2.85Å; Y516-M519 PolarHBondContact O-N 3.41Å; Y516-M519 VanDerWaalsContact O-N 3.15Å; M519-D522 PolarHBondContact O-N 2.99Å; M519-V523 WeakPolarHBondContact O-CB 3.39Å; M519-V523 WeakPolarHBondContact O-CG2 3.44Å; M519-V523 PolarHBondContact O-N 3.26Å
520	R	98.4	Very high	98	Very high	76 Å²	76	65.2 Å²	65.2	29%	0.287	30%	0.301	S	S	.	.	H	α-helix	trans	-60.7	-47.4	174.6	-170.6	-170.9	64.5	-179.7	-5.1	111.7	D367 L370 Y472 Y516 K518 V523 S524	D367-R520 WeakPolarHBondContact OD2-CD 3.26Å; L370-R520 HydrophobicContact CD2-CG 3.7Å; Y472-R520 HydrophobicContact CD2-CB 4.01Å; Y472-R520 HydrophobicContact CE2-CB 3.67Å; Y472-R520 HydrophobicContact CE2-CG 3.81Å; Y516-R520 WeakPolarHBondContact O-CB 3.49Å; Y516-R520 PolarHBondContact O-N 2.78Å; K518-R520 PolarHBondContact O-N 2.96Å; R520-V523 PolarHBondContact O-N 2.85Å; R520-S524 PolarHBondContact O-N 2.9Å
521	N	98.1	Very high	97.8	Very high	80 Å²	80	66 Å²	66	43%	0.428	30%	0.304	S	S	.	.	H	α-helix	trans	-66	-44.3	178.3	-61.8	-10.8	0	0	0	111	E517 K518 V523 S524 I525	E517-N521 PolarHBondContact O-N 3.23Å; E517-N521 PolarHBondContact O-ND2 2.76Å; E517-N521 PolarHBondContact O-OD1 3.37Å; K518-N521 PolarHBondContact O-N 3.38Å; K518-N521 VanDerWaalsContact O-N 3.07Å; N521-V523 VanDerWaalsContact C-N 3.34Å; N521-V523 PolarHBondContact O-N 2.98Å; N521-S524 PolarHBondContact O-N 3.49Å; N521-I525 WeakPolarHBondContact O-CB 3.48Å; N521-I525 VanDerWaalsContact O-CG1 3.29Å; N521-I525 WeakPolarHBondContact O-CG1 3.35Å; N521-I525 PolarHBondContact O-N 3.37Å
522	D	97.8	Very high	97.5	Very high	61 Å²	61	66.6 Å²	66.6	33%	0.326	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-41.3	178	-72.4	-15.8	0	0	0	111.5	K518 M519 K526	K518-D522 WeakPolarHBondContact CE-OD2 3.5Å; K518-D522 WeakPolarHBondContact CG-OD2 3.48Å; K518-D522 PolarHBondContact O-N 2.99Å; M519-D522 PolarHBondContact O-N 2.99Å; D522-K526 WeakPolarHBondContact O-CB 3.46Å; D522-K526 WeakPolarHBondContact O-CG 3.46Å; D522-K526 PolarHBondContact O-N 3.42Å
523	V	98.5	Very high	97.2	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-69.1	-44.4	175.4	170.5	0	0	0	0	112.2	L370 I374 N468 I469 Y472 M519 R520 N521 I525 K526 L527	L370-V523 HydrophobicContact CD1-CG1 4.23Å; L370-V523 HydrophobicContact CD2-CG1 4.4Å; I374-V523 HydrophobicContact CD1-CG1 4.48Å; N468-V523 HydrophobicContact CB-CG2 4.24Å; N468-V523 WeakPolarHBondContact O-CG2 3.3Å; I469-V523 HydrophobicContact CG1-CG1 3.7Å; I469-V523 HydrophobicContact CG1-CG2 4.47Å; Y472-V523 HydrophobicContact CG-CG2 4.46Å; M519-V523 WeakPolarHBondContact O-CB 3.39Å; M519-V523 WeakPolarHBondContact O-CG2 3.44Å; M519-V523 PolarHBondContact O-N 3.26Å; R520-V523 PolarHBondContact O-N 2.85Å; N521-V523 VanDerWaalsContact C-N 3.34Å; N521-V523 PolarHBondContact O-N 2.98Å; V523-I525 VanDerWaalsContact C-N 3.26Å; V523-I525 PolarHBondContact O-N 3.17Å; V523-K526 PolarHBondContact O-N 3.38Å; V523-L527 HydrophobicContact CG1-CD1 3.81Å; V523-L527 HydrophobicContact CG1-CG 4.31Å; V523-L527 WeakPolarHBondContact O-CG 3.47Å; V523-L527 PolarHBondContact O-N 3.3Å
524	S	98.2	Very high	97.1	Very high	22 Å²	22	65.3 Å²	65.3	15%	0.154	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-38.1	176.2	-172.2	0	0	0	0	112.1	R520 N521 K528	R520-S524 PolarHBondContact O-N 2.9Å; N521-S524 PolarHBondContact O-N 3.49Å; S524-K528 WeakPolarHBondContact O-CD 3.32Å; S524-K528 WeakPolarHBondContact O-CG 3.39Å; S524-K528 PolarHBondContact O-N 2.85Å; S524-K528 PolarHBondContact OG-NZ 3.41Å
525	I	97.8	Very high	96.8	Very high	88 Å²	88	64 Å²	64	45%	0.451	31%	0.305	S	S	.	.	H	α-helix	trans	-69.7	-44.7	175.7	-69.3	167.1	0	0	0	111	N521 V523 L527 K528 F529	N521-I525 WeakPolarHBondContact O-CB 3.48Å; N521-I525 VanDerWaalsContact O-CG1 3.29Å; N521-I525 WeakPolarHBondContact O-CG1 3.35Å; N521-I525 PolarHBondContact O-N 3.37Å; V523-I525 VanDerWaalsContact C-N 3.26Å; V523-I525 PolarHBondContact O-N 3.17Å; I525-L527 PolarHBondContact O-N 3.49Å; I525-K528 PolarHBondContact O-N 3.47Å; I525-F529 HydrophobicContact CG2-CD2 3.73Å; I525-F529 HydrophobicContact CG2-CE2 3.49Å; I525-F529 VanDerWaalsContact CG2-CE2 3.49Å; I525-F529 WeakPolarHBondContact O-CD2 3.42Å; I525-F529 PolarHBondContact O-N 3.19Å; I525-F529 VanDerWaalsContact O-N 3.16Å
526	K	97.3	Very high	96.6	Very high	63 Å²	63	66.1 Å²	66.1	27%	0.274	31%	0.314	S	S	.	.	H	α-helix	trans	-61.7	-41.1	177	-82.7	-166.4	167.5	-165.8	0	113.1	D464 T465 N468 D522 V523 K528 F529 L530	D464-K526 IonicContact OD1-NZ 2.76Å; D464-K526 IonicContact OD2-NZ 3.31Å; D464-K526 PolarHBondContact OD2-NZ 3Å; T465-K526 HydrophobicContact CG2-CB 4.34Å; N468-K526 HydrophobicContact CB-CD 4.08Å; N468-K526 PolarHBondContact ND2-NZ 3.23Å; N468-K526 WeakPolarHBondContact OD1-CE 3.28Å; N468-K526 PolarHBondContact OD1-NZ 3.04Å; D522-K526 WeakPolarHBondContact O-CB 3.46Å; D522-K526 WeakPolarHBondContact O-CG 3.46Å; D522-K526 PolarHBondContact O-N 3.42Å; V523-K526 PolarHBondContact O-N 3.38Å; K526-K528 VanDerWaalsContact C-N 3.31Å; K526-K528 PolarHBondContact O-N 3.32Å; K526-F529 PolarHBondContact O-N 3.35Å; K526-L530 VanDerWaalsContact O-CB 3.27Å; K526-L530 WeakPolarHBondContact O-CB 3.32Å; K526-L530 PolarHBondContact O-N 3.16Å
527	L	98.2	Very high	96.3	Very high	17 Å²	17	67.6 Å²	67.6	9%	0.089	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-41.7	176.7	-75.1	163.8	0	0	0	112	L370 Q373 I374 L377 T465 I469 V523 I525 L530 E531	L370-L527 HydrophobicContact CD1-CD1 3.68Å; Q373-L527 HydrophobicContact CB-CD1 4.02Å; I374-L527 HydrophobicContact CG1-CD1 4.19Å; L377-L527 HydrophobicContact CB-CD2 4.24Å; L377-L527 HydrophobicContact CD2-CD2 3.72Å; T465-L527 HydrophobicContact CG2-CD2 4.07Å; T465-L527 HydrophobicContact CG2-CG 4.38Å; I469-L527 HydrophobicContact CD1-CD2 4.49Å; V523-L527 HydrophobicContact CG1-CD1 3.81Å; V523-L527 HydrophobicContact CG1-CG 4.31Å; V523-L527 WeakPolarHBondContact O-CG 3.47Å; V523-L527 PolarHBondContact O-N 3.3Å; I525-L527 PolarHBondContact O-N 3.49Å; L527-L530 PolarHBondContact O-N 2.9Å; L527-E531 PolarHBondContact O-N 3.3Å
528	K	96.2	Very high	96	Very high	113 Å²	113	65.6 Å²	65.6	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-45.8	177.9	-71.4	161.1	-177.2	154.4	0	112.2	S524 I525 K526 L530 E531 E532	S524-K528 WeakPolarHBondContact O-CD 3.32Å; S524-K528 WeakPolarHBondContact O-CG 3.39Å; S524-K528 PolarHBondContact O-N 2.85Å; S524-K528 PolarHBondContact OG-NZ 3.41Å; I525-K528 PolarHBondContact O-N 3.47Å; K526-K528 VanDerWaalsContact C-N 3.31Å; K526-K528 PolarHBondContact O-N 3.32Å; K528-L530 VanDerWaalsContact C-N 3.34Å; K528-L530 PolarHBondContact O-N 2.97Å; K528-E531 PolarHBondContact O-N 2.63Å; K528-E532 PolarHBondContact O-N 2.95Å
529	F	95.9	Very high	95.9	Very high	140 Å²	140	65.2 Å²	65.2	61%	0.614	32%	0.315	S	S	*	.	H	α-helix	trans	-65.5	-35.9	174.4	-75.3	-57.1	0	0	0	113.2	I525 K526 N533	I525-F529 HydrophobicContact CG2-CD2 3.73Å; I525-F529 HydrophobicContact CG2-CE2 3.49Å; I525-F529 VanDerWaalsContact CG2-CE2 3.49Å; I525-F529 WeakPolarHBondContact O-CD2 3.42Å; I525-F529 PolarHBondContact O-N 3.19Å; I525-F529 VanDerWaalsContact O-N 3.16Å; K526-F529 PolarHBondContact O-N 3.35Å; F529-N533 WeakPolarHBondContact O-CB 3.42Å; F529-N533 PolarHBondContact O-N 3.42Å
530	L	97.3	Very high	95.7	Very high	10 Å²	10	67.9 Å²	67.9	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-45	176.5	178.6	65.5	0	0	0	111.2	L377 T461 I462 T465 K526 L527 K528 E532 N533 K534	L377-L530 HydrophobicContact CD1-CD2 3.5Å; L377-L530 HydrophobicContact CD2-CD2 3.74Å; L377-L530 HydrophobicContact CG-CD2 4.29Å; T461-L530 HydrophobicContact CG2-CD1 3.71Å; I462-L530 HydrophobicContact CG1-CD1 4.06Å; I462-L530 HydrophobicContact CG1-CD2 4.26Å; T465-L530 HydrophobicContact CG2-CD2 3.92Å; K526-L530 VanDerWaalsContact O-CB 3.27Å; K526-L530 WeakPolarHBondContact O-CB 3.32Å; K526-L530 PolarHBondContact O-N 3.16Å; L527-L530 PolarHBondContact O-N 2.9Å; K528-L530 VanDerWaalsContact C-N 3.34Å; K528-L530 PolarHBondContact O-N 2.97Å; L530-E532 PolarHBondContact O-N 2.92Å; L530-N533 PolarHBondContact O-N 3.49Å; L530-K534 WeakPolarHBondContact O-CB 3.31Å; L530-K534 PolarHBondContact O-N 3.4Å
531	E	94.8	Very high	95.6	Very high	87 Å²	87	64.7 Å²	64.7	41%	0.407	32%	0.318	S	S	.	.	H	α-helix	trans	-59.7	-46.9	178.9	-173	57.9	-150	0	0	111.5	L527 K528 N533 K534 V535	L527-E531 PolarHBondContact O-N 3.3Å; K528-E531 PolarHBondContact O-N 2.63Å; E531-N533 VanDerWaalsContact C-N 3.35Å; E531-N533 PolarHBondContact O-N 2.65Å; E531-K534 PolarHBondContact O-N 2.99Å; E531-K534 VanDerWaalsContact OE1-CE 3.22Å; E531-K534 WeakPolarHBondContact OE1-CE 3.41Å; E531-K534 IonicContact OE1-NZ 2.72Å; E531-K534 PolarHBondContact OE1-NZ 3.22Å; E531-K534 VanDerWaalsContact OE2-CE 3.31Å; E531-K534 WeakPolarHBondContact OE2-CE 3.42Å; E531-K534 IonicContact OE2-NZ 3.64Å; E531-K534 PolarHBondContact OE2-NZ 2.82Å; E531-V535 WeakPolarHBondContact O-CG2 3.47Å; E531-V535 PolarHBondContact O-N 2.66Å
532	E	92.8	Very high	95.5	Very high	105 Å²	105	65.4 Å²	65.4	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-58	-43.3	173.6	-85.2	-161.4	-126.3	0	0	113.1	K528 L530 K536	K528-E532 PolarHBondContact O-N 2.95Å; L530-E532 PolarHBondContact O-N 2.92Å; E532-K536 WeakPolarHBondContact O-CD 3.33Å; E532-K536 WeakPolarHBondContact O-CE 3.5Å; E532-K536 WeakPolarHBondContact O-CG 3.41Å; E532-K536 PolarHBondContact O-N 3.25Å; E532-K536 IonicContact OE2-NZ 2.66Å; E532-K536 PolarHBondContact OE2-NZ 2.96Å
533	N	91.6	Very high	95.4	Very high	68 Å²	68	66 Å²	66	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-68.2	-46.3	179.7	-175	-92.5	0	0	0	111.5	F529 L530 E531 V535 K536 V537	F529-N533 WeakPolarHBondContact O-CB 3.42Å; F529-N533 PolarHBondContact O-N 3.42Å; L530-N533 PolarHBondContact O-N 3.49Å; E531-N533 VanDerWaalsContact C-N 3.35Å; E531-N533 PolarHBondContact O-N 2.65Å; N533-V535 PolarHBondContact O-N 3.4Å; N533-K536 PolarHBondContact O-N 2.93Å; N533-V537 WeakPolarHBondContact O-CG2 3.41Å; N533-V537 PolarHBondContact O-N 3.39Å
534	K	95	Very high	95.3	Very high	16 Å²	16	69.6 Å²	69.6	7%	0.07	34%	0.343	C	S	.	.	H	α-helix	trans	-54.3	-49.3	178.5	-174.7	-158.8	83.1	-179.1	0	111.4	Y384 L457 L530 E531 V537 L538	Y384-K534 HydrophobicContact CE2-CD 3.91Å; Y384-K534 HydrophobicContact CE2-CG 4.07Å; Y384-K534 WeakPolarHBondContact OH-CD 3.44Å; Y384-K534 WeakPolarHBondContact OH-CE 3.48Å; L457-K534 HydrophobicContact CD1-CB 4.45Å; L457-K534 HydrophobicContact CD2-CG 4.24Å; L530-K534 WeakPolarHBondContact O-CB 3.31Å; L530-K534 PolarHBondContact O-N 3.4Å; E531-K534 PolarHBondContact O-N 2.99Å; E531-K534 VanDerWaalsContact OE1-CE 3.22Å; E531-K534 WeakPolarHBondContact OE1-CE 3.41Å; E531-K534 IonicContact OE1-NZ 2.72Å; E531-K534 PolarHBondContact OE1-NZ 3.22Å; E531-K534 VanDerWaalsContact OE2-CE 3.31Å; E531-K534 WeakPolarHBondContact OE2-CE 3.42Å; E531-K534 IonicContact OE2-NZ 3.64Å; E531-K534 PolarHBondContact OE2-NZ 2.82Å; K534-V537 PolarHBondContact O-N 3.47Å; K534-L538 HydrophobicContact CG-CD1 3.92Å; K534-L538 WeakPolarHBondContact O-CB 3.31Å; K534-L538 WeakPolarHBondContact O-CG 3.29Å; K534-L538 PolarHBondContact O-N 2.96Å
535	V	94.1	Very high	95.2	Very high	81 Å²	81	70.7 Å²	70.7	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-47.3	178.1	172	0	0	0	0	111.2	E531 N533 V537 H539	E531-V535 WeakPolarHBondContact O-CG2 3.47Å; E531-V535 PolarHBondContact O-N 2.66Å; N533-V535 PolarHBondContact O-N 3.4Å; V535-V537 PolarHBondContact O-N 2.66Å; V535-H539 WeakPolarHBondContact O-CB 3.27Å; V535-H539 PolarHBondContact O-N 3.31Å
536	K	92.9	Very high	95.2	Very high	129 Å²	129	72.1 Å²	72.1	56%	0.561	35%	0.349	S	S	*	.	H	α-helix	trans	-62.6	-42.5	-179.6	-67.5	163.4	-162.7	169.7	0	112.1	E532 N533	E532-K536 WeakPolarHBondContact O-CD 3.33Å; E532-K536 WeakPolarHBondContact O-CE 3.5Å; E532-K536 WeakPolarHBondContact O-CG 3.41Å; E532-K536 PolarHBondContact O-N 3.25Å; E532-K536 IonicContact OE2-NZ 2.66Å; E532-K536 PolarHBondContact OE2-NZ 2.96Å; N533-K536 PolarHBondContact O-N 2.93Å
537	V	92.3	Very high	95.1	Very high	42 Å²	42	73.2 Å²	73.2	26%	0.255	36%	0.358	S	S	.	.	H	α-helix	trans	-68.3	-53.7	177.8	172.9	0	0	0	0	111.1	L457 N533 K534 V535 H539 N540 Q541	L457-V537 HydrophobicContact CB-CG1 4.46Å; L457-V537 HydrophobicContact CD2-CG1 4.3Å; N533-V537 WeakPolarHBondContact O-CG2 3.41Å; N533-V537 PolarHBondContact O-N 3.39Å; K534-V537 PolarHBondContact O-N 3.47Å; V535-V537 PolarHBondContact O-N 2.66Å; V537-H539 PolarHBondContact O-N 2.82Å; V537-N540 PolarHBondContact O-N 3.48Å; V537-Q541 HydrophobicContact CG1-CG 4.26Å; V537-Q541 WeakPolarHBondContact O-CG 3.47Å; V537-Q541 PolarHBondContact O-N 3.43Å
538	L	93.4	Very high	95	Very high	22 Å²	22	73.4 Å²	73.4	12%	0.115	36%	0.362	C	S	.	.	H	α-helix	trans	-64.7	-38.8	-175.3	-71.2	177	0	0	0	112.6	Y384 V454 L457 K534 N540 Q541 L542	Y384-L538 HydrophobicContact CD1-CD1 4.42Å; Y384-L538 HydrophobicContact CE1-CD1 3.73Å; Y384-L538 HydrophobicContact CE2-CD1 3.95Å; Y384-L538 VanDerWaalsContact CZ-CD1 3.47Å; V454-L538 HydrophobicContact CG2-CD2 4.45Å; L457-L538 HydrophobicContact CD2-CD1 4.11Å; L457-L538 HydrophobicContact CD2-CD2 3.68Å; L457-L538 HydrophobicContact CD2-CG 3.64Å; K534-L538 HydrophobicContact CG-CD1 3.92Å; K534-L538 WeakPolarHBondContact O-CB 3.31Å; K534-L538 WeakPolarHBondContact O-CG 3.29Å; K534-L538 PolarHBondContact O-N 2.96Å; L538-N540 VanDerWaalsContact C-N 3.34Å; L538-N540 PolarHBondContact O-N 2.82Å; L538-Q541 PolarHBondContact O-N 3.34Å; L538-L542 HydrophobicContact CB-CD1 4.37Å; L538-L542 VanDerWaalsContact O-CB 3.3Å; L538-L542 WeakPolarHBondContact O-CB 3.25Å; L538-L542 WeakPolarHBondContact O-CG 3.43Å; L538-L542 PolarHBondContact O-N 3.31Å
539	H	95.2	Very high	95	Very high	123 Å²	123	70.1 Å²	70.1	57%	0.569	35%	0.349	S	S	*	.	H	α-helix	trans	-55.6	-48.8	176.6	179.2	76.6	0	0	0	111.7	V535 V537 I543	V535-H539 WeakPolarHBondContact O-CB 3.27Å; V535-H539 PolarHBondContact O-N 3.31Å; V537-H539 PolarHBondContact O-N 2.82Å; H539-I543 WeakPolarHBondContact NE2-CD1 3.47Å; H539-I543 WeakPolarHBondContact O-CG1 3.48Å; H539-I543 PolarHBondContact O-N 3.16Å
540	N	93.6	Very high	95	Very high	82 Å²	82	65.5 Å²	65.5	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-65.2	-45.5	177.7	-177.8	76.5	0	0	0	112.4	V537 L538 I543 L544	V537-N540 PolarHBondContact O-N 3.48Å; L538-N540 VanDerWaalsContact C-N 3.34Å; L538-N540 PolarHBondContact O-N 2.82Å; N540-I543 PolarHBondContact O-N 3.37Å; N540-L544 WeakPolarHBondContact ND2-CD1 3.5Å; N540-L544 WeakPolarHBondContact O-CG 3.06Å; N540-L544 PolarHBondContact O-N 3.01Å
541	Q	96.3	Very high	94.9	Very high	9 Å²	9	68 Å²	68	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-67.1	-40.4	-177.6	-64.5	-56.5	-28.9	0	0	112.6	F450 N453 V537 L538 L544 F545	F450-Q541 HydrophobicContact CD2-CB 3.83Å; F450-Q541 WeakPolarHBondContact CD2-O 3.38Å; F450-Q541 HydrophobicContact CE2-CB 3.96Å; N453-Q541 HydrophobicContact CB-CG 3.87Å; N453-Q541 PolarHBondContact OD1-NE2 3.32Å; V537-Q541 HydrophobicContact CG1-CG 4.26Å; V537-Q541 WeakPolarHBondContact O-CG 3.47Å; V537-Q541 PolarHBondContact O-N 3.43Å; L538-Q541 PolarHBondContact O-N 3.34Å; Q541-L544 PolarHBondContact O-N 3.2Å; Q541-F545 WeakPolarHBondContact O-CB 3.12Å; Q541-F545 PolarHBondContact O-N 3.07Å
542	L	96.6	Very high	94.9	Very high	96 Å²	96	64.8 Å²	64.8	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-65.3	-39.2	177.4	-69.7	168.2	0	0	0	112	F450 L538 H546	F450-L542 HydrophobicContact CE2-CD2 4.13Å; F450-L542 HydrophobicContact CZ-CD2 4.26Å; L538-L542 HydrophobicContact CB-CD1 4.37Å; L538-L542 VanDerWaalsContact O-CB 3.3Å; L538-L542 WeakPolarHBondContact O-CB 3.25Å; L538-L542 WeakPolarHBondContact O-CG 3.43Å; L538-L542 PolarHBondContact O-N 3.31Å; L542-H546 WeakPolarHBondContact O-CB 3.25Å; L542-H546 PolarHBondContact O-N 2.99Å
543	I	96.4	Very high	94.9	Very high	73 Å²	73	67.1 Å²	67.1	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-46	174.4	-71.4	171.1	0	0	0	111	H539 N540 F545 H546 N547	H539-I543 WeakPolarHBondContact NE2-CD1 3.47Å; H539-I543 WeakPolarHBondContact O-CG1 3.48Å; H539-I543 PolarHBondContact O-N 3.16Å; N540-I543 PolarHBondContact O-N 3.37Å; I543-F545 VanDerWaalsContact C-N 3.34Å; I543-F545 PolarHBondContact O-N 3Å; I543-H546 PolarHBondContact O-N 2.79Å; I543-N547 VanDerWaalsContact O-CB 3.3Å; I543-N547 WeakPolarHBondContact O-CB 3.33Å; I543-N547 PolarHBondContact O-N 3.15Å; I543-N547 PolarHBondContact O-ND2 3.26Å; I543-N547 PolarHBondContact O-OD1 3.07Å
544	L	95	Very high	94.9	Very high	75 Å²	75	66.6 Å²	66.6	39%	0.393	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-41	177.9	-71	174.8	0	0	0	112.2	F449 N540 Q541 A548	F449-L544 HydrophobicContact CE1-CD1 4.1Å; N540-L544 WeakPolarHBondContact ND2-CD1 3.5Å; N540-L544 WeakPolarHBondContact O-CG 3.06Å; N540-L544 PolarHBondContact O-N 3.01Å; Q541-L544 PolarHBondContact O-N 3.2Å; L544-A548 WeakPolarHBondContact O-CB 3.41Å; L544-A548 PolarHBondContact O-N 3.27Å
545	F	96.9	Very high	94.6	Very high	45 Å²	45	68.1 Å²	68.1	20%	0.197	38%	0.375	C	S	.	.	H	α-helix	trans	-63.5	-49	175.7	-177.4	-92.9	0	0	0	112.1	T391 L394 I447 F450 Q541 I543 N547 A548 I549	T391-F545 HydrophobicContact CG2-CD2 4.48Å; T391-F545 HydrophobicContact CG2-CE2 3.64Å; T391-F545 HydrophobicContact CG2-CZ 4.23Å; L394-F545 HydrophobicContact CD2-CZ 4.23Å; I447-F545 HydrophobicContact CG1-CD2 4.46Å; I447-F545 HydrophobicContact CG1-CE2 3.94Å; I447-F545 HydrophobicContact CG2-CE2 4.47Å; F450-F545 HydrophobicContact CB-CD2 3.98Å; F450-F545 AromaticContact CD1-CD2 3.95Å; F450-F545 HydrophobicContact CD1-CD2 3.95Å; F450-F545 HydrophobicContact CD1-CE2 4.37Å; F450-F545 HydrophobicContact CD2-CB 3.67Å; F450-F545 HydrophobicContact CD2-CD2 4.13Å; F450-F545 HydrophobicContact CD2-CG 4.16Å; F450-F545 HydrophobicContact CE1-CD2 4.45Å; F450-F545 HydrophobicContact CE2-CB 4.05Å; F450-F545 HydrophobicContact CE2-CG 4.4Å; F450-F545 HydrophobicContact CG-CB 4.16Å; F450-F545 AromaticContact CG-CD2 3.76Å; F450-F545 HydrophobicContact CG-CD2 3.76Å; F450-F545 HydrophobicContact CG-CG 4.26Å; Q541-F545 WeakPolarHBondContact O-CB 3.12Å; Q541-F545 PolarHBondContact O-N 3.07Å; I543-F545 VanDerWaalsContact C-N 3.34Å; I543-F545 PolarHBondContact O-N 3Å; F545-N547 PolarHBondContact O-N 3.19Å; F545-A548 PolarHBondContact O-N 2.88Å; F545-I549 HydrophobicContact CD1-CG1 4.38Å; F545-I549 HydrophobicContact CE1-CG1 4.08Å; F545-I549 HydrophobicContact CZ-CD1 4.43Å; F545-I549 HydrophobicContact CZ-CG1 4.3Å; F545-I549 WeakPolarHBondContact O-CG1 3.28Å; F545-I549 PolarHBondContact O-N 3.34Å; F545-I549 VanDerWaalsContact O-N 3.09Å
546	H	96.9	Very high	94.3	Very high	118 Å²	118	65 Å²	65	55%	0.546	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-47.7	176.1	174	73.9	0	0	0	111.8	L542 I543 A548 I549 A550	L542-H546 WeakPolarHBondContact O-CB 3.25Å; L542-H546 PolarHBondContact O-N 2.99Å; I543-H546 PolarHBondContact O-N 2.79Å; H546-A548 VanDerWaalsContact C-N 3.32Å; H546-A548 PolarHBondContact O-N 3.42Å; H546-I549 PolarHBondContact O-N 3.36Å; H546-A550 WeakPolarHBondContact O-CB 3.3Å; H546-A550 PolarHBondContact O-N 3.18Å
547	N	96.1	Very high	94	Very high	87 Å²	87	63.8 Å²	63.8	47%	0.465	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-38	-179.2	-70.8	-7.3	0	0	0	112.1	I543 F545 A551	I543-N547 VanDerWaalsContact O-CB 3.3Å; I543-N547 WeakPolarHBondContact O-CB 3.33Å; I543-N547 PolarHBondContact O-N 3.15Å; I543-N547 PolarHBondContact O-ND2 3.26Å; I543-N547 PolarHBondContact O-OD1 3.07Å; F545-N547 PolarHBondContact O-N 3.19Å; N547-A551 WeakPolarHBondContact O-CB 3.35Å; N547-A551 PolarHBondContact O-N 2.94Å
548	A	96.4	Very high	93.3	Very high	20 Å²	20	69 Å²	69	17%	0.165	37%	0.373	C	S	.	.	H	α-helix	trans	-66.4	-44.3	176	0	0	0	0	0	112.4	L443 A446 L544 F545 H546 A551 Y552	L443-A548 HydrophobicContact CD1-CB 4.07Å; A446-A548 HydrophobicContact CB-CB 3.44Å; A446-A548 VanDerWaalsContact CB-CB 3.44Å; L544-A548 WeakPolarHBondContact O-CB 3.41Å; L544-A548 PolarHBondContact O-N 3.27Å; F545-A548 PolarHBondContact O-N 2.88Å; H546-A548 VanDerWaalsContact C-N 3.32Å; H546-A548 PolarHBondContact O-N 3.42Å; A548-A551 PolarHBondContact O-N 3.45Å; A548-Y552 PolarHBondContact O-N 2.85Å
549	I	95.9	Very high	92.4	Very high	44 Å²	44	69.7 Å²	69.7	23%	0.226	38%	0.376	C	S	.	.	H	α-helix	trans	-60.5	-49	175.2	-69	-78.1	0	0	0	110.5	L443 I447 F545 H546 A551 Y552 Y553	L443-I549 HydrophobicContact CD1-CD1 3.85Å; L443-I549 HydrophobicContact CD1-CG1 4.18Å; L443-I549 HydrophobicContact CD2-CD1 4.25Å; I447-I549 HydrophobicContact CD1-CD1 4.46Å; F545-I549 HydrophobicContact CD1-CG1 4.38Å; F545-I549 HydrophobicContact CE1-CG1 4.08Å; F545-I549 HydrophobicContact CZ-CD1 4.43Å; F545-I549 HydrophobicContact CZ-CG1 4.3Å; F545-I549 WeakPolarHBondContact O-CG1 3.28Å; F545-I549 PolarHBondContact O-N 3.34Å; F545-I549 VanDerWaalsContact O-N 3.09Å; H546-I549 PolarHBondContact O-N 3.36Å; I549-A551 PolarHBondContact O-N 3.03Å; I549-Y552 PolarHBondContact O-N 3.46Å; I549-Y553 HydrophobicContact CG2-CD2 4.11Å; I549-Y553 HydrophobicContact CG2-CE2 4.04Å; I549-Y553 VanDerWaalsContact O-CD2 3.26Å; I549-Y553 WeakPolarHBondContact O-CD2 3.07Å; I549-Y553 PolarHBondContact O-N 2.85Å
550	A	95.8	Very high	91.5	Very high	44 Å²	44	68.5 Å²	68.5	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-62.2	-43.8	178.7	0	0	0	0	0	112.2	H546 Y552 Y553 A554	H546-A550 WeakPolarHBondContact O-CB 3.3Å; H546-A550 PolarHBondContact O-N 3.18Å; A550-Y552 PolarHBondContact O-N 3.5Å; A550-Y553 PolarHBondContact O-N 3.15Å; A550-A554 VanDerWaalsContact O-CB 3.26Å; A550-A554 WeakPolarHBondContact O-CB 3.48Å; A550-A554 PolarHBondContact O-N 2.99Å
551	A	94	Very high	90.9	Very high	63 Å²	63	67.5 Å²	67.5	52%	0.521	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-35.7	178.3	0	0	0	0	0	113	N547 A548 I549 G555	N547-A551 WeakPolarHBondContact O-CB 3.35Å; N547-A551 PolarHBondContact O-N 2.94Å; A548-A551 PolarHBondContact O-N 3.45Å; I549-A551 PolarHBondContact O-N 3.03Å; A551-G555 PolarHBondContact O-N 3.42Å
552	Y	95	Very high	89.9	Confident	19 Å²	19	71.6 Å²	71.6	8%	0.075	39%	0.387	C	S	.	.	H	α-helix	trans	-61.7	-53.3	174	176.2	-107	0	0	0	111.4	L436 N439 L443 A548 I549 A550 G555 N556	L436-Y552 PolarHBondContact O-OH 2.93Å; N439-Y552 HydrophobicContact CB-CD2 4.02Å; N439-Y552 HydrophobicContact CB-CE2 3.92Å; L443-Y552 HydrophobicContact CB-CD2 4.17Å; L443-Y552 HydrophobicContact CB-CG 4.27Å; L443-Y552 HydrophobicContact CD2-CD1 3.73Å; L443-Y552 HydrophobicContact CD2-CD2 4.22Å; L443-Y552 HydrophobicContact CD2-CE1 4.29Å; L443-Y552 HydrophobicContact CD2-CG 3.69Å; A548-Y552 PolarHBondContact O-N 2.85Å; I549-Y552 PolarHBondContact O-N 3.46Å; A550-Y552 PolarHBondContact O-N 3.5Å; Y552-G555 PolarHBondContact O-N 3.06Å; Y552-N556 WeakPolarHBondContact CE2-ND2 3.47Å; Y552-N556 PolarHBondContact O-N 3.48Å; Y552-N556 VanDerWaalsContact O-N 3.12Å; Y552-N556 PolarHBondContact O-ND2 3.12Å
553	Y	93.3	Very high	88.7	Confident	153 Å²	153	68.1 Å²	68.1	60%	0.6	37%	0.37	S	S	*	.	H	α-helix	trans	-67.4	-42	-178.5	-70.9	-66.6	0	0	0	112.6	I549 A550 N556 Q557	I549-Y553 HydrophobicContact CG2-CD2 4.11Å; I549-Y553 HydrophobicContact CG2-CE2 4.04Å; I549-Y553 VanDerWaalsContact O-CD2 3.26Å; I549-Y553 WeakPolarHBondContact O-CD2 3.07Å; I549-Y553 PolarHBondContact O-N 2.85Å; A550-Y553 PolarHBondContact O-N 3.15Å; Y553-N556 PolarHBondContact O-N 3.29Å; Y553-Q557 PolarHBondContact O-N 3.26Å
554	A	91.3	Very high	87.4	Confident	58 Å²	58	66.9 Å²	66.9	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-65.5	-39.1	176.3	0	0	0	0	0	112.7	A550 N556 Q557	A550-A554 VanDerWaalsContact O-CB 3.26Å; A550-A554 WeakPolarHBondContact O-CB 3.48Å; A550-A554 PolarHBondContact O-N 2.99Å; A554-N556 VanDerWaalsContact C-N 3.27Å; A554-N556 PolarHBondContact O-N 2.99Å; A554-Q557 WeakPolarHBondContact O-CB 3.37Å; A554-Q557 PolarHBondContact O-N 3.25Å
555	G	88.5	Confident	86.4	Confident	48 Å²	48	70.2 Å²	70.2	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-29.3	175.5	0	0	0	0	0	113.4	A551 Y552	A551-G555 PolarHBondContact O-N 3.42Å; Y552-G555 PolarHBondContact O-N 3.06Å
556	N	88.1	Confident	84.9	Confident	15 Å²	15	73.5 Å²	73.5	8%	0.08	39%	0.391	C	S	.	.	H	α-helix	trans	-85.6	-20.3	175.7	-64.1	-28.2	0	0	0	113.3	L436 N439 Y552 Y553 A554 Q558 Q559 L560	L436-N556 HydrophobicContact CD2-CB 3.84Å; L436-N556 VanDerWaalsContact CD2-CG 3.5Å; N439-N556 PolarHBondContact ND2-OD1 3.24Å; Y552-N556 WeakPolarHBondContact CE2-ND2 3.47Å; Y552-N556 PolarHBondContact O-N 3.48Å; Y552-N556 VanDerWaalsContact O-N 3.12Å; Y552-N556 PolarHBondContact O-ND2 3.12Å; Y553-N556 PolarHBondContact O-N 3.29Å; A554-N556 VanDerWaalsContact C-N 3.27Å; A554-N556 PolarHBondContact O-N 2.99Å; N556-Q558 VanDerWaalsContact C-N 3.34Å; N556-Q558 PolarHBondContact O-N 2.88Å; N556-Q559 PolarHBondContact O-N 2.97Å; N556-L560 PolarHBondContact O-N 3.08Å
557	Q	86.6	Confident	83.2	Confident	104 Å²	104	73.9 Å²	73.9	49%	0.486	39%	0.391	S	S	.	.	H	α-helix	trans	-57.1	-43	-174.9	-173.6	-171.2	-24.3	0	0	112.7	Y553 A554 Q559 L560 D561	Y553-Q557 PolarHBondContact O-N 3.26Å; A554-Q557 WeakPolarHBondContact O-CB 3.37Å; A554-Q557 PolarHBondContact O-N 3.25Å; Q557-Q559 PolarHBondContact O-N 2.91Å; Q557-L560 PolarHBondContact O-N 2.98Å; Q557-L560 VanDerWaalsContact O-N 3.11Å; Q557-D561 PolarHBondContact NE2-OD2 2.68Å; Q557-D561 VanDerWaalsContact NE2-OD2 3.14Å; Q557-D561 WeakPolarHBondContact O-CB 3.42Å; Q557-D561 PolarHBondContact O-N 2.79Å
558	Q	77.8	Confident	81.3	Confident	150 Å²	150	77.9 Å²	77.9	70%	0.701	41%	0.407	S	S	*	.	H	α-helix	trans	-62.6	-28.8	-176.4	-65.1	-172.2	4.7	0	0	113.5	N556 Q562	N556-Q558 VanDerWaalsContact C-N 3.34Å; N556-Q558 PolarHBondContact O-N 2.88Å; Q558-Q562 WeakPolarHBondContact O-CG 3.33Å; Q558-Q562 PolarHBondContact O-N 2.82Å; Q558-Q562 PolarHBondContact O-NE2 3.45Å
559	Q	75.4	Confident	79.4	Confident	37 Å²	37	81.4 Å²	81.4	17%	0.173	42%	0.422	C	S	.	.	H	α-helix	trans	-75.8	-45.9	174.4	-170.4	68.3	5	0	0	110.2	Y428 T432 L435 N556 Q557 D561 Q562 T563	Y428-Q559 PolarHBondContact OH-NE2 3.38Å; Y428-Q559 PolarHBondContact OH-O 3.15Å; T432-Q559 HydrophobicContact CG2-CG 3.97Å; T432-Q559 PolarHBondContact OG1-NE2 3.2Å; L435-Q559 HydrophobicContact CD2-CB 4.35Å; L435-Q559 HydrophobicContact CD2-CG 4.36Å; N556-Q559 PolarHBondContact O-N 2.97Å; Q557-Q559 PolarHBondContact O-N 2.91Å; Q559-D561 VanDerWaalsContact C-N 3.31Å; Q559-D561 PolarHBondContact O-N 2.74Å; Q559-Q562 WeakPolarHBondContact O-CA 3.45Å; Q559-Q562 WeakPolarHBondContact O-CB 3.49Å; Q559-Q562 PolarHBondContact O-N 3.02Å; Q559-T563 PolarHBondContact O-N 3.22Å; Q559-T563 PolarHBondContact O-OG1 3.3Å
560	L	76.4	Confident	77	Confident	99 Å²	99	88.8 Å²	88.8	52%	0.518	45%	0.453	S	S	.	.	H	α-helix	trans	-58.4	-41.5	176.2	-176.6	62.7	0	0	0	112.2	N556 Q557 Q562 T563 L564	N556-L560 PolarHBondContact O-N 3.08Å; Q557-L560 PolarHBondContact O-N 2.98Å; Q557-L560 VanDerWaalsContact O-N 3.11Å; L560-Q562 PolarHBondContact O-N 2.62Å; L560-T563 WeakPolarHBondContact O-CB 3.47Å; L560-T563 PolarHBondContact O-N 3.3Å; L560-L564 HydrophobicContact CD1-CD1 4.3Å; L560-L564 HydrophobicContact CD1-CG 4.29Å; L560-L564 HydrophobicContact CG-CD1 4Å; L560-L564 HydrophobicContact CG-CG 4.42Å; L560-L564 WeakPolarHBondContact O-CB 3.49Å; L560-L564 VanDerWaalsContact O-CG 3.32Å; L560-L564 WeakPolarHBondContact O-CG 3.46Å; L560-L564 PolarHBondContact O-N 3.04Å
561	D	79.9	Confident	74.8	Confident	61 Å²	61	92.7 Å²	92.7	33%	0.326	47%	0.466	S	S	.	.	H	α-helix	trans	-67.4	-17.8	175.7	-77.3	-18	0	0	0	113.3	Q557 Q559 K565	Q557-D561 PolarHBondContact NE2-OD2 2.68Å; Q557-D561 VanDerWaalsContact NE2-OD2 3.14Å; Q557-D561 WeakPolarHBondContact O-CB 3.42Å; Q557-D561 PolarHBondContact O-N 2.79Å; Q559-D561 VanDerWaalsContact C-N 3.31Å; Q559-D561 PolarHBondContact O-N 2.74Å; D561-K565 WeakPolarHBondContact O-CD 3.3Å; D561-K565 WeakPolarHBondContact O-CE 3.38Å; D561-K565 VanDerWaalsContact O-CG 3.24Å; D561-K565 WeakPolarHBondContact O-CG 3.4Å; D561-K565 PolarHBondContact O-NZ 3.27Å
562	Q	74.6	Confident	72.5	Confident	94 Å²	94	96.4 Å²	96.4	44%	0.439	47%	0.471	S	S	.	.	H	α-helix	trans	-84.9	-47.8	170.1	-72.8	169.5	60.2	0	0	110.2	Y428 Q558 Q559 L560 L564 K565 Q566	Y428-Q562 WeakPolarHBondContact OH-CB 3.42Å; Q558-Q562 WeakPolarHBondContact O-CG 3.33Å; Q558-Q562 PolarHBondContact O-N 2.82Å; Q558-Q562 PolarHBondContact O-NE2 3.45Å; Q559-Q562 WeakPolarHBondContact O-CA 3.45Å; Q559-Q562 WeakPolarHBondContact O-CB 3.49Å; Q559-Q562 PolarHBondContact O-N 3.02Å; L560-Q562 PolarHBondContact O-N 2.62Å; Q562-L564 VanDerWaalsContact C-N 3.34Å; Q562-L564 PolarHBondContact O-N 2.97Å; Q562-K565 PolarHBondContact O-N 3.15Å; Q562-K565 VanDerWaalsContact O-N 3.15Å; Q562-Q566 PolarHBondContact O-N 2.86Å
563	T	71.4	Confident	70.2	Confident	23 Å²	23	102.7 Å²	102.7	14%	0.141	50%	0.503	C	S	.	.	H	α-helix	trans	-51.8	-50.1	175.3	-51.9	0	0	0	0	111.8	Y428 Q559 L560 K565 Q566 F567	Y428-T563 HydrophobicContact CE1-CG2 4.32Å; Y428-T563 WeakPolarHBondContact CE1-OG1 3.33Å; Y428-T563 PolarHBondContact OH-N 2.96Å; Y428-T563 PolarHBondContact OH-OG1 2.98Å; Q559-T563 PolarHBondContact O-N 3.22Å; Q559-T563 PolarHBondContact O-OG1 3.3Å; L560-T563 WeakPolarHBondContact O-CB 3.47Å; L560-T563 PolarHBondContact O-N 3.3Å; T563-K565 VanDerWaalsContact C-N 3.29Å; T563-K565 PolarHBondContact O-N 3.45Å; T563-Q566 PolarHBondContact O-N 3.24Å; T563-F567 HydrophobicContact CG2-CD2 3.82Å; T563-F567 HydrophobicContact CG2-CE2 3.55Å; T563-F567 VanDerWaalsContact O-CD2 3.28Å; T563-F567 WeakPolarHBondContact O-CD2 3.25Å; T563-F567 PolarHBondContact O-N 2.88Å
564	L	71	Confident	67.8	Low	47 Å²	47	102.1 Å²	102.1	25%	0.246	52%	0.518	C	S	.	.	H	α-helix	trans	-63.8	-31.4	-177.9	-72.4	171.3	0	0	0	113.3	L560 Q562 I569 L571	L560-L564 HydrophobicContact CD1-CD1 4.3Å; L560-L564 HydrophobicContact CD1-CG 4.29Å; L560-L564 HydrophobicContact CG-CD1 4Å; L560-L564 HydrophobicContact CG-CG 4.42Å; L560-L564 WeakPolarHBondContact O-CB 3.49Å; L560-L564 VanDerWaalsContact O-CG 3.32Å; L560-L564 WeakPolarHBondContact O-CG 3.46Å; L560-L564 PolarHBondContact O-N 3.04Å; Q562-L564 VanDerWaalsContact C-N 3.34Å; Q562-L564 PolarHBondContact O-N 2.97Å; L564-I569 PolarHBondContact O-N 3.45Å; L564-L571 HydrophobicContact CD1-CD1 4Å; L564-L571 HydrophobicContact CD2-CD1 3.8Å; L564-L571 HydrophobicContact CG-CD1 4.46Å
565	K	72.1	Confident	66	Low	145 Å²	145	103 Å²	103	63%	0.63	53%	0.533	S	S	*	.	H	α-helix	trans	-70.1	-38	176.7	-71.1	169	-168.8	131.1	0	111.7	D561 Q562 T563 H568	D561-K565 WeakPolarHBondContact O-CD 3.3Å; D561-K565 WeakPolarHBondContact O-CE 3.38Å; D561-K565 VanDerWaalsContact O-CG 3.24Å; D561-K565 WeakPolarHBondContact O-CG 3.4Å; D561-K565 PolarHBondContact O-NZ 3.27Å; Q562-K565 PolarHBondContact O-N 3.15Å; Q562-K565 VanDerWaalsContact O-N 3.15Å; T563-K565 VanDerWaalsContact C-N 3.29Å; T563-K565 PolarHBondContact O-N 3.45Å; K565-H568 PolarHBondContact O-N 3.47Å
566	Q	66.1	Low	64.4	Low	114 Å²	114	103.3 Å²	103.3	53%	0.533	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-44.9	176.1	-68.7	174.5	-29.7	0	0	111.5	Q562 T563 H568	Q562-Q566 PolarHBondContact O-N 2.86Å; T563-Q566 PolarHBondContact O-N 3.24Å; Q566-H568 PolarHBondContact O-N 3.29Å; Q566-H568 VanDerWaalsContact O-N 3.07Å; Q566-H568 PolarHBondContact O-ND1 3.4Å
567	F	61.5	Low	62.5	Low	127 Å²	127	107.9 Å²	107.9	56%	0.557	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-2.4	179	-74.5	-65.6	0	0	0	115	T563 I569	T563-F567 HydrophobicContact CG2-CD2 3.82Å; T563-F567 HydrophobicContact CG2-CE2 3.55Å; T563-F567 VanDerWaalsContact O-CD2 3.28Å; T563-F567 WeakPolarHBondContact O-CD2 3.25Å; T563-F567 PolarHBondContact O-N 2.88Å; F567-I569 HydrophobicContact CB-CD1 3.7Å; F567-I569 HydrophobicContact CB-CG1 3.78Å; F567-I569 HydrophobicContact CG-CD1 4.34Å; F567-I569 PolarHBondContact O-N 3.04Å
568	H	56.8	Low	60.7	Low	171 Å²	171	108.6 Å²	108.6	79%	0.792	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.9	17.7	-175.3	-68.7	69.3	0	0	0	114.4	K565 Q566 K570	K565-H568 PolarHBondContact O-N 3.47Å; Q566-H568 PolarHBondContact O-N 3.29Å; Q566-H568 VanDerWaalsContact O-N 3.07Å; Q566-H568 PolarHBondContact O-ND1 3.4Å; H568-K570 PolarHBondContact O-N 3.04Å
569	I	55.3	Low	59.4	Low	94 Å²	94	107.2 Å²	107.2	48%	0.482	58%	0.576	S	S	.	*			trans	-75.3	94	-179.6	-59.5	168.1	0	0	0	108.3	L564 F567 L571	L564-I569 PolarHBondContact O-N 3.45Å; F567-I569 HydrophobicContact CB-CD1 3.7Å; F567-I569 HydrophobicContact CB-CG1 3.78Å; F567-I569 HydrophobicContact CG-CD1 4.34Å; F567-I569 PolarHBondContact O-N 3.04Å; I569-L571 VanDerWaalsContact C-N 3.32Å; I569-L571 HydrophobicContact CG2-CD1 3.82Å; I569-L571 HydrophobicContact CG2-CG 4.38Å; I569-L571 PolarHBondContact O-N 2.75Å
570	K	46.4	Very low	58.3	Low	199 Å²	199	108.4 Å²	108.4	87%	0.865	59%	0.588	S	S	*	*			trans	-64.3	96.2	158.4	-71.6	-172.9	176.2	-174.3	0	108	H568 K572	H568-K570 PolarHBondContact O-N 3.04Å; K570-K572 VanDerWaalsContact C-N 3.27Å; K570-K572 PolarHBondContact O-N 3.43Å
571	L	50.1	Low	57.2	Low	125 Å²	125	112.6 Å²	112.6	65%	0.654	60%	0.597	S	S	*	*			trans	-62.7	94.7	163.6	-88.8	95.3	0	0	0	108.4	L564 I569 M573	L564-L571 HydrophobicContact CD1-CD1 4Å; L564-L571 HydrophobicContact CD2-CD1 3.8Å; L564-L571 HydrophobicContact CG-CD1 4.46Å; I569-L571 VanDerWaalsContact C-N 3.32Å; I569-L571 HydrophobicContact CG2-CD1 3.82Å; I569-L571 HydrophobicContact CG2-CG 4.38Å; I569-L571 PolarHBondContact O-N 2.75Å; L571-M573 PolarHBondContact O-N 3.14Å
572	K	43.9	Very low	55.9	Low	142 Å²	142	116.5 Å²	116.5	62%	0.617	62%	0.617	S	S	*	*			trans	-69.8	107	170.4	-134.5	-174.3	-178	-159.9	0	107.2	K570 D577	K570-K572 VanDerWaalsContact C-N 3.27Å; K570-K572 PolarHBondContact O-N 3.43Å; K572-D577 VanDerWaalsContact CE-CB 3.46Å; K572-D577 WeakPolarHBondContact CE-OD2 3.37Å; K572-D577 IonicContact NZ-OD2 2.68Å
573	M	47	Very low	55	Low	151 Å²	151	119.9 Å²	119.9	74%	0.744	63%	0.633	S	S	*	*			trans	-62.5	134.9	173.9	-64	-152	-54.5	0	0	109.2	L571 G575 G576	L571-M573 PolarHBondContact O-N 3.14Å; M573-G575 PolarHBondContact O-N 3.02Å; M573-G575 VanDerWaalsContact O-N 3.09Å; M573-G576 PolarHBondContact O-N 3.17Å
574	P	43.1	Very low	53.8	Low	140 Å²	140	126.2 Å²	126.2	91%	0.909	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	116.4	174.7	-22.9	33.8	0	0	0	110.2
575	G	54.7	Low	52.4	Low	77 Å²	77	134.8 Å²	134.8	79%	0.794	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	103.5	-0.3	-179.9	0	0	0	0	0	117	M573	M573-G575 PolarHBondContact O-N 3.02Å; M573-G575 VanDerWaalsContact O-N 3.09Å
576	G	53.3	Low	51.5	Low	54 Å²	54	134.3 Å²	134.3	56%	0.557	70%	0.703	S	S	*	*	S	Bend	trans	-78.4	-42.6	-176.3	0	0	0	0	0	116.6	M573	M573-G576 PolarHBondContact O-N 3.17Å
577	D	50.3	Low	50.7	Low	111 Å²	111	135.4 Å²	135.4	59%	0.594	71%	0.712	S	S	*	*	S	Bend	trans	-122.5	63.3	-163.5	-62.8	-25.7	0	0	0	113.1	K572	K572-D577 VanDerWaalsContact CE-CB 3.46Å; K572-D577 WeakPolarHBondContact CE-OD2 3.37Å; K572-D577 IonicContact NZ-OD2 2.68Å
578	T	48.3	Very low	50.1	Low	120 Å²	120	135.8 Å²	135.8	74%	0.736	72%	0.721	S	S	*	*			trans	-135.2	113.5	157.4	46.5	0	0	0	0	108	S580	T578-S580 PolarHBondContact O-N 3.26Å
579	P	50.5	Low	49.7	Very low	121 Å²	121	133.8 Å²	133.8	79%	0.786	72%	0.716	S	S	*	*			trans	-60.2	139.9	170	27.7	-33.5	0	0	0	108.6	W581	P579-W581 PolarHBondContact O-N 2.57Å
580	S	51.7	Low	49.4	Very low	62 Å²	62	136.3 Å²	136.3	43%	0.434	73%	0.731	S	S	.	*			trans	-70.4	126.4	179.1	-175.3	0	0	0	0	109	T578 L582 E583	T578-S580 PolarHBondContact O-N 3.26Å; S580-L582 PolarHBondContact O-N 3.37Å; S580-L582 VanDerWaalsContact O-N 3.07Å; S580-L582 PolarHBondContact OG-N 3.27Å; S580-E583 PolarHBondContact O-N 3.17Å
581	W	53.7	Low	49.5	Very low	187 Å²	187	132.1 Å²	132.1	71%	0.708	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-60.3	-18.8	175.6	174.5	71.5	0	0	0	112.7	P579 E583	P579-W581 PolarHBondContact O-N 2.57Å; W581-E583 PolarHBondContact O-N 3.18Å
582	L	52.5	Low	49.5	Very low	143 Å²	143	132.6 Å²	132.6	75%	0.749	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-72.9	-1.9	170.9	-82.9	98.7	0	0	0	115	S580	S580-L582 PolarHBondContact O-N 3.37Å; S580-L582 VanDerWaalsContact O-N 3.07Å; S580-L582 PolarHBondContact OG-N 3.27Å
583	E	55.8	Low	49.9	Very low	165 Å²	165	131.8 Å²	131.8	77%	0.771	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-94.1	1	175.3	-67.5	-174.2	139.1	0	0	113.9	S580 W581	S580-E583 PolarHBondContact O-N 3.17Å; W581-E583 PolarHBondContact O-N 3.18Å
584	E	46.3	Very low	50.2	Low	156 Å²	156	130.3 Å²	130.3	73%	0.729	74%	0.735	S	S	*	*			trans	-113.8	8.1	-173.3	-149.2	170.4	-156.3	0	0	115.6
585	H	42.3	Very low	50.8	Low	227 Å²	227	129.4 Å²	129.4	100%	1.051	72%	0.719	S	S	*	*			trans	-137.7	0	177.3	-78.9	-18.7	0	0	0	114.3

Retrieved 585 of 585 residues in 932.3 ms (Link to these results)

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