A0A087YEB8_POEFO Loading...

Rho GTPase activating protein 6

AlphaFold DB , UniProt , Accession A0A087YEB8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 751 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	35.6	Very low	37.9	Very low	244 Å²	244	130.4 Å²	130.4	100%	1.202	69%	0.694	S	S	*	*				0	128.7	0	-69.4	148.6	176.3	0	0	106.1
2	G	31.3	Very low	39.7	Very low	75 Å²	75	123.7 Å²	123.7	77%	0.773	67%	0.666	S	S	*	*			trans	-130.8	115.2	174	0	0	0	0	0	106.5	S4	G2-S4 PolarHBondContact O-N 2.96Å
3	D	29.9	Very low	41.6	Very low	147 Å²	147	121.2 Å²	121.2	79%	0.786	64%	0.642	S	S	*	*			trans	-77.4	118.3	-169.8	-64.7	-44.7	0	0	0	110.4	V5	D3-V5 PolarHBondContact O-N 3.06Å
4	S	31.2	Very low	42.9	Very low	98 Å²	98	120.1 Å²	120.1	69%	0.685	64%	0.636	S	S	*	*			trans	-74.9	74.6	179.8	175.6	0	0	0	0	110.4	G2 F6	G2-S4 PolarHBondContact O-N 2.96Å; S4-F6 PolarHBondContact O-N 2.85Å
5	V	36	Very low	44.3	Very low	119 Å²	119	113.7 Å²	113.7	72%	0.721	61%	0.61	S	S	*	*			trans	-75.7	61.2	167.2	-167	0	0	0	0	109.5	D3 L7	D3-V5 PolarHBondContact O-N 3.06Å; V5-L7 HydrophobicContact CG1-CG 4.37Å; V5-L7 PolarHBondContact O-N 2.95Å
6	F	31.7	Very low	46.3	Very low	190 Å²	190	114.1 Å²	114.1	83%	0.833	61%	0.612	S	S	*	*			trans	-69.6	91.2	155.7	-98.7	-88.4	0	0	0	106.7	S4 D8	S4-F6 PolarHBondContact O-N 2.85Å; F6-D8 PolarHBondContact O-N 2.88Å
7	L	35.7	Very low	48.6	Very low	125 Å²	125	112.1 Å²	112.1	65%	0.654	60%	0.597	S	S	*	*			trans	-65.6	99.5	168.2	-112.1	163.4	0	0	0	107.3	V5 R9	V5-L7 HydrophobicContact CG1-CG 4.37Å; V5-L7 PolarHBondContact O-N 2.95Å; L7-R9 HydrophobicContact CD2-CG 4.46Å; L7-R9 PolarHBondContact O-N 2.92Å
8	D	37.4	Very low	50.7	Low	126 Å²	126	106.7 Å²	106.7	67%	0.674	57%	0.568	S	S	*	*			trans	-72	67.7	-179.9	-162.3	10.7	0	0	0	110.5	F6 Q10	F6-D8 PolarHBondContact O-N 2.88Å; D8-Q10 PolarHBondContact O-N 3.25Å; D8-Q10 WeakPolarHBondContact OD1-CG 3.34Å; D8-Q10 PolarHBondContact OD1-NE2 3.32Å; D8-Q10 PolarHBondContact OD2-NE2 3.46Å
9	R	42	Very low	52.6	Low	155 Å²	155	101.1 Å²	101.1	59%	0.585	54%	0.539	S	S	*	.			trans	-77.1	77.5	174.7	-76.3	-164.9	177.5	-167.1	4.6	109.2	L7 L22	L7-R9 HydrophobicContact CD2-CG 4.46Å; L7-R9 PolarHBondContact O-N 2.92Å; R9-L22 HydrophobicContact CB-CD2 4.46Å; R9-L22 PolarHBondContact NH1-O 3.18Å; R9-L22 VanDerWaalsContact O-CD2 3.28Å; R9-L22 WeakPolarHBondContact O-CD2 3.45Å
10	Q	52.8	Low	54.1	Low	136 Å²	136	97 Å²	97	64%	0.636	52%	0.518	S	S	*	.			trans	-91.1	157	158.3	-63.3	175.8	39.4	0	0	109.1	D8 S12	D8-Q10 PolarHBondContact O-N 3.25Å; D8-Q10 WeakPolarHBondContact OD1-CG 3.34Å; D8-Q10 PolarHBondContact OD1-NE2 3.32Å; D8-Q10 PolarHBondContact OD2-NE2 3.46Å; Q10-S12 PolarHBondContact O-N 3.48Å
11	H	53.5	Low	55.4	Low	19 Å²	19	92.5 Å²	92.5	9%	0.088	49%	0.494	C	S	.	.			trans	-64.5	112.8	167.8	-60.3	84.2	0	0	0	109.4	W19 L442 P446 D450	H11-W19 HydrophobicContact CB-CE3 4.47Å; H11-W19 HydrophobicContact CB-CZ3 4.35Å; H11-L442 HydrophobicContact CB-CD1 3.86Å; H11-L442 HydrophobicContact CB-CD2 4.46Å; H11-L442 WeakPolarHBondContact ND1-CD1 3.38Å; H11-P446 PolarHBondContact CE1-O 3.4Å; H11-D450 WeakPolarHBondContact NE2-CA 3.46Å; H11-D450 VanDerWaalsContact NE2-CB 3.27Å; H11-D450 WeakPolarHBondContact NE2-CB 3.48Å; H11-D450 PolarHBondContact NE2-N 3.39Å; H11-D450 IonicContact NE2-OD1 2.69Å
12	S	59.6	Low	57.4	Low	50 Å²	50	83.1 Å²	83.1	35%	0.35	45%	0.449	S	S	.	.			trans	-91	120.3	173.5	60.4	0	0	0	0	110.7	Q10 L14 S20	Q10-S12 PolarHBondContact O-N 3.48Å; S12-L14 WeakPolarHBondContact OG-CD2 3.49Å; S12-S20 PolarHBondContact N-OG 3.45Å; S12-S20 PolarHBondContact O-N 3.31Å; S12-S20 PolarHBondContact O-OG 3.3Å; S12-S20 PolarHBondContact OG-OG 3.13Å
13	Y	64.4	Low	59.3	Low	92 Å²	92	82 Å²	82	36%	0.361	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-71.5	120.2	156.5	178.3	-112.5	0	0	0	108.2	F17 W19 N435 M439	Y13-F17 PolarHBondContact OH-N 3.29Å; Y13-W19 AromaticContact CD2-CD1 3.95Å; Y13-W19 HydrophobicContact CD2-CD2 4.48Å; Y13-W19 AromaticContact CD2-CE2 3.99Å; Y13-W19 HydrophobicContact CD2-CG 4.48Å; Y13-W19 AromaticContact CD2-NE1 3.59Å; Y13-N435 VanDerWaalsContact CD2-OD1 3.31Å; Y13-N435 WeakPolarHBondContact CD2-OD1 3.32Å; Y13-N435 WeakPolarHBondContact CE2-OD1 3.44Å; Y13-M439 HydrophobicContact CD1-CE 4.1Å; Y13-M439 HydrophobicContact CD2-CE 4.14Å; Y13-M439 HydrophobicContact CG-CE 3.68Å
14	L	59.6	Low	61.4	Low	105 Å²	105	78.1 Å²	78.1	55%	0.55	42%	0.424	S	S	.	.			trans	-96.7	4.2	-170.9	-64.7	174.3	0	0	0	113.4	S12 T18	S12-L14 WeakPolarHBondContact OG-CD2 3.49Å; L14-T18 HydrophobicContact CB-CG2 4.49Å; L14-T18 HydrophobicContact CD1-CG2 4.33Å; L14-T18 PolarHBondContact N-O 3.21Å
15	G	63.1	Low	63.8	Low	24 Å²	24	80.5 Å²	80.5	25%	0.247	42%	0.418	C	S	.	.	S	Bend	trans	85.6	177.3	-165.7	0	0	0	0	0	112.3	F17 T18	G15-F17 PolarHBondContact O-N 3.18Å; G15-T18 WeakPolarHBondContact O-CA 3.38Å; G15-T18 VanDerWaalsContact O-CB 3.29Å; G15-T18 WeakPolarHBondContact O-CB 3.39Å; G15-T18 PolarHBondContact O-N 2.97Å
16	D	77	Confident	66	Low	121 Å²	121	78.5 Å²	78.5	65%	0.647	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.5	43.1	177.3	-58.5	-6.6	0	0	0	115.2	T18 R28	D16-T18 PolarHBondContact O-N 2.92Å; D16-T18 VanDerWaalsContact O-N 3.15Å; D16-T18 PolarHBondContact O-OG1 3.14Å; D16-R28 PolarHBondContact O-NH1 3.47Å
17	F	84.9	Confident	68.7	Low	80 Å²	80	69.8 Å²	69.8	35%	0.351	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	32.6	-176.2	-51.7	-63.9	0	0	0	114	Y13 G15 L29 P431 D432 N435	Y13-F17 PolarHBondContact OH-N 3.29Å; G15-F17 PolarHBondContact O-N 3.18Å; F17-L29 HydrophobicContact CB-CB 4.14Å; F17-L29 HydrophobicContact CB-CD1 4.46Å; F17-L29 WeakPolarHBondContact O-CB 3.32Å; F17-L29 WeakPolarHBondContact O-CG 3.37Å; F17-L29 PolarHBondContact O-N 3.44Å; F17-P431 HydrophobicContact CB-CB 3.79Å; F17-P431 HydrophobicContact CD1-CB 4.12Å; F17-P431 HydrophobicContact CD2-CB 3.72Å; F17-P431 HydrophobicContact CE2-CB 4.32Å; F17-P431 HydrophobicContact CG-CB 3.59Å; F17-D432 HydrophobicContact CE1-CB 3.75Å; F17-D432 HydrophobicContact CZ-CB 3.9Å; F17-N435 HydrophobicContact CD1-CB 4.06Å
18	T	86.4	Confident	71.2	Confident	14 Å²	14	71.1 Å²	71.1	9%	0.086	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.5	-176.2	-54.8	0	0	0	0	110.7	L14 G15 D16 S26 V27 R28	L14-T18 HydrophobicContact CB-CG2 4.49Å; L14-T18 HydrophobicContact CD1-CG2 4.33Å; L14-T18 PolarHBondContact N-O 3.21Å; G15-T18 WeakPolarHBondContact O-CA 3.38Å; G15-T18 VanDerWaalsContact O-CB 3.29Å; G15-T18 WeakPolarHBondContact O-CB 3.39Å; G15-T18 PolarHBondContact O-N 2.97Å; D16-T18 PolarHBondContact O-N 2.92Å; D16-T18 VanDerWaalsContact O-N 3.15Å; D16-T18 PolarHBondContact O-OG1 3.14Å; T18-S26 WeakPolarHBondContact CG2-OG 3.35Å; T18-V27 CarbonylContact C-O 3.59Å; T18-V27 WeakPolarHBondContact CA-O 3.4Å; T18-R28 PolarHBondContact OG1-NH1 3.38Å
19	W	87.4	Confident	73.7	Confident	1 Å²	1	65.6 Å²	65.6	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.5	-172.4	-79.4	74.5	0	0	0	111.6	H11 Y13 S26 V27 N435 L438 M439 L442 V449 L453	H11-W19 HydrophobicContact CB-CE3 4.47Å; H11-W19 HydrophobicContact CB-CZ3 4.35Å; Y13-W19 AromaticContact CD2-CD1 3.95Å; Y13-W19 HydrophobicContact CD2-CD2 4.48Å; Y13-W19 AromaticContact CD2-CE2 3.99Å; Y13-W19 HydrophobicContact CD2-CG 4.48Å; Y13-W19 AromaticContact CD2-NE1 3.59Å; W19-S26 CarbonylContact O-C 3.54Å; W19-S26 WeakPolarHBondContact O-CA 3.27Å; W19-V27 PolarHBondContact N-O 3.16Å; W19-V27 PolarHBondContact O-N 3.12Å; W19-N435 PolarHBondContact NE1-OD1 3.33Å; W19-L438 HydrophobicContact CD2-CD1 4.29Å; W19-L438 HydrophobicContact CG-CD1 4.49Å; W19-L438 HydrophobicContact CH2-CB 3.73Å; W19-L438 HydrophobicContact CZ2-CB 3.5Å; W19-L438 HydrophobicContact CZ2-CD1 4.42Å; W19-L438 HydrophobicContact CZ3-CB 4.39Å; W19-M439 HydrophobicContact CH2-CE 3.95Å; W19-M439 HydrophobicContact CH2-CG 4.13Å; W19-M439 HydrophobicContact CH2-SD 3.64Å; W19-M439 HydrophobicContact CZ2-CE 3.71Å; W19-M439 HydrophobicContact CZ2-CG 4Å; W19-M439 HydrophobicContact CZ2-SD 3.88Å; W19-L442 HydrophobicContact CH2-CD2 4.39Å; W19-L442 HydrophobicContact CZ3-CD2 4.2Å; W19-V449 HydrophobicContact CE3-CG1 4.39Å; W19-V449 HydrophobicContact CZ3-CG1 4.04Å; W19-L453 HydrophobicContact CB-CD1 4.06Å; W19-L453 HydrophobicContact CB-CD2 3.62Å; W19-L453 HydrophobicContact CD2-CD1 4.49Å; W19-L453 HydrophobicContact CE3-CD1 3.97Å; W19-L453 HydrophobicContact CG-CD2 4.11Å
20	S	83	Confident	76	Confident	18 Å²	18	62.3 Å²	62.3	13%	0.126	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.6	165.8	68.8	0	0	0	0	112.1	S12	S12-S20 PolarHBondContact N-OG 3.45Å; S12-S20 PolarHBondContact O-N 3.31Å; S12-S20 PolarHBondContact O-OG 3.3Å; S12-S20 PolarHBondContact OG-OG 3.13Å
21	S	81.8	Confident	77.9	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.021	33%	0.328	C	S	.	.			trans	-79.6	153.8	161.6	161.9	0	0	0	0	109.7	S23 G24 R25 D450	S21-S23 WeakPolarHBondContact CB-OG 3.48Å; S21-S23 PolarHBondContact O-N 3.16Å; S21-S23 WeakPolarHBondContact OG-CB 3.44Å; S21-S23 PolarHBondContact OG-N 3.28Å; S21-S23 VanDerWaalsContact OG-N 3.11Å; S21-S23 PolarHBondContact OG-OG 3.01Å; S21-G24 PolarHBondContact O-N 3.01Å; S21-R25 PolarHBondContact N-O 2.95Å; S21-D450 WeakPolarHBondContact CA-OD1 3.44Å; S21-D450 VanDerWaalsContact CB-OD1 3.29Å; S21-D450 WeakPolarHBondContact CB-OD1 3.5Å; S21-D450 PolarHBondContact OG-OD1 2.67Å
22	L	77.2	Confident	79.7	Confident	47 Å²	47	59.9 Å²	59.9	25%	0.246	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.1	171.6	-51.6	-178.6	0	0	0	112.8	R9 G24 D450	R9-L22 HydrophobicContact CB-CD2 4.46Å; R9-L22 PolarHBondContact NH1-O 3.18Å; R9-L22 VanDerWaalsContact O-CD2 3.28Å; R9-L22 WeakPolarHBondContact O-CD2 3.45Å; L22-G24 VanDerWaalsContact C-N 3.25Å; L22-G24 PolarHBondContact O-N 3.44Å; L22-D450 WeakPolarHBondContact CB-OD2 3.04Å; L22-D450 HydrophobicContact CD1-CB 4.17Å; L22-D450 HydrophobicContact CG-CB 4.19Å; L22-D450 PolarHBondContact N-OD1 3.49Å
23	S	71.6	Confident	81.3	Confident	53 Å²	53	59.1 Å²	59.1	37%	0.371	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-5.2	169.9	65.8	0	0	0	0	114.7	S21 R25	S21-S23 WeakPolarHBondContact CB-OG 3.48Å; S21-S23 PolarHBondContact O-N 3.16Å; S21-S23 WeakPolarHBondContact OG-CB 3.44Å; S21-S23 PolarHBondContact OG-N 3.28Å; S21-S23 VanDerWaalsContact OG-N 3.11Å; S21-S23 PolarHBondContact OG-OG 3.01Å; S23-R25 VanDerWaalsContact C-N 3.3Å
24	G	73	Confident	82.6	Confident	65 Å²	65	54.9 Å²	54.9	67%	0.67	31%	0.313	S	S	*	.	S	Bend	trans	81.6	2	-175.3	0	0	0	0	0	114.6	S21 L22	S21-G24 PolarHBondContact O-N 3.01Å; L22-G24 VanDerWaalsContact C-N 3.25Å; L22-G24 PolarHBondContact O-N 3.44Å
25	R	80.6	Confident	84	Confident	148 Å²	148	50.8 Å²	50.8	56%	0.558	29%	0.291	S	S	*	.			trans	-79.6	131.1	174.9	-64.8	-176.3	-178.8	-170.3	0.2	110.6	S21 S23	S21-R25 PolarHBondContact N-O 2.95Å; S23-R25 VanDerWaalsContact C-N 3.3Å
26	S	83.9	Confident	85.2	Confident	76 Å²	76	52.1 Å²	52.1	53%	0.531	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	142.1	170.8	-170.5	0	0	0	0	110.7	T18 W19	T18-S26 WeakPolarHBondContact CG2-OG 3.35Å; W19-S26 CarbonylContact O-C 3.54Å; W19-S26 WeakPolarHBondContact O-CA 3.27Å
27	V	87.1	Confident	85.9	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.048	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	115.3	-179.9	-176.4	0	0	0	0	108.7	T18 W19 L453 K456 A457	T18-V27 CarbonylContact C-O 3.59Å; T18-V27 WeakPolarHBondContact CA-O 3.4Å; W19-V27 PolarHBondContact N-O 3.16Å; W19-V27 PolarHBondContact O-N 3.12Å; V27-L453 HydrophobicContact CB-CD2 4.26Å; V27-L453 HydrophobicContact CG2-CD2 4.5Å; V27-K456 HydrophobicContact CG1-CB 4.03Å; V27-A457 HydrophobicContact CG2-CB 3.69Å
28	R	88.6	Confident	86.1	Confident	152 Å²	152	42.8 Å²	42.8	57%	0.574	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	126	169	-174.8	178.5	-67.4	-84.8	7.3	109.2	D16 T18 T30	D16-R28 PolarHBondContact O-NH1 3.47Å; T18-R28 PolarHBondContact OG1-NH1 3.38Å; R28-T30 PolarHBondContact O-N 2.94Å
29	L	90.1	Very high	86.2	Confident	10 Å²	10	45.8 Å²	45.8	5%	0.052	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-73.6	122.7	175.3	-58	172.4	0	0	0	109.6	F17 P431 Q434 N435 L438 K456	F17-L29 HydrophobicContact CB-CB 4.14Å; F17-L29 HydrophobicContact CB-CD1 4.46Å; F17-L29 WeakPolarHBondContact O-CB 3.32Å; F17-L29 WeakPolarHBondContact O-CG 3.37Å; F17-L29 PolarHBondContact O-N 3.44Å; L29-P431 HydrophobicContact CB-CB 4.08Å; L29-Q434 HydrophobicContact CD1-CB 4.14Å; L29-N435 HydrophobicContact CD1-CB 4.05Å; L29-L438 HydrophobicContact CD1-CD1 4.13Å; L29-L438 HydrophobicContact CD2-CD1 3.93Å; L29-K456 HydrophobicContact CD2-CD 4.27Å
30	T	90.3	Very high	86.3	Confident	86 Å²	86	47 Å²	47	53%	0.528	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-103.6	166	169.1	53.6	0	0	0	0	109.6	R28 V32 Q434	R28-T30 PolarHBondContact O-N 2.94Å; T30-V32 WeakPolarHBondContact O-CG2 3.48Å; T30-V32 PolarHBondContact O-N 2.88Å; T30-Q434 PolarHBondContact O-NE2 2.91Å
31	P	91.9	Very high	86.7	Confident	75 Å²	75	46.2 Å²	46.2	49%	0.487	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-58.6	130.3	170.5	-23	34	0	0	0	111.2	M428 V429 P431	P31-M428 HydrophobicContact CB-CE 4.02Å; P31-M428 VanDerWaalsContact O-CE 3.29Å; P31-M428 WeakPolarHBondContact O-CE 3.49Å; P31-V429 WeakPolarHBondContact CA-O 3.39Å; P31-P431 HydrophobicContact CG-CG 4.46Å
32	V	92.3	Very high	87.3	Confident	30 Å²	30	46.9 Å²	46.9	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.9	-171.4	165.4	0	0	0	0	111.1	T30 V34 S36 L37 V429	T30-V32 WeakPolarHBondContact O-CG2 3.48Å; T30-V32 PolarHBondContact O-N 2.88Å; V32-V34 PolarHBondContact O-N 3.42Å; V32-S36 WeakPolarHBondContact CG1-OG 3.29Å; V32-L37 HydrophobicContact CG1-CD2 3.94Å; V32-V429 PolarHBondContact N-O 3.31Å; V32-V429 PolarHBondContact O-N 3.01Å
33	A	92.4	Very high	87.9	Confident	33 Å²	33	46 Å²	46	27%	0.273	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.6	-180	0	0	0	0	0	111.9	Q35 S36 F427 M428	A33-Q35 PolarHBondContact O-N 3.41Å; A33-S36 PolarHBondContact O-N 3.49Å; A33-S36 PolarHBondContact O-OG 3Å; A33-F427 WeakPolarHBondContact CA-O 3.35Å; A33-M428 HydrophobicContact CB-SD 3.75Å
34	V	91.9	Very high	88.9	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.018	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-50.3	-32.8	-178.1	167.3	0	0	0	0	113.2	V32 S36 L37 R42 Y334 F427 V429	V32-V34 PolarHBondContact O-N 3.42Å; V34-S36 VanDerWaalsContact C-N 3.31Å; V34-S36 PolarHBondContact O-N 2.9Å; V34-L37 WeakPolarHBondContact O-CB 3.34Å; V34-L37 PolarHBondContact O-N 3.05Å; V34-R42 WeakPolarHBondContact O-CD 3.39Å; V34-Y334 HydrophobicContact CG2-CD1 3.83Å; V34-Y334 HydrophobicContact CG2-CE1 3.45Å; V34-Y334 VanDerWaalsContact CG2-CE1 3.45Å; V34-F427 WeakPolarHBondContact CG2-O 3.43Å; V34-F427 PolarHBondContact N-O 3.23Å; V34-V429 HydrophobicContact CB-CG2 4.43Å; V34-V429 HydrophobicContact CG2-CG2 3.41Å; V34-V429 VanDerWaalsContact CG2-CG2 3.41Å
35	Q	89.1	Confident	90	Very high	20 Å²	20	42.7 Å²	42.7	9%	0.093	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-76.6	-14.1	-178.1	-59.8	77.3	28.1	0	0	114	A33 R233 D342 H345	A33-Q35 PolarHBondContact O-N 3.41Å; Q35-R233 HydrophobicContact CB-CG 4.38Å; Q35-R233 HydrophobicContact CG-CG 4.24Å; Q35-D342 WeakPolarHBondContact CG-OD1 3.13Å; Q35-H345 VanDerWaalsContact CD-ND1 3.25Å; Q35-H345 PolarHBondContact NE2-ND1 3.05Å; Q35-H345 PolarHBondContact OE1-CE1 2.92Å; Q35-H345 PolarHBondContact OE1-ND1 3.49Å; Q35-H345 VanDerWaalsContact OE1-ND1 3.1Å
36	S	89.4	Confident	90.6	Very high	51 Å²	51	37.8 Å²	37.8	36%	0.357	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-88.2	-10.5	174.6	69.2	0	0	0	0	113.4	V32 A33 V34	V32-S36 WeakPolarHBondContact CG1-OG 3.29Å; A33-S36 PolarHBondContact O-N 3.49Å; A33-S36 PolarHBondContact O-OG 3Å; V34-S36 VanDerWaalsContact C-N 3.31Å; V34-S36 PolarHBondContact O-N 2.9Å
37	L	90.3	Very high	91.1	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.031	20%	0.203	C	C	.	.	S	Bend	trans	-74.3	146.6	174.4	-61.6	-175.6	0	0	0	111	V32 V34 E41 R42 L45 V429	V32-L37 HydrophobicContact CG1-CD2 3.94Å; V34-L37 WeakPolarHBondContact O-CB 3.34Å; V34-L37 PolarHBondContact O-N 3.05Å; L37-E41 HydrophobicContact CB-CB 3.84Å; L37-E41 HydrophobicContact CD1-CB 4.43Å; L37-E41 HydrophobicContact CD2-CB 4.27Å; L37-E41 WeakPolarHBondContact CD2-OE1 3.18Å; L37-E41 HydrophobicContact CG-CB 4.41Å; L37-R42 HydrophobicContact CB-CG 3.71Å; L37-R42 HydrophobicContact CD1-CG 4.41Å; L37-L45 HydrophobicContact CD1-CD2 4.02Å; L37-V429 HydrophobicContact CD1-CG2 3.88Å
38	S	90.1	Very high	91.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-67.4	165	171.2	60.9	0	0	0	0	112.7	L40 E41 R42 S227 L228 N229	S38-L40 PolarHBondContact O-N 3.46Å; S38-E41 VanDerWaalsContact CB-OE2 3.25Å; S38-E41 WeakPolarHBondContact CB-OE2 3.46Å; S38-E41 PolarHBondContact N-OE2 2.79Å; S38-E41 PolarHBondContact O-N 2.79Å; S38-E41 WeakPolarHBondContact OG-CB 3.31Å; S38-E41 VanDerWaalsContact OG-CG 3.31Å; S38-E41 WeakPolarHBondContact OG-CG 3.47Å; S38-E41 PolarHBondContact OG-N 3.28Å; S38-E41 PolarHBondContact OG-OE2 3.17Å; S38-R42 WeakPolarHBondContact O-CG 3.45Å; S38-R42 PolarHBondContact O-N 3.01Å; S38-S227 WeakPolarHBondContact CB-O 3.35Å; S38-L228 WeakPolarHBondContact CB-O 3.13Å; S38-N229 WeakPolarHBondContact CA-O 3.32Å
39	E	88.5	Confident	91.7	Very high	77 Å²	77	31.6 Å²	31.6	36%	0.36	18%	0.178	S	C	.	.	H	α-helix	trans	-59.8	-36.2	177.1	-169.1	-179.3	-166.5	0	0	111.9	A43 L226 S227 I231	E39-A43 WeakPolarHBondContact O-CB 3.23Å; E39-A43 PolarHBondContact O-N 3.19Å; E39-L226 HydrophobicContact CB-CB 4.22Å; E39-L226 HydrophobicContact CG-CB 4.07Å; E39-L226 HydrophobicContact CG-CD2 4.12Å; E39-L226 HydrophobicContact CG-CG 4.49Å; E39-S227 WeakPolarHBondContact CB-O 3.34Å; E39-S227 VanDerWaalsContact CB-OG 3.3Å; E39-S227 WeakPolarHBondContact CB-OG 3.48Å; E39-S227 PolarHBondContact N-O 2.85Å; E39-S227 VanDerWaalsContact N-O 3.13Å; E39-S227 WeakPolarHBondContact OE2-CB 3.03Å; E39-S227 PolarHBondContact OE2-N 2.69Å; E39-S227 PolarHBondContact OE2-OG 2.82Å; E39-I231 HydrophobicContact CB-CD1 3.99Å; E39-I231 HydrophobicContact CB-CG1 4.09Å; E39-I231 HydrophobicContact CG-CD1 4.17Å
40	L	89.4	Confident	91.9	Very high	25 Å²	25	34.5 Å²	34.5	13%	0.131	19%	0.189	C	C	.	.	H	α-helix	trans	-70.9	-44.6	174	-176.7	61.1	0	0	0	113	S38 R42 A43 R44 L226 L228 L441 V448	S38-L40 PolarHBondContact O-N 3.46Å; L40-R42 VanDerWaalsContact C-N 3.28Å; L40-R42 PolarHBondContact O-N 3.08Å; L40-A43 PolarHBondContact O-N 2.99Å; L40-R44 HydrophobicContact CD1-CG 4.49Å; L40-R44 PolarHBondContact O-N 2.85Å; L40-L226 HydrophobicContact CB-CB 4.09Å; L40-L226 HydrophobicContact CD1-CD1 4.07Å; L40-L228 HydrophobicContact CB-CD2 4.17Å; L40-L228 HydrophobicContact CD2-CD2 3.58Å; L40-L441 HydrophobicContact CD1-CD2 4.21Å; L40-L441 HydrophobicContact CD2-CD2 3.84Å; L40-L441 HydrophobicContact CG-CD2 3.9Å; L40-V448 HydrophobicContact CD2-CG1 3.77Å
41	E	92.2	Very high	92.1	Very high	3 Å²	3	33.3 Å²	33.3	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-40.7	174.1	-79.4	164.4	112.1	0	0	111.1	L37 S38 L45 L452 R455 K456	L37-E41 HydrophobicContact CB-CB 3.84Å; L37-E41 HydrophobicContact CD1-CB 4.43Å; L37-E41 HydrophobicContact CD2-CB 4.27Å; L37-E41 WeakPolarHBondContact CD2-OE1 3.18Å; L37-E41 HydrophobicContact CG-CB 4.41Å; S38-E41 VanDerWaalsContact CB-OE2 3.25Å; S38-E41 WeakPolarHBondContact CB-OE2 3.46Å; S38-E41 PolarHBondContact N-OE2 2.79Å; S38-E41 PolarHBondContact O-N 2.79Å; S38-E41 WeakPolarHBondContact OG-CB 3.31Å; S38-E41 VanDerWaalsContact OG-CG 3.31Å; S38-E41 WeakPolarHBondContact OG-CG 3.47Å; S38-E41 PolarHBondContact OG-N 3.28Å; S38-E41 PolarHBondContact OG-OE2 3.17Å; E41-L45 VanDerWaalsContact O-CB 3.27Å; E41-L45 WeakPolarHBondContact O-CB 3.37Å; E41-L45 PolarHBondContact O-N 2.96Å; E41-L452 HydrophobicContact CG-CD1 3.78Å; E41-L452 HydrophobicContact CG-CD2 4.21Å; E41-L452 WeakPolarHBondContact OE2-CD2 3.49Å; E41-R455 IonicContact OE1-NH2 3.81Å; E41-R455 PolarHBondContact OE1-NH2 2.85Å; E41-R455 IonicContact OE2-CZ 3.35Å; E41-R455 IonicContact OE2-NH1 3.03Å; E41-R455 IonicContact OE2-NH2 2.73Å; E41-R455 PolarHBondContact OE2-NH2 3.43Å; E41-K456 WeakPolarHBondContact OE1-CE 3.3Å; E41-K456 IonicContact OE1-NZ 3.52Å; E41-K456 PolarHBondContact OE1-NZ 3.29Å
42	R	92.4	Very high	92.1	Very high	17 Å²	17	32.6 Å²	32.6	6%	0.064	17%	0.169	C	C	.	.	H	α-helix	trans	-70.5	-36.3	177.5	-67.2	-179.9	77.3	166.4	5.1	112.8	V34 L37 S38 L40 L45 Q46 S341 D342	V34-R42 WeakPolarHBondContact O-CD 3.39Å; L37-R42 HydrophobicContact CB-CG 3.71Å; L37-R42 HydrophobicContact CD1-CG 4.41Å; S38-R42 WeakPolarHBondContact O-CG 3.45Å; S38-R42 PolarHBondContact O-N 3.01Å; L40-R42 VanDerWaalsContact C-N 3.28Å; L40-R42 PolarHBondContact O-N 3.08Å; R42-L45 PolarHBondContact O-N 3.19Å; R42-Q46 WeakPolarHBondContact O-CG 3.4Å; R42-Q46 PolarHBondContact O-N 3.24Å; R42-S341 PolarHBondContact NH2-OG 3.29Å; R42-D342 IonicContact CZ-OD1 2.81Å; R42-D342 VanDerWaalsContact CZ-OD1 3.23Å; R42-D342 IonicContact NH1-OD1 3.14Å; R42-D342 PolarHBondContact NH1-OD1 2.91Å; R42-D342 IonicContact NH1-OD2 3.67Å; R42-D342 PolarHBondContact NH1-OD2 2.98Å; R42-D342 IonicContact NH2-OD1 3.75Å; R42-D342 PolarHBondContact NH2-OD1 3.48Å
43	A	91.3	Very high	92.2	Very high	27 Å²	27	31.2 Å²	31.2	22%	0.223	16%	0.16	C	C	.	.	H	α-helix	trans	-66.5	-43.2	175.1	0	0	0	0	0	112.2	E39 L40 Q46 E47 L226	E39-A43 WeakPolarHBondContact O-CB 3.23Å; E39-A43 PolarHBondContact O-N 3.19Å; L40-A43 PolarHBondContact O-N 2.99Å; A43-Q46 WeakPolarHBondContact O-CB 3.3Å; A43-Q46 PolarHBondContact O-N 3.3Å; A43-E47 PolarHBondContact O-N 3.27Å; A43-L226 HydrophobicContact CB-CD1 3.46Å; A43-L226 VanDerWaalsContact CB-CD1 3.46Å
44	R	92.4	Very high	92.1	Very high	46 Å²	46	34.3 Å²	34.3	17%	0.174	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-37	173.1	-70.4	-59.2	-162.2	-155.9	2.8	112.4	L40 Q46 E47 V48 V437 L441 T444	L40-R44 HydrophobicContact CD1-CG 4.49Å; L40-R44 PolarHBondContact O-N 2.85Å; R44-Q46 VanDerWaalsContact C-N 3.26Å; R44-Q46 PolarHBondContact O-N 2.92Å; R44-E47 WeakPolarHBondContact CD-OE2 3.49Å; R44-E47 IonicContact CZ-OE2 3.93Å; R44-E47 IonicContact NE-OE2 3.21Å; R44-E47 IonicContact NH1-OE1 2.77Å; R44-E47 IonicContact NH1-OE2 3.19Å; R44-E47 PolarHBondContact NH1-OE2 3.25Å; R44-E47 PolarHBondContact O-N 3.48Å; R44-E47 VanDerWaalsContact O-N 3.12Å; R44-V48 WeakPolarHBondContact O-CG2 3.42Å; R44-V48 PolarHBondContact O-N 2.8Å; R44-V437 HydrophobicContact CB-CG1 3.9Å; R44-V437 HydrophobicContact CB-CG2 4.27Å; R44-L441 HydrophobicContact CG-CD1 4.44Å; R44-L441 HydrophobicContact CG-CD2 3.76Å; R44-L441 HydrophobicContact CG-CG 3.93Å; R44-T444 PolarHBondContact NH2-OG1 3.13Å
45	L	94.9	Very high	92	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-34.7	174	-176	64.6	0	0	0	112.1	L37 E41 R42 A49 Y334 V429 L433 V437	L37-L45 HydrophobicContact CD1-CD2 4.02Å; E41-L45 VanDerWaalsContact O-CB 3.27Å; E41-L45 WeakPolarHBondContact O-CB 3.37Å; E41-L45 PolarHBondContact O-N 2.96Å; R42-L45 PolarHBondContact O-N 3.19Å; L45-A49 WeakPolarHBondContact O-CB 3.44Å; L45-A49 PolarHBondContact O-N 2.98Å; L45-Y334 HydrophobicContact CD1-CD2 3.94Å; L45-Y334 HydrophobicContact CD1-CE2 4.27Å; L45-Y334 HydrophobicContact CD2-CD1 4.12Å; L45-Y334 HydrophobicContact CD2-CD2 4.01Å; L45-Y334 HydrophobicContact CD2-CE2 4.4Å; L45-Y334 HydrophobicContact CD2-CG 3.87Å; L45-Y334 HydrophobicContact CG-CD2 3.97Å; L45-Y334 HydrophobicContact CG-CG 4.08Å; L45-V429 HydrophobicContact CD1-CG1 3.8Å; L45-V429 HydrophobicContact CD2-CG1 4.15Å; L45-V429 HydrophobicContact CD2-CG2 3.68Å; L45-L433 HydrophobicContact CD1-CB 4.21Å; L45-V437 HydrophobicContact CB-CG2 4.03Å; L45-V437 HydrophobicContact CD1-CG2 4.14Å
46	Q	94.5	Very high	92	Very high	45 Å²	45	43.4 Å²	43.4	21%	0.21	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-42.8	172.2	-77.5	177.9	-13.8	0	0	112.4	R42 A43 R44 Y50 Y334 L336	R42-Q46 WeakPolarHBondContact O-CG 3.4Å; R42-Q46 PolarHBondContact O-N 3.24Å; A43-Q46 WeakPolarHBondContact O-CB 3.3Å; A43-Q46 PolarHBondContact O-N 3.3Å; R44-Q46 VanDerWaalsContact C-N 3.26Å; R44-Q46 PolarHBondContact O-N 2.92Å; Q46-Y50 WeakPolarHBondContact O-CB 3.46Å; Q46-Y50 PolarHBondContact O-N 3.41Å; Q46-Y334 WeakPolarHBondContact CG-O 3.48Å; Q46-Y334 PolarHBondContact NE2-O 3.36Å; Q46-L336 PolarHBondContact NE2-O 3.31Å
47	E	93.1	Very high	92.1	Very high	92 Å²	92	43.3 Å²	43.3	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-67.7	-44.6	178.7	-66.4	175.2	158.8	0	0	111.9	A43 R44 T51	A43-E47 PolarHBondContact O-N 3.27Å; R44-E47 WeakPolarHBondContact CD-OE2 3.49Å; R44-E47 IonicContact CZ-OE2 3.93Å; R44-E47 IonicContact NE-OE2 3.21Å; R44-E47 IonicContact NH1-OE1 2.77Å; R44-E47 IonicContact NH1-OE2 3.19Å; R44-E47 PolarHBondContact NH1-OE2 3.25Å; R44-E47 PolarHBondContact O-N 3.48Å; R44-E47 VanDerWaalsContact O-N 3.12Å; E47-T51 WeakPolarHBondContact O-CB 3.44Å; E47-T51 PolarHBondContact O-N 3.24Å; E47-T51 PolarHBondContact O-OG1 3.18Å
48	V	94.3	Very high	91.9	Very high	14 Å²	14	49.8 Å²	49.8	9%	0.085	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-50.5	175	173.5	0	0	0	0	110.7	R44 Y50 T51 R52 L433 E436 V437	R44-V48 WeakPolarHBondContact O-CG2 3.42Å; R44-V48 PolarHBondContact O-N 2.8Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 3.5Å; V48-T51 WeakPolarHBondContact O-CB 3.42Å; V48-T51 PolarHBondContact O-N 2.93Å; V48-T51 VanDerWaalsContact O-N 3.1Å; V48-R52 WeakPolarHBondContact O-CG 3.47Å; V48-R52 PolarHBondContact O-N 3.26Å; V48-L433 HydrophobicContact CG1-CD2 3.97Å; V48-E436 HydrophobicContact CG1-CB 3.82Å; V48-E436 HydrophobicContact CG2-CB 4.25Å; V48-V437 HydrophobicContact CB-CG2 4.39Å; V48-V437 HydrophobicContact CG2-CG2 3.98Å
49	A	95.1	Very high	91.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-36.3	-179.1	0	0	0	0	0	112.8	L45 T51 L53 L331 Y334 L335	L45-A49 WeakPolarHBondContact O-CB 3.44Å; L45-A49 PolarHBondContact O-N 2.98Å; A49-T51 VanDerWaalsContact C-N 3.35Å; A49-L53 WeakPolarHBondContact O-CB 3.42Å; A49-L53 VanDerWaalsContact O-CG 3.27Å; A49-L53 WeakPolarHBondContact O-CG 3.42Å; A49-L53 PolarHBondContact O-N 3.43Å; A49-L331 HydrophobicContact CB-CB 4.4Å; A49-L331 HydrophobicContact CB-CD2 3.76Å; A49-Y334 HydrophobicContact CB-CD2 4.19Å; A49-L335 HydrophobicContact CB-CD1 3.74Å
50	Y	94.7	Very high	91.5	Very high	71 Å²	71	49.5 Å²	49.5	28%	0.278	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-39.2	173.4	178.3	-107.1	0	0	0	111.8	Q46 V48 L53 L54 I63 I65 L335	Q46-Y50 WeakPolarHBondContact O-CB 3.46Å; Q46-Y50 PolarHBondContact O-N 3.41Å; V48-Y50 VanDerWaalsContact C-N 3.33Å; V48-Y50 PolarHBondContact O-N 3.5Å; Y50-L53 PolarHBondContact O-N 3.11Å; Y50-L54 HydrophobicContact CD1-CD1 4.22Å; Y50-L54 HydrophobicContact CE1-CD1 3.62Å; Y50-L54 HydrophobicContact CE2-CD1 4.07Å; Y50-L54 WeakPolarHBondContact O-CG 3.43Å; Y50-L54 PolarHBondContact O-N 3.36Å; Y50-I63 HydrophobicContact CD2-CG2 4.13Å; Y50-I63 HydrophobicContact CE2-CB 4.2Å; Y50-I63 HydrophobicContact CE2-CG2 4.06Å; Y50-I63 WeakPolarHBondContact CE2-O 3.4Å; Y50-I63 PolarHBondContact OH-O 3.49Å; Y50-I65 HydrophobicContact CD1-CD1 4.1Å; Y50-I65 HydrophobicContact CD1-CG1 4.44Å; Y50-I65 HydrophobicContact CD2-CD1 4.17Å; Y50-I65 HydrophobicContact CD2-CG1 3.68Å; Y50-I65 HydrophobicContact CE2-CG1 4.17Å; Y50-I65 HydrophobicContact CG-CD1 3.77Å; Y50-I65 HydrophobicContact CG-CG1 3.82Å; Y50-L335 HydrophobicContact CD2-CD2 4.11Å
51	T	92.9	Very high	91.3	Very high	61 Å²	61	50.1 Å²	50.1	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-48.1	177.5	-57.1	0	0	0	0	111	E47 V48 A49 L53 L54 Q55	E47-T51 WeakPolarHBondContact O-CB 3.44Å; E47-T51 PolarHBondContact O-N 3.24Å; E47-T51 PolarHBondContact O-OG1 3.18Å; V48-T51 WeakPolarHBondContact O-CB 3.42Å; V48-T51 PolarHBondContact O-N 2.93Å; V48-T51 VanDerWaalsContact O-N 3.1Å; A49-T51 VanDerWaalsContact C-N 3.35Å; T51-L53 PolarHBondContact O-N 3.19Å; T51-L54 PolarHBondContact O-N 2.78Å; T51-L54 VanDerWaalsContact O-N 3.12Å; T51-Q55 HydrophobicContact CG2-CG 4.45Å; T51-Q55 WeakPolarHBondContact O-CG 3.28Å; T51-Q55 PolarHBondContact O-N 2.84Å; T51-Q55 VanDerWaalsContact O-N 3.1Å
52	R	93	Very high	90.9	Very high	59 Å²	59	58.9 Å²	58.9	22%	0.223	31%	0.306	C	S	.	.	H	α-helix	trans	-59.6	-43.9	174.9	-65.3	-56.2	-146.5	88	14.1	112.5	V48 L54 Q55 D56 L331 D432 L433 E436	V48-R52 WeakPolarHBondContact O-CG 3.47Å; V48-R52 PolarHBondContact O-N 3.26Å; R52-L54 PolarHBondContact O-N 3.06Å; R52-L54 VanDerWaalsContact O-N 3.12Å; R52-Q55 PolarHBondContact O-N 2.89Å; R52-Q55 VanDerWaalsContact O-N 3.12Å; R52-D56 WeakPolarHBondContact CD-OD2 3.47Å; R52-D56 IonicContact CZ-OD2 3.35Å; R52-D56 IonicContact NE-OD2 2.89Å; R52-D56 IonicContact NH1-OD2 3.17Å; R52-D56 PolarHBondContact NH1-OD2 3.22Å; R52-D56 WeakPolarHBondContact O-CB 3.37Å; R52-D56 PolarHBondContact O-N 3.19Å; R52-L331 HydrophobicContact CB-CD1 4.22Å; R52-D432 IonicContact NH2-OD2 2.68Å; R52-L433 HydrophobicContact CG-CD2 4.24Å; R52-E436 IonicContact CZ-OE1 3.91Å; R52-E436 IonicContact CZ-OE2 3.8Å; R52-E436 IonicContact NE-OE1 3.3Å; R52-E436 IonicContact NE-OE2 4Å; R52-E436 PolarHBondContact NE-OE2 3.41Å; R52-E436 IonicContact NH2-OE1 3.09Å; R52-E436 PolarHBondContact NH2-OE1 3.31Å; R52-E436 IonicContact NH2-OE2 2.81Å; R52-E436 PolarHBondContact NH2-OE2 3.13Å
53	L	93.7	Very high	90.7	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-19.1	175.9	-79.5	171.9	0	0	0	114.8	A49 Y50 T51 Y57 L59 I63 V328 L331 L332 L335	A49-L53 WeakPolarHBondContact O-CB 3.42Å; A49-L53 VanDerWaalsContact O-CG 3.27Å; A49-L53 WeakPolarHBondContact O-CG 3.42Å; A49-L53 PolarHBondContact O-N 3.43Å; Y50-L53 PolarHBondContact O-N 3.11Å; T51-L53 PolarHBondContact O-N 3.19Å; L53-Y57 HydrophobicContact CD2-CD2 4.4Å; L53-L59 HydrophobicContact CD2-CD1 4.09Å; L53-I63 HydrophobicContact CB-CD1 3.9Å; L53-I63 HydrophobicContact CD1-CD1 4.4Å; L53-V328 HydrophobicContact CD2-CG1 3.84Å; L53-L331 HydrophobicContact CD1-CB 3.88Å; L53-L331 HydrophobicContact CD2-CB 3.84Å; L53-L331 HydrophobicContact CD2-CD1 3.97Å; L53-L331 HydrophobicContact CG-CB 3.71Å; L53-L331 HydrophobicContact CG-CD1 4Å; L53-L331 HydrophobicContact CG-CG 4.49Å; L53-L332 HydrophobicContact CD1-CD2 3.79Å; L53-L332 HydrophobicContact CD1-CG 4.22Å; L53-L332 HydrophobicContact CD2-CG 4.49Å; L53-L335 HydrophobicContact CD1-CD1 3.73Å; L53-L335 HydrophobicContact CD1-CD2 3.83Å; L53-L335 HydrophobicContact CD1-CG 4.44Å
54	L	90.8	Very high	90.5	Very high	98 Å²	98	59.6 Å²	59.6	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-102.3	-12.9	176.3	-68.4	-180	0	0	0	114	Y50 T51 R52	Y50-L54 HydrophobicContact CD1-CD1 4.22Å; Y50-L54 HydrophobicContact CE1-CD1 3.62Å; Y50-L54 HydrophobicContact CE2-CD1 4.07Å; Y50-L54 WeakPolarHBondContact O-CG 3.43Å; Y50-L54 PolarHBondContact O-N 3.36Å; T51-L54 PolarHBondContact O-N 2.78Å; T51-L54 VanDerWaalsContact O-N 3.12Å; R52-L54 PolarHBondContact O-N 3.06Å; R52-L54 VanDerWaalsContact O-N 3.12Å
55	Q	90.2	Very high	90.3	Very high	139 Å²	139	59.7 Å²	59.7	65%	0.65	31%	0.312	S	S	*	.	H	α-helix	trans	-103.1	-42.4	-178.8	-72.1	178.5	-5.9	0	0	112.2	T51 R52	T51-Q55 HydrophobicContact CG2-CG 4.45Å; T51-Q55 WeakPolarHBondContact O-CG 3.28Å; T51-Q55 PolarHBondContact O-N 2.84Å; T51-Q55 VanDerWaalsContact O-N 3.1Å; R52-Q55 PolarHBondContact O-N 2.89Å; R52-Q55 VanDerWaalsContact O-N 3.12Å
56	D	89.8	Confident	89.8	Confident	76 Å²	76	60.1 Å²	60.1	41%	0.406	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-19.3	-169	-59.9	-17.1	0	0	0	112.8	R52	R52-D56 WeakPolarHBondContact CD-OD2 3.47Å; R52-D56 IonicContact CZ-OD2 3.35Å; R52-D56 IonicContact NE-OD2 2.89Å; R52-D56 IonicContact NH1-OD2 3.17Å; R52-D56 PolarHBondContact NH1-OD2 3.22Å; R52-D56 WeakPolarHBondContact O-CB 3.37Å; R52-D56 PolarHBondContact O-N 3.19Å
57	Y	90.2	Very high	88.8	Confident	49 Å²	49	64.1 Å²	64.1	19%	0.192	33%	0.332	C	S	.	.			trans	-138	128.2	-169	-58.5	-72.4	0	0	0	113.7	L53 L59 E324 V328 L331	L53-Y57 HydrophobicContact CD2-CD2 4.4Å; Y57-L59 PolarHBondContact O-N 3.2Å; Y57-E324 HydrophobicContact CE1-CB 4.06Å; Y57-E324 HydrophobicContact CE1-CG 4.18Å; Y57-V328 HydrophobicContact CD1-CG2 3.46Å; Y57-V328 VanDerWaalsContact CD1-CG2 3.46Å; Y57-V328 HydrophobicContact CD2-CG2 3.68Å; Y57-V328 HydrophobicContact CE1-CG2 3.53Å; Y57-V328 HydrophobicContact CE2-CG2 3.72Å; Y57-V328 HydrophobicContact CG-CG2 3.54Å; Y57-L331 HydrophobicContact CD2-CD1 4.35Å; Y57-L331 HydrophobicContact CE2-CD1 3.82Å
58	D	87.1	Confident	87.3	Confident	142 Å²	142	64 Å²	64	76%	0.759	33%	0.334	S	S	*	.			trans	-90.1	91.6	167	-172.3	3.8	0	0	0	111	G60	D58-G60 PolarHBondContact O-N 2.7Å; D58-G60 WeakPolarHBondContact OD1-CA 3.49Å; D58-G60 PolarHBondContact OD1-N 2.81Å
59	L	86	Confident	85.3	Confident	9 Å²	9	65.8 Å²	65.8	5%	0.047	36%	0.356	C	S	.	.			trans	-79.2	3.3	173.4	-88.7	168.8	0	0	0	113.9	L53 Y57 C61 I63 A313 N316 T317 L320 V328	L53-L59 HydrophobicContact CD2-CD1 4.09Å; Y57-L59 PolarHBondContact O-N 3.2Å; L59-C61 PolarHBondContact O-N 1.83Å; L59-C61 PolarHBondContact O-SG 3.33Å; L59-I63 HydrophobicContact CD1-CD1 3.73Å; L59-A313 HydrophobicContact CD1-CB 4.41Å; L59-N316 HydrophobicContact CD2-CB 3.88Å; L59-N316 WeakPolarHBondContact O-CB 3.25Å; L59-N316 PolarHBondContact O-ND2 3.41Å; L59-T317 HydrophobicContact CD2-CG2 4.48Å; L59-L320 HydrophobicContact CD2-CD1 4.02Å; L59-V328 HydrophobicContact CD1-CG1 3.74Å; L59-V328 HydrophobicContact CD2-CG1 4.17Å; L59-V328 HydrophobicContact CG-CG1 4.25Å
60	G	82.9	Confident	83.1	Confident	62 Å²	62	71.2 Å²	71.2	64%	0.639	38%	0.382	S	S	*	.	S	Bend	trans	59.4	16.5	176.3	0	0	0	0	0	115.5	D58	D58-G60 PolarHBondContact O-N 2.7Å; D58-G60 WeakPolarHBondContact OD1-CA 3.49Å; D58-G60 PolarHBondContact OD1-N 2.81Å
61	C	85.9	Confident	80.6	Confident	37 Å²	37	76.5 Å²	76.5	25%	0.25	41%	0.406	C	S	.	.	S	Bend	trans	-149.8	157.1	-175.2	65.6	0	0	0	0	112.5	L59 I63 T312	L59-C61 PolarHBondContact O-N 1.83Å; L59-C61 PolarHBondContact O-SG 3.33Å; C61-I63 PolarHBondContact O-N 3.22Å; C61-T312 HydrophobicContact CB-CG2 3.71Å
62	Q	84.6	Confident	78.3	Confident	187 Å²	187	84.6 Å²	84.6	87%	0.874	43%	0.43	S	S	*	.			trans	-78.1	111.1	175.9	-69.2	-173.6	-1.4	0	0	110.7
63	I	87.9	Confident	76	Confident	7 Å²	7	90.2 Å²	90.2	4%	0.036	46%	0.456	C	S	.	.			trans	-81.6	134.3	172.7	-52	174.2	0	0	0	108.8	Y50 L53 L59 C61 L310 A313 L335	Y50-I63 HydrophobicContact CD2-CG2 4.13Å; Y50-I63 HydrophobicContact CE2-CB 4.2Å; Y50-I63 HydrophobicContact CE2-CG2 4.06Å; Y50-I63 WeakPolarHBondContact CE2-O 3.4Å; Y50-I63 PolarHBondContact OH-O 3.49Å; L53-I63 HydrophobicContact CB-CD1 3.9Å; L53-I63 HydrophobicContact CD1-CD1 4.4Å; L59-I63 HydrophobicContact CD1-CD1 3.73Å; C61-I63 PolarHBondContact O-N 3.22Å; I63-L310 HydrophobicContact CG2-CD2 4.03Å; I63-A313 HydrophobicContact CG1-CB 4.35Å; I63-L335 HydrophobicContact CG2-CD2 3.58Å
64	T	87.4	Confident	73.8	Confident	53 Å²	53	100.3 Å²	100.3	33%	0.325	50%	0.499	S	S	.	.			trans	-129.9	134.4	171	51.9	0	0	0	0	110.1	P66 E309	T64-P66 VanDerWaalsContact O-CD 3.29Å; T64-P66 WeakPolarHBondContact O-CD 3.42Å; T64-E309 PolarHBondContact OG1-OE2 2.86Å
65	I	87.3	Confident	71.7	Confident	47 Å²	47	98.3 Å²	98.3	24%	0.241	49%	0.494	C	S	.	.			trans	-66.5	118.8	175.9	-54.5	178.8	0	0	0	108.1	Y50 K67	Y50-I65 HydrophobicContact CD1-CD1 4.1Å; Y50-I65 HydrophobicContact CD1-CG1 4.44Å; Y50-I65 HydrophobicContact CD2-CD1 4.17Å; Y50-I65 HydrophobicContact CD2-CG1 3.68Å; Y50-I65 HydrophobicContact CE2-CG1 4.17Å; Y50-I65 HydrophobicContact CG-CD1 3.77Å; Y50-I65 HydrophobicContact CG-CG1 3.82Å; I65-K67 PolarHBondContact O-N 3.05Å; I65-K67 PolarHBondContact O-NZ 2.57Å
66	P	84.1	Confident	69.5	Low	13 Å²	13	98.1 Å²	98.1	8%	0.084	50%	0.497	C	S	.	.			trans	-60.1	126.3	-176.5	-23.6	33.4	0	0	0	112	T64 D68 T307 E309 L310 L335 P337	T64-P66 VanDerWaalsContact O-CD 3.29Å; T64-P66 WeakPolarHBondContact O-CD 3.42Å; P66-D68 PolarHBondContact O-N 2.91Å; P66-T307 HydrophobicContact CB-CG2 3.86Å; P66-T307 HydrophobicContact CG-CG2 4Å; P66-T307 WeakPolarHBondContact CG-OG1 3.48Å; P66-E309 HydrophobicContact CB-CB 4.42Å; P66-E309 HydrophobicContact CG-CB 4.19Å; P66-L310 HydrophobicContact CG-CD1 3.95Å; P66-L310 HydrophobicContact CG-CD2 4.33Å; P66-L310 HydrophobicContact CG-CG 3.79Å; P66-L335 WeakPolarHBondContact CD-O 3.41Å; P66-P337 HydrophobicContact CB-CG 4.11Å
67	K	74.3	Confident	67.4	Low	130 Å²	130	104.9 Å²	104.9	57%	0.565	52%	0.516	S	S	*	.			trans	-86.2	114.6	-172.9	-69.2	164.3	-162.4	66.5	0	110.6	I65 G69 E309	I65-K67 PolarHBondContact O-N 3.05Å; I65-K67 PolarHBondContact O-NZ 2.57Å; K67-G69 PolarHBondContact O-N 3.26Å; K67-E309 PolarHBondContact N-OE1 3.25Å; K67-E309 IonicContact NZ-OE2 2.85Å; K67-E309 PolarHBondContact NZ-OE2 3.08Å
68	D	60.2	Low	65.5	Low	88 Å²	88	111.9 Å²	111.9	47%	0.471	54%	0.542	S	S	.	.			trans	-44.9	130	173.3	-139.6	-30.4	0	0	0	111.1	P66 Q70	P66-D68 PolarHBondContact O-N 2.91Å; D68-Q70 PolarHBondContact O-N 3.49Å
69	G	52.7	Low	63.7	Low	53 Å²	53	112.4 Å²	112.4	55%	0.546	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-62.6	-0.5	-153.1	0	0	0	0	0	117.5	K67 K71 R72	K67-G69 PolarHBondContact O-N 3.26Å; G69-K71 PolarHBondContact O-N 3.27Å; G69-R72 PolarHBondContact O-N 3.24Å
70	Q	48.4	Very low	61.8	Low	114 Å²	114	118 Å²	118	53%	0.533	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-46.3	-31.1	178.4	-62.1	-81.4	-61.3	0	0	114.8	D68 R72 K224	D68-Q70 PolarHBondContact O-N 3.49Å; Q70-R72 VanDerWaalsContact C-N 3.35Å; Q70-R72 PolarHBondContact O-N 3.18Å; Q70-K224 VanDerWaalsContact OE1-NZ 3.08Å
71	K	42.5	Very low	59.8	Low	182 Å²	182	120.2 Å²	120.2	79%	0.791	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-80.3	-3.4	-172.7	-71.9	-172.1	176.8	177.9	0	115.2	G69 K73	G69-K71 PolarHBondContact O-N 3.27Å; K71-K73 PolarHBondContact O-N 3.3Å; K71-K73 VanDerWaalsContact O-N 3.16Å
72	R	45.2	Very low	57.9	Low	231 Å²	231	121.8 Å²	121.8	87%	0.872	58%	0.576	S	S	*	*			trans	-83.6	33.5	173.4	-106.2	-178.2	-177.6	177	3.2	115.3	G69 Q70 K74	G69-R72 PolarHBondContact O-N 3.24Å; Q70-R72 VanDerWaalsContact C-N 3.35Å; Q70-R72 PolarHBondContact O-N 3.18Å; R72-K74 PolarHBondContact O-N 3.31Å
73	K	44.6	Very low	56.2	Low	177 Å²	177	118.7 Å²	118.7	77%	0.77	57%	0.565	S	S	*	*			trans	-63.7	18.7	170	-73.9	-172.7	178.1	-178.2	0	115.4	K71 S75	K71-K73 PolarHBondContact O-N 3.3Å; K71-K73 VanDerWaalsContact O-N 3.16Å; K73-S75 PolarHBondContact O-N 3.49Å
74	K	48.5	Very low	54.2	Low	212 Å²	212	122.4 Å²	122.4	92%	0.922	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	45.5	174.9	-70.3	-170.8	176.3	-179.1	0	113	R72	R72-K74 PolarHBondContact O-N 3.31Å
75	S	46.8	Very low	52.1	Low	57 Å²	57	128.3 Å²	128.3	40%	0.399	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-143.7	18.9	174.8	-164	0	0	0	0	115.5	K73 R77 R78	K73-S75 PolarHBondContact O-N 3.49Å; S75-R77 VanDerWaalsContact C-N 3.32Å; S75-R77 PolarHBondContact O-N 3.31Å; S75-R78 PolarHBondContact O-N 2.92Å
76	L	43.8	Very low	50.1	Low	135 Å²	135	133.8 Å²	133.8	71%	0.707	64%	0.642	S	S	*	*	H	α-helix	trans	-66.5	-30.5	173.6	-79.8	169.9	0	0	0	113.1	K79 L80	L76-K79 PolarHBondContact O-N 3.07Å; L76-L80 PolarHBondContact O-N 3.42Å; L76-L80 VanDerWaalsContact O-N 3.12Å
77	R	46.2	Very low	48.2	Very low	217 Å²	217	143.1 Å²	143.1	82%	0.819	68%	0.682	S	S	*	*	H	α-helix	trans	-57.6	-49.8	173.5	-80.3	-175.2	172.1	167.4	-2.4	112	S75 K79 L80 D81	S75-R77 VanDerWaalsContact C-N 3.32Å; S75-R77 PolarHBondContact O-N 3.31Å; R77-K79 VanDerWaalsContact C-N 3.25Å; R77-K79 PolarHBondContact O-N 2.68Å; R77-L80 WeakPolarHBondContact O-CA 3.24Å; R77-L80 WeakPolarHBondContact O-CB 3.29Å; R77-L80 PolarHBondContact O-N 3.19Å; R77-D81 VanDerWaalsContact O-CG 3.27Å; R77-D81 PolarHBondContact O-N 3Å; R77-D81 VanDerWaalsContact O-OD2 3.06Å
78	R	50.3	Low	46.7	Very low	196 Å²	196	141.5 Å²	141.5	74%	0.74	69%	0.686	S	S	*	*	H	α-helix	trans	-59	-31.5	177.7	-65.9	-175.1	-179.9	172.4	-0.9	113.8	S75 S82	S75-R78 PolarHBondContact O-N 2.92Å; R78-S82 PolarHBondContact O-N 3.26Å; R78-S82 VanDerWaalsContact O-N 3.17Å; R78-S82 PolarHBondContact O-OG 3.29Å
79	K	47.6	Very low	46.1	Very low	154 Å²	154	147.2 Å²	147.2	67%	0.67	71%	0.707	S	S	*	*	H	α-helix	trans	-76	-25.6	174.7	-77.6	-159.8	171.5	-166	0	113.5	L76 R77 S82	L76-K79 PolarHBondContact O-N 3.07Å; R77-K79 VanDerWaalsContact C-N 3.25Å; R77-K79 PolarHBondContact O-N 2.68Å; K79-S82 WeakPolarHBondContact CA-OG 3.3Å; K79-S82 PolarHBondContact O-OG 3.11Å
80	L	46.7	Very low	45.6	Very low	125 Å²	125	151.4 Å²	151.4	65%	0.654	72%	0.717	S	S	*	*	H	α-helix	trans	-77.4	-41.1	172.3	-166	66.3	0	0	0	110.7	L76 R77 S82 L83 A84	L76-L80 PolarHBondContact O-N 3.42Å; L76-L80 VanDerWaalsContact O-N 3.12Å; R77-L80 WeakPolarHBondContact O-CA 3.24Å; R77-L80 WeakPolarHBondContact O-CB 3.29Å; R77-L80 PolarHBondContact O-N 3.19Å; L80-S82 VanDerWaalsContact C-N 3.3Å; L80-S82 PolarHBondContact O-N 2.85Å; L80-L83 PolarHBondContact O-N 3.47Å; L80-A84 PolarHBondContact O-N 2.9Å
81	D	41.1	Very low	45.8	Very low	109 Å²	109	156.2 Å²	156.2	58%	0.583	74%	0.736	S	S	*	*	H	α-helix	trans	-64.4	-31.5	176.9	-60.2	-41.3	0	0	0	112.7	R77	R77-D81 VanDerWaalsContact O-CG 3.27Å; R77-D81 PolarHBondContact O-N 3Å; R77-D81 VanDerWaalsContact O-OD2 3.06Å
82	S	46.7	Very low	46.4	Very low	70 Å²	70	156.4 Å²	156.4	49%	0.49	74%	0.74	S	S	.	*	H	α-helix	trans	-70.9	-37.2	175.8	54.3	0	0	0	0	113.3	R78 K79 L80 A84 K85	R78-S82 PolarHBondContact O-N 3.26Å; R78-S82 VanDerWaalsContact O-N 3.17Å; R78-S82 PolarHBondContact O-OG 3.29Å; K79-S82 WeakPolarHBondContact CA-OG 3.3Å; K79-S82 PolarHBondContact O-OG 3.11Å; L80-S82 VanDerWaalsContact C-N 3.3Å; L80-S82 PolarHBondContact O-N 2.85Å; S82-A84 PolarHBondContact O-N 3.08Å; S82-K85 PolarHBondContact O-N 2.85Å
83	L	47.9	Very low	47	Very low	122 Å²	122	148.9 Å²	148.9	64%	0.639	72%	0.722	S	S	*	*	H	α-helix	trans	-65.6	-25.1	177	-77.1	165.6	0	0	0	112.5	L80 K85	L80-L83 PolarHBondContact O-N 3.47Å; L83-K85 PolarHBondContact O-N 3.37Å
84	A	45.4	Very low	48.6	Very low	86 Å²	86	145.7 Å²	145.7	71%	0.711	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-0.4	176.4	0	0	0	0	0	114.4	L80 S82	L80-A84 PolarHBondContact O-N 2.9Å; S82-A84 PolarHBondContact O-N 3.08Å
85	K	44.5	Very low	50.3	Low	176 Å²	176	137.9 Å²	137.9	77%	0.765	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	10.7	-174.7	-99.3	-179.2	178.3	176.3	0	116	S82 L83 K87	S82-K85 PolarHBondContact O-N 2.85Å; L83-K85 PolarHBondContact O-N 3.37Å; K85-K87 PolarHBondContact O-N 3.32Å
86	E	45.7	Very low	52.3	Low	162 Å²	162	138.3 Å²	138.3	76%	0.757	68%	0.684	S	S	*	*			trans	-74.1	74.2	179.2	-161.5	175.3	156.9	0	0	112.3
87	K	43.9	Very low	54.5	Low	210 Å²	210	132.1 Å²	132.1	91%	0.913	65%	0.652	S	S	*	*			trans	-145.1	34.8	170	-147.3	170.9	-173.2	173.9	0	113.2	K85	K85-K87 PolarHBondContact O-N 3.32Å
88	S	42.1	Very low	56.8	Low	95 Å²	95	121.9 Å²	121.9	66%	0.664	61%	0.614	S	S	*	*	S	Bend	trans	-121.5	130.6	169.2	47.8	0	0	0	0	109.6	D90	S88-D90 PolarHBondContact O-N 2.91Å; S88-D90 VanDerWaalsContact O-N 3.08Å
89	K	47.1	Very low	58.7	Low	208 Å²	208	115.8 Å²	115.8	90%	0.904	60%	0.601	S	S	*	*			trans	-89.2	63.1	-165.7	-168.5	-169.8	172.8	-178.5	0	112.5
90	D	43.8	Very low	60.8	Low	142 Å²	142	109.7 Å²	109.7	76%	0.759	58%	0.575	S	S	*	*			trans	-130.7	123.9	168.2	-78.6	-61.5	0	0	0	109.6	S88 E92	S88-D90 PolarHBondContact O-N 2.91Å; S88-D90 VanDerWaalsContact O-N 3.08Å; D90-E92 PolarHBondContact O-N 2.71Å
91	K	52.4	Low	63	Low	214 Å²	214	107 Å²	107	93%	0.93	57%	0.565	S	S	*	*			trans	-81.4	70.4	174.3	-70.4	-173.5	177.8	-176.5	0	109.3	C93	K91-C93 PolarHBondContact O-N 2.85Å
92	E	53.7	Low	65.4	Low	187 Å²	187	102.3 Å²	102.3	87%	0.874	54%	0.54	S	S	*	.			trans	-64.5	98.3	172.9	-168.1	169.4	-135.1	0	0	108.6	D90 V94	D90-E92 PolarHBondContact O-N 2.71Å; E92-V94 PolarHBondContact O-N 2.77Å
93	C	59.2	Low	67.5	Low	73 Å²	73	101.1 Å²	101.1	49%	0.493	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-67.3	123.9	-173.1	-168.5	0	0	0	0	109.5	K91 P95	K91-C93 PolarHBondContact O-N 2.85Å; C93-P95 WeakPolarHBondContact O-CD 3.28Å; C93-P95 VanDerWaalsContact O-N 3.16Å
94	V	76.8	Confident	69.6	Low	109 Å²	109	99.9 Å²	99.9	66%	0.661	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-61.8	118.3	173.5	179.8	0	0	0	0	107.6	E92 Q96	E92-V94 PolarHBondContact O-N 2.77Å; V94-Q96 PolarHBondContact O-N 3.45Å; V94-Q96 PolarHBondContact O-NE2 2.83Å
95	P	84.4	Confident	71.8	Confident	49 Å²	49	95.9 Å²	95.9	32%	0.318	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-61.4	127.5	-170.3	22.8	-33.5	0	0	0	110.7	C93 I100 D274	C93-P95 WeakPolarHBondContact O-CD 3.28Å; C93-P95 VanDerWaalsContact O-N 3.16Å; P95-I100 HydrophobicContact CG-CG2 4.08Å; P95-D274 HydrophobicContact CB-CB 4.43Å; P95-D274 WeakPolarHBondContact CB-OD1 3.44Å
96	Q	88.8	Confident	74	Confident	65 Å²	65	87.9 Å²	87.9	30%	0.304	46%	0.455	S	S	.	.	S	Bend	trans	-84	-17.3	-177.2	-62.5	-58.5	-52.7	0	0	113.3	V94 I100 N108 D274	V94-Q96 PolarHBondContact O-N 3.45Å; V94-Q96 PolarHBondContact O-NE2 2.83Å; Q96-I100 WeakPolarHBondContact O-CD1 3.34Å; Q96-N108 PolarHBondContact O-ND2 3.11Å; Q96-D274 WeakPolarHBondContact CB-O 3.4Å; Q96-D274 WeakPolarHBondContact CG-O 3.49Å; Q96-D274 PolarHBondContact N-O 3.15Å
97	A	90.3	Very high	76.2	Confident	6 Å²	6	81.9 Å²	81.9	5%	0.05	43%	0.433	C	S	.	.	S	Bend	trans	-136.7	-53	-170.7	0	0	0	0	0	115.4	I100 V105 V238 F273 D274 F297	A97-I100 WeakPolarHBondContact O-CG1 3.26Å; A97-V105 HydrophobicContact CB-CG1 4.39Å; A97-V105 WeakPolarHBondContact O-CG2 3.16Å; A97-V238 HydrophobicContact CB-CG2 3.81Å; A97-F273 HydrophobicContact CB-CB 4.34Å; A97-D274 PolarHBondContact N-OD1 3.04Å; A97-F297 WeakPolarHBondContact O-CE2 3.48Å
98	F	93.7	Very high	78.5	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.009	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	151.9	-172.7	-67.7	-105.3	0	0	0	111.9	I100 V238 R270 F273 D274 L293 F297	F98-I100 PolarHBondContact O-N 2.82Å; F98-V238 HydrophobicContact CE2-CG1 4.18Å; F98-V238 HydrophobicContact CZ-CG1 3.92Å; F98-R270 HydrophobicContact CB-CG 4.45Å; F98-R270 VanDerWaalsContact CB-CZ 3.46Å; F98-R270 HydrophobicContact CD1-CG 3.79Å; F98-R270 HydrophobicContact CD2-CG 3.68Å; F98-R270 HydrophobicContact CE1-CG 3.88Å; F98-R270 HydrophobicContact CE2-CB 4.37Å; F98-R270 HydrophobicContact CE2-CG 3.82Å; F98-R270 HydrophobicContact CG-CG 3.71Å; F98-R270 HydrophobicContact CZ-CB 4.4Å; F98-R270 HydrophobicContact CZ-CG 3.93Å; F98-F273 HydrophobicContact CE2-CB 3.93Å; F98-D274 PolarHBondContact N-OD1 2.97Å; F98-L293 HydrophobicContact CE1-CD1 4.09Å; F98-L293 HydrophobicContact CE2-CD1 4.44Å; F98-L293 HydrophobicContact CZ-CD1 3.57Å; F98-L293 HydrophobicContact CZ-CG 3.99Å; F98-F297 HydrophobicContact CD1-CB 4.2Å; F98-F297 HydrophobicContact CD1-CD2 4.17Å; F98-F297 VanDerWaalsContact CE1-CA 3.46Å; F98-F297 HydrophobicContact CE1-CB 3.58Å; F98-F297 HydrophobicContact CE1-CD2 4.04Å; F98-F297 HydrophobicContact CE1-CG 4.33Å; F98-F297 HydrophobicContact CE2-CD2 4.41Å; F98-F297 HydrophobicContact CG-CD2 4.42Å; F98-F297 HydrophobicContact CZ-CB 4.07Å; F98-F297 HydrophobicContact CZ-CD2 4.14Å
99	S	91.6	Very high	80.8	Confident	67 Å²	67	69.8 Å²	69.8	47%	0.469	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	13.4	176.2	-51.7	0	0	0	0	116.2	R270 D300	S99-R270 PolarHBondContact OG-NH2 3.48Å; S99-D300 WeakPolarHBondContact CA-O 3.39Å
100	I	91.4	Very high	82.8	Confident	26 Å²	26	65.2 Å²	65.2	13%	0.133	35%	0.348	C	S	.	.	S	Bend	trans	-114.2	161.6	172.5	58.7	159.2	0	0	0	110.8	P95 Q96 A97 F98 Q104 V105 N108 P302	P95-I100 HydrophobicContact CG-CG2 4.08Å; Q96-I100 WeakPolarHBondContact O-CD1 3.34Å; A97-I100 WeakPolarHBondContact O-CG1 3.26Å; F98-I100 PolarHBondContact O-N 2.82Å; I100-Q104 HydrophobicContact CD1-CB 4.19Å; I100-Q104 HydrophobicContact CD1-CG 3.92Å; I100-V105 HydrophobicContact CD1-CG2 3.79Å; I100-V105 HydrophobicContact CG1-CG2 3.72Å; I100-N108 WeakPolarHBondContact CD1-ND2 3.49Å; I100-P302 VanDerWaalsContact C-CD 3.5Å; I100-P302 WeakPolarHBondContact O-CD 3.3Å
101	P	92.1	Very high	84.8	Confident	68 Å²	68	61.5 Å²	61.5	44%	0.442	33%	0.33	S	S	.	.			trans	-63.2	142.6	-178.9	-22.5	34.3	0	0	0	112.5	S103 Q104 V105 P302	P101-S103 VanDerWaalsContact C-N 3.28Å; P101-S103 PolarHBondContact O-N 2.86Å; P101-Q104 WeakPolarHBondContact O-CA 3.31Å; P101-Q104 VanDerWaalsContact O-CB 3.31Å; P101-Q104 WeakPolarHBondContact O-CB 3.4Å; P101-Q104 PolarHBondContact O-N 2.99Å; P101-V105 PolarHBondContact O-N 3.49Å; P101-V105 VanDerWaalsContact O-N 3.14Å; P101-P302 HydrophobicContact CB-CG 4.3Å; P101-P302 HydrophobicContact CG-CG 4.01Å
102	L	92.1	Very high	86.3	Confident	12 Å²	12	53 Å²	53	6%	0.063	29%	0.294	C	S	.	.	H	α-helix	trans	-49.7	-44.6	-177.5	-176.3	64.6	0	0	0	113.4	Q104 V105 I106 P236 F297 M301 L305 C339 N340 T343	L102-Q104 VanDerWaalsContact C-N 3.29Å; L102-Q104 PolarHBondContact O-N 3.24Å; L102-V105 WeakPolarHBondContact O-CB 3.45Å; L102-V105 PolarHBondContact O-N 2.95Å; L102-V105 VanDerWaalsContact O-N 3.16Å; L102-I106 HydrophobicContact CD1-CD1 4.34Å; L102-I106 HydrophobicContact CG-CD1 4Å; L102-I106 WeakPolarHBondContact O-CD1 3.44Å; L102-I106 WeakPolarHBondContact O-CG1 3.3Å; L102-I106 PolarHBondContact O-N 3.2Å; L102-I106 VanDerWaalsContact O-N 3.07Å; L102-P236 HydrophobicContact CD1-CG 3.36Å; L102-F297 HydrophobicContact CD1-CE1 4.39Å; L102-F297 HydrophobicContact CD1-CZ 4.35Å; L102-M301 HydrophobicContact CB-SD 4.25Å; L102-M301 HydrophobicContact CD1-SD 4.09Å; L102-L305 HydrophobicContact CD2-CD1 3.84Å; L102-C339 HydrophobicContact CD2-CB 4.22Å; L102-C339 HydrophobicContact CG-CB 4.4Å; L102-N340 HydrophobicContact CD2-CB 4.38Å; L102-T343 HydrophobicContact CD1-CG2 4.34Å
103	S	90.8	Very high	87.8	Confident	45 Å²	45	51.4 Å²	51.4	32%	0.315	28%	0.28	S	S	.	.	H	α-helix	trans	-68.4	-22.3	177.4	50.7	0	0	0	0	114.2	P101 A107	P101-S103 VanDerWaalsContact C-N 3.28Å; P101-S103 PolarHBondContact O-N 2.86Å; S103-A107 WeakPolarHBondContact O-CB 3.48Å; S103-A107 PolarHBondContact O-N 3.04Å; S103-A107 VanDerWaalsContact O-N 3.15Å
104	Q	91.3	Very high	89	Confident	96 Å²	96	54.3 Å²	54.3	45%	0.449	29%	0.286	S	S	.	.	H	α-helix	trans	-76.7	-37.5	169.6	-173.9	65.2	63.4	0	0	111.3	I100 P101 L102 A107 N108	I100-Q104 HydrophobicContact CD1-CB 4.19Å; I100-Q104 HydrophobicContact CD1-CG 3.92Å; P101-Q104 WeakPolarHBondContact O-CA 3.31Å; P101-Q104 VanDerWaalsContact O-CB 3.31Å; P101-Q104 WeakPolarHBondContact O-CB 3.4Å; P101-Q104 PolarHBondContact O-N 2.99Å; L102-Q104 VanDerWaalsContact C-N 3.29Å; L102-Q104 PolarHBondContact O-N 3.24Å; Q104-A107 PolarHBondContact O-N 3.42Å; Q104-N108 PolarHBondContact NE2-OD1 2.97Å; Q104-N108 PolarHBondContact O-N 2.91Å; Q104-N108 PolarHBondContact O-ND2 2.89Å; Q104-N108 PolarHBondContact O-OD1 2.74Å
105	V	92.6	Very high	89.2	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-58.8	-50	173.3	-171.2	0	0	0	0	110.1	A97 I100 P101 L102 A107 N108 D109 P236 F297	A97-V105 HydrophobicContact CB-CG1 4.39Å; A97-V105 WeakPolarHBondContact O-CG2 3.16Å; I100-V105 HydrophobicContact CD1-CG2 3.79Å; I100-V105 HydrophobicContact CG1-CG2 3.72Å; P101-V105 PolarHBondContact O-N 3.49Å; P101-V105 VanDerWaalsContact O-N 3.14Å; L102-V105 WeakPolarHBondContact O-CB 3.45Å; L102-V105 PolarHBondContact O-N 2.95Å; L102-V105 VanDerWaalsContact O-N 3.16Å; V105-A107 VanDerWaalsContact C-N 3.28Å; V105-A107 PolarHBondContact O-N 3.4Å; V105-N108 WeakPolarHBondContact O-CB 3.23Å; V105-N108 PolarHBondContact O-N 3.17Å; V105-N108 VanDerWaalsContact O-N 3.08Å; V105-D109 PolarHBondContact O-N 2.67Å; V105-P236 HydrophobicContact CG1-CB 3.85Å; V105-P236 HydrophobicContact CG1-CG 4.34Å; V105-F297 HydrophobicContact CG1-CE2 4.4Å; V105-F297 HydrophobicContact CG1-CZ 4.45Å; V105-F297 HydrophobicContact CG2-CE2 4.35Å; V105-F297 HydrophobicContact CG2-CZ 4.33Å
106	I	91.7	Very high	88.9	Confident	7 Å²	7	57 Å²	57	4%	0.036	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-34.9	179.6	-65.3	157.7	0	0	0	111.3	L102 R110 Q234 P236 C339	L102-I106 HydrophobicContact CD1-CD1 4.34Å; L102-I106 HydrophobicContact CG-CD1 4Å; L102-I106 WeakPolarHBondContact O-CD1 3.44Å; L102-I106 WeakPolarHBondContact O-CG1 3.3Å; L102-I106 PolarHBondContact O-N 3.2Å; L102-I106 VanDerWaalsContact O-N 3.07Å; I106-R110 VanDerWaalsContact O-CG 3.29Å; I106-R110 WeakPolarHBondContact O-CG 3.42Å; I106-R110 PolarHBondContact O-N 2.76Å; I106-Q234 HydrophobicContact CD1-CB 4.28Å; I106-Q234 VanDerWaalsContact CD1-O 3.23Å; I106-Q234 WeakPolarHBondContact CD1-O 3.35Å; I106-P236 HydrophobicContact CD1-CG 4.46Å; I106-P236 HydrophobicContact CG1-CG 4.07Å; I106-C339 HydrophobicContact CD1-CB 3.63Å
107	A	90.5	Very high	88.5	Confident	37 Å²	37	57 Å²	57	31%	0.306	28%	0.282	S	S	.	.	H	α-helix	trans	-67.1	-41.9	172.4	0	0	0	0	0	112.6	S103 Q104 V105 R110 V111	S103-A107 WeakPolarHBondContact O-CB 3.48Å; S103-A107 PolarHBondContact O-N 3.04Å; S103-A107 VanDerWaalsContact O-N 3.15Å; Q104-A107 PolarHBondContact O-N 3.42Å; V105-A107 VanDerWaalsContact C-N 3.28Å; V105-A107 PolarHBondContact O-N 3.4Å; A107-R110 PolarHBondContact O-N 3.42Å; A107-V111 WeakPolarHBondContact O-CG2 3.48Å; A107-V111 PolarHBondContact O-N 2.94Å; A107-V111 VanDerWaalsContact O-N 3.11Å
108	N	91.8	Very high	88	Confident	28 Å²	28	59.4 Å²	59.4	15%	0.15	30%	0.303	C	S	.	.	H	α-helix	trans	-63.4	-44.7	176	-62.1	-14.2	0	0	0	111	Q96 I100 Q104 V105 R110 V111 H112	Q96-N108 PolarHBondContact O-ND2 3.11Å; I100-N108 WeakPolarHBondContact CD1-ND2 3.49Å; Q104-N108 PolarHBondContact NE2-OD1 2.97Å; Q104-N108 PolarHBondContact O-N 2.91Å; Q104-N108 PolarHBondContact O-ND2 2.89Å; Q104-N108 PolarHBondContact O-OD1 2.74Å; V105-N108 WeakPolarHBondContact O-CB 3.23Å; V105-N108 PolarHBondContact O-N 3.17Å; V105-N108 VanDerWaalsContact O-N 3.08Å; N108-R110 PolarHBondContact O-N 3.29Å; N108-V111 PolarHBondContact O-N 3.35Å; N108-H112 WeakPolarHBondContact O-CB 3.44Å; N108-H112 PolarHBondContact O-N 3.39Å
109	D	91.1	Very high	87.1	Confident	22 Å²	22	67.1 Å²	67.1	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-38	177.2	-83.4	-33.2	0	0	0	112.8	V105 H112 R113 R237	V105-D109 PolarHBondContact O-N 2.67Å; D109-H112 PolarHBondContact O-N 3.27Å; D109-R113 WeakPolarHBondContact O-CB 3.41Å; D109-R113 PolarHBondContact O-N 3.23Å; D109-R237 HydrophobicContact CB-CG 4.34Å; D109-R237 VanDerWaalsContact OD1-CD 3.3Å; D109-R237 WeakPolarHBondContact OD1-CD 3.47Å; D109-R237 IonicContact OD1-CZ 3.32Å; D109-R237 IonicContact OD1-NE 3.43Å; D109-R237 IonicContact OD1-NH1 2.92Å; D109-R237 PolarHBondContact OD1-NH1 2.84Å; D109-R237 PolarHBondContact OD2-N 2.97Å
110	R	88.3	Confident	86.2	Confident	113 Å²	113	72.9 Å²	72.9	43%	0.426	34%	0.344	S	S	.	.	H	α-helix	trans	-63.1	-46.1	172.9	-76.6	173	-179	166.6	5.7	111.7	I106 A107 N108 H112 R113 Q114	I106-R110 VanDerWaalsContact O-CG 3.29Å; I106-R110 WeakPolarHBondContact O-CG 3.42Å; I106-R110 PolarHBondContact O-N 2.76Å; A107-R110 PolarHBondContact O-N 3.42Å; N108-R110 PolarHBondContact O-N 3.29Å; R110-H112 VanDerWaalsContact C-N 3.33Å; R110-H112 PolarHBondContact O-N 2.9Å; R110-R113 PolarHBondContact O-N 2.99Å; R110-Q114 WeakPolarHBondContact O-CG 3.46Å; R110-Q114 PolarHBondContact O-N 2.78Å
111	V	87.1	Confident	85.3	Confident	63 Å²	63	78.4 Å²	78.4	38%	0.382	37%	0.374	S	S	.	.	H	α-helix	trans	-65.9	-35.8	177.2	171.6	0	0	0	0	111.6	A107 N108 R115	A107-V111 WeakPolarHBondContact O-CG2 3.48Å; A107-V111 PolarHBondContact O-N 2.94Å; A107-V111 VanDerWaalsContact O-N 3.11Å; N108-V111 PolarHBondContact O-N 3.35Å; V111-R115 VanDerWaalsContact O-CG 3.32Å; V111-R115 WeakPolarHBondContact O-CG 3.39Å; V111-R115 PolarHBondContact O-N 3.46Å
112	H	84.1	Confident	83.7	Confident	37 Å²	37	81.6 Å²	81.6	17%	0.171	39%	0.387	C	S	.	.	H	α-helix	trans	-63.6	-49.8	173.3	-179.5	-81.5	0	0	0	111.4	N108 D109 R110 Q114 R115 Q116 R237 G276	N108-H112 WeakPolarHBondContact O-CB 3.44Å; N108-H112 PolarHBondContact O-N 3.39Å; D109-H112 PolarHBondContact O-N 3.27Å; R110-H112 VanDerWaalsContact C-N 3.33Å; R110-H112 PolarHBondContact O-N 2.9Å; H112-Q114 PolarHBondContact O-N 3.33Å; H112-R115 PolarHBondContact O-N 2.96Å; H112-Q116 PolarHBondContact CE1-OE1 3.04Å; H112-Q116 PolarHBondContact ND1-OE1 2.82Å; H112-Q116 PolarHBondContact O-N 3.39Å; H112-R237 PolarHBondContact CE1-NH2 3.21Å; H112-R237 VanDerWaalsContact CE1-NH2 3.26Å; H112-G276 PolarHBondContact CD2-O 3.06Å; H112-G276 VanDerWaalsContact CD2-O 3.22Å; H112-G276 PolarHBondContact NE2-O 3.27Å
113	R	84.3	Confident	82	Confident	153 Å²	153	85 Å²	85	58%	0.577	41%	0.41	S	S	*	.	H	α-helix	trans	-58.2	-50.3	178.2	-173.1	-174.2	-63.9	-136.1	1.2	111.5	D109 R110 R115 Q116 D117	D109-R113 WeakPolarHBondContact O-CB 3.41Å; D109-R113 PolarHBondContact O-N 3.23Å; R110-R113 PolarHBondContact O-N 2.99Å; R113-R115 PolarHBondContact O-N 2.94Å; R113-R115 VanDerWaalsContact O-N 3.17Å; R113-Q116 PolarHBondContact O-N 3.39Å; R113-D117 WeakPolarHBondContact CG-OD2 3.31Å; R113-D117 PolarHBondContact O-N 3.12Å
114	Q	83.7	Confident	80.2	Confident	133 Å²	133	87.6 Å²	87.6	62%	0.621	43%	0.425	S	S	*	.	H	α-helix	trans	-55.2	-35.8	177.6	-75	173.2	-19.7	0	0	113.1	R110 H112 A118	R110-Q114 WeakPolarHBondContact O-CG 3.46Å; R110-Q114 PolarHBondContact O-N 2.78Å; H112-Q114 PolarHBondContact O-N 3.33Å; Q114-A118 WeakPolarHBondContact O-CB 3.39Å; Q114-A118 PolarHBondContact O-N 3.18Å
115	R	82.3	Confident	77.9	Confident	161 Å²	161	91.6 Å²	91.6	61%	0.608	44%	0.444	S	S	*	.	H	α-helix	trans	-70.6	-43.2	174.2	-71.2	168.7	178.8	173.3	0.5	112.3	V111 H112 R113 D117 A118 Y119	V111-R115 VanDerWaalsContact O-CG 3.32Å; V111-R115 WeakPolarHBondContact O-CG 3.39Å; V111-R115 PolarHBondContact O-N 3.46Å; H112-R115 PolarHBondContact O-N 2.96Å; R113-R115 PolarHBondContact O-N 2.94Å; R113-R115 VanDerWaalsContact O-N 3.17Å; R115-D117 VanDerWaalsContact C-N 3.32Å; R115-D117 PolarHBondContact O-N 2.96Å; R115-A118 PolarHBondContact O-N 2.91Å; R115-Y119 WeakPolarHBondContact O-CD2 3.19Å; R115-Y119 PolarHBondContact O-N 3.29Å
116	Q	78.3	Confident	75.7	Confident	54 Å²	54	101.3 Å²	101.3	25%	0.252	48%	0.481	S	S	.	.	H	α-helix	trans	-62	-40.1	175.9	-71.9	-175.2	-61.2	0	0	112.1	H112 R113 Y119 R120 D278	H112-Q116 PolarHBondContact CE1-OE1 3.04Å; H112-Q116 PolarHBondContact ND1-OE1 2.82Å; H112-Q116 PolarHBondContact O-N 3.39Å; R113-Q116 PolarHBondContact O-N 3.39Å; Q116-Y119 PolarHBondContact O-N 2.97Å; Q116-R120 WeakPolarHBondContact O-CG 3.48Å; Q116-R120 PolarHBondContact O-N 3.33Å; Q116-R120 VanDerWaalsContact O-N 3.16Å; Q116-D278 PolarHBondContact NE2-OD2 2.94Å
117	D	79.9	Confident	73	Confident	64 Å²	64	109.3 Å²	109.3	34%	0.342	52%	0.518	S	S	.	.	H	α-helix	trans	-70.4	-38.6	179.1	-62.5	-27.9	0	0	0	111.1	R113 R115 R120 L121	R113-D117 WeakPolarHBondContact CG-OD2 3.31Å; R113-D117 PolarHBondContact O-N 3.12Å; R115-D117 VanDerWaalsContact C-N 3.32Å; R115-D117 PolarHBondContact O-N 2.96Å; D117-R120 WeakPolarHBondContact O-CB 3.48Å; D117-R120 PolarHBondContact O-N 2.9Å; D117-R120 VanDerWaalsContact O-N 3.12Å; D117-L121 WeakPolarHBondContact O-CG 3.42Å; D117-L121 PolarHBondContact O-N 2.86Å
118	A	79.5	Confident	70.7	Confident	58 Å²	58	114.4 Å²	114.4	48%	0.479	54%	0.535	S	S	.	.	H	α-helix	trans	-59.6	-47.4	170.9	0	0	0	0	0	112.3	Q114 R115 R120 L121 D122	Q114-A118 WeakPolarHBondContact O-CB 3.39Å; Q114-A118 PolarHBondContact O-N 3.18Å; R115-A118 PolarHBondContact O-N 2.91Å; A118-R120 PolarHBondContact O-N 3.23Å; A118-R120 VanDerWaalsContact O-N 3.16Å; A118-L121 PolarHBondContact O-N 3.17Å; A118-D122 PolarHBondContact O-N 3.29Å
119	Y	75.5	Confident	68.5	Low	164 Å²	164	121.2 Å²	121.2	64%	0.643	57%	0.566	S	S	*	*	H	α-helix	trans	-64.2	-15.3	175.1	-73.4	-56.7	0	0	0	114.4	R115 Q116	R115-Y119 WeakPolarHBondContact O-CD2 3.19Å; R115-Y119 PolarHBondContact O-N 3.29Å; Q116-Y119 PolarHBondContact O-N 2.97Å
120	R	71.6	Confident	66.3	Low	187 Å²	187	129 Å²	129	71%	0.706	60%	0.599	S	S	*	*	H	α-helix	trans	-91.2	-35.2	175.6	-82.1	176.6	164	152.7	-2.2	113.1	Q116 D117 A118	Q116-R120 WeakPolarHBondContact O-CG 3.48Å; Q116-R120 PolarHBondContact O-N 3.33Å; Q116-R120 VanDerWaalsContact O-N 3.16Å; D117-R120 WeakPolarHBondContact O-CB 3.48Å; D117-R120 PolarHBondContact O-N 2.9Å; D117-R120 VanDerWaalsContact O-N 3.12Å; A118-R120 PolarHBondContact O-N 3.23Å; A118-R120 VanDerWaalsContact O-N 3.16Å
121	L	73.4	Confident	63.7	Low	143 Å²	143	130.4 Å²	130.4	75%	0.749	61%	0.614	S	S	*	*	H	α-helix	trans	-80.3	-45.2	179.8	-68.7	169.3	0	0	0	111.2	D117 A118 P123	D117-L121 WeakPolarHBondContact O-CG 3.42Å; D117-L121 PolarHBondContact O-N 2.86Å; A118-L121 PolarHBondContact O-N 3.17Å; L121-P123 WeakPolarHBondContact O-CD 3.45Å
122	D	58.4	Low	61.3	Low	135 Å²	135	133 Å²	133	72%	0.722	64%	0.636	S	S	*	*	S	Bend	trans	-116.1	84.9	168.3	-74	-56.1	0	0	0	109.5	A118 P124	A118-D122 PolarHBondContact O-N 3.29Å; D122-P124 WeakPolarHBondContact O-CD 3.21Å
123	P	55.8	Low	59.6	Low	84 Å²	84	135.4 Å²	135.4	55%	0.545	66%	0.657	S	S	.	*			trans	-58.1	123.8	163.6	-17.6	30.7	0	0	0	107.8	L121 Q125	L121-P123 WeakPolarHBondContact O-CD 3.45Å; P123-Q125 PolarHBondContact O-N 3.15Å
124	P	53.7	Low	57.6	Low	98 Å²	98	134.5 Å²	134.5	64%	0.636	66%	0.663	S	S	*	*			trans	-59.4	115.7	178.7	23.5	-32.6	0	0	0	108.3	D122 R126	D122-P124 WeakPolarHBondContact O-CD 3.21Å; P124-R126 PolarHBondContact O-N 3.33Å
125	Q	42.7	Very low	55.6	Low	180 Å²	180	134.4 Å²	134.4	84%	0.841	67%	0.666	S	S	*	*			trans	-55.5	133.3	175.2	-68.8	-168.9	5.9	0	0	108.1	P123 E127	P123-Q125 PolarHBondContact O-N 3.15Å; Q125-E127 VanDerWaalsContact C-N 3.28Å; Q125-E127 PolarHBondContact O-N 3.16Å
126	R	46.8	Very low	53.6	Low	207 Å²	207	130.7 Å²	130.7	78%	0.781	66%	0.661	S	S	*	*			trans	-69.8	94.9	166.5	-72	-172.4	179.3	178.7	2.9	107.8	P124 E128	P124-R126 PolarHBondContact O-N 3.33Å; R126-E128 HydrophobicContact CB-CG 3.85Å; R126-E128 IonicContact NH1-OE1 3.49Å; R126-E128 PolarHBondContact NH1-OE1 3.02Å; R126-E128 PolarHBondContact O-N 3.14Å
127	E	34.7	Very low	52	Low	175 Å²	175	131.7 Å²	131.7	82%	0.818	67%	0.674	S	S	*	*			trans	-64.7	87.5	153.4	-74.9	-166.4	110.2	0	0	107.7	Q125 H129	Q125-E127 VanDerWaalsContact C-N 3.28Å; Q125-E127 PolarHBondContact O-N 3.16Å; E127-H129 PolarHBondContact O-N 2.94Å
128	E	41.9	Very low	49.9	Very low	144 Å²	144	133 Å²	133	67%	0.673	69%	0.688	S	S	*	*			trans	-72.8	50.1	171.1	-62.7	-165.7	155.9	0	0	110.9	R126	R126-E128 HydrophobicContact CB-CG 3.85Å; R126-E128 IonicContact NH1-OE1 3.49Å; R126-E128 PolarHBondContact NH1-OE1 3.02Å; R126-E128 PolarHBondContact O-N 3.14Å
129	H	45	Very low	48.2	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.787	70%	0.696	S	S	*	*	S	Bend	trans	-159.1	111.6	164.8	-101.7	-58.6	0	0	0	113.5	E127	E127-H129 PolarHBondContact O-N 2.94Å
130	K	44.4	Very low	46.5	Very low	186 Å²	186	134.6 Å²	134.6	81%	0.809	70%	0.698	S	S	*	*			trans	69.5	140.9	177.9	-58	173.4	-179.7	171.8	0	114
131	D	34.7	Very low	45	Very low	142 Å²	142	133.1 Å²	133.1	76%	0.759	70%	0.699	S	S	*	*			cis	-112.1	138.6	10.6	-81.3	-50.9	0	0	0	114.6	S133	D131-S133 PolarHBondContact O-N 3.23Å
132	S	37.5	Very low	43.2	Very low	119 Å²	119	136.1 Å²	136.1	83%	0.832	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	37.2	176.9	62.4	0	0	0	0	113.5
133	S	46.5	Very low	42	Very low	87 Å²	87	133.2 Å²	133.2	61%	0.608	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-35.3	-174.1	-166.8	0	0	0	0	114.1	D131	D131-S133 PolarHBondContact O-N 3.23Å
134	D	43.9	Very low	40.7	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	71%	0.712	S	S	*	*	S	Bend	trans	-85	-25.3	-170.2	-105.4	-27.6	0	0	0	114.7	V136 S137	D134-V136 PolarHBondContact O-N 3.07Å; D134-S137 WeakPolarHBondContact O-CB 3.29Å; D134-S137 PolarHBondContact O-N 3.47Å
135	L	40.8	Very low	39.6	Very low	132 Å²	132	140.4 Å²	140.4	69%	0.691	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-27.9	-178.5	-164.8	66.9	0	0	0	112.6	S137 S138 I139	L135-S137 VanDerWaalsContact C-N 3.31Å; L135-S137 PolarHBondContact O-N 3.04Å; L135-S138 PolarHBondContact O-N 3.48Å; L135-I139 HydrophobicContact CG-CD1 4.26Å
136	V	41	Very low	38.9	Very low	82 Å²	82	143.2 Å²	143.2	50%	0.497	73%	0.727	S	S	.	*	H	α-helix	trans	-67.6	-31.8	178.4	-176.4	0	0	0	0	111.7	D134 S138 I139 L140	D134-V136 PolarHBondContact O-N 3.07Å; V136-S138 PolarHBondContact O-N 3.07Å; V136-I139 PolarHBondContact O-N 3.09Å; V136-L140 HydrophobicContact CG1-CD1 3.9Å
137	S	44.1	Very low	38.9	Very low	75 Å²	75	138.9 Å²	138.9	52%	0.524	73%	0.726	S	S	.	*	H	α-helix	trans	-62.5	-24.5	-179.4	-60.3	0	0	0	0	114	D134 L135	D134-S137 WeakPolarHBondContact O-CB 3.29Å; D134-S137 PolarHBondContact O-N 3.47Å; L135-S137 VanDerWaalsContact C-N 3.31Å; L135-S137 PolarHBondContact O-N 3.04Å
138	S	36.5	Very low	38.5	Very low	92 Å²	92	136.5 Å²	136.5	64%	0.643	73%	0.729	S	S	*	*	H	α-helix	trans	-93.9	-25.1	-179.6	-66.4	0	0	0	0	113.9	L135 V136	L135-S138 PolarHBondContact O-N 3.48Å; V136-S138 PolarHBondContact O-N 3.07Å
139	I	42.1	Very low	37.7	Very low	124 Å²	124	136.5 Å²	136.5	64%	0.636	73%	0.734	S	S	*	*	H	α-helix	trans	-87.4	-26.3	-171.3	-65.5	174.2	0	0	0	112.2	L135 V136 Q141	L135-I139 HydrophobicContact CG-CD1 4.26Å; V136-I139 PolarHBondContact O-N 3.09Å; I139-Q141 VanDerWaalsContact C-N 3.27Å; I139-Q141 PolarHBondContact O-N 3.11Å
140	L	41.1	Very low	37	Very low	131 Å²	131	135.8 Å²	135.8	69%	0.686	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	7.8	-176.2	-81	170.6	0	0	0	116.3	V136	V136-L140 HydrophobicContact CG1-CD1 3.9Å
141	Q	39.7	Very low	36.1	Very low	157 Å²	157	133.9 Å²	133.9	73%	0.734	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-5.1	-177.7	-65	-167.6	23.8	0	0	115.6	I139	I139-Q141 VanDerWaalsContact C-N 3.27Å; I139-Q141 PolarHBondContact O-N 3.11Å
142	F	36.7	Very low	35.8	Very low	205 Å²	205	134.6 Å²	134.6	90%	0.899	73%	0.725	S	S	*	*	S	Bend	trans	-110.7	8.1	-175.2	-85.3	-82.4	0	0	0	116.1
143	A	31.7	Very low	35.4	Very low	74 Å²	74	134.6 Å²	134.6	61%	0.612	73%	0.725	S	S	*	*			trans	-104.9	110.2	-178.7	0	0	0	0	0	114.3
144	T	29.5	Very low	34.5	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	74%	0.737	S	S	*	*			trans	51.6	101.2	149	54.9	0	0	0	0	121.8
145	K	31.2	Very low	33.9	Very low	208 Å²	208	135.2 Å²	135.2	90%	0.904	74%	0.74	S	S	*	*				45.4	142.4	120.3	-62.8	177.8	-179.3	175.1	0	122.5
146	R	26.8	Very low	33.4	Very low	238 Å²	238	136.5 Å²	136.5	90%	0.898	75%	0.747	S	S	*	*			trans	-57.2	177.6	162.4	-53.6	178.7	177.2	178.2	-1.9	113.5
147	P	47.2	Very low	33	Very low	116 Å²	116	137 Å²	137	75%	0.753	75%	0.754	S	S	*	*				-139.5	158.8	-54.1	39	-23	0	0	0	114.1
148	S	26.7	Very low	32.5	Very low	125 Å²	125	138.5 Å²	138.5	87%	0.874	77%	0.765	S	S	*	*			trans	-164.3	154.3	158.4	42.9	0	0	0	0	117.5
149	N	24.8	Very low	32.3	Very low	145 Å²	145	141.7 Å²	141.7	78%	0.775	77%	0.774	S	S	*	*			trans	-37.4	147.2	175.8	-66.1	-36.2	0	0	0	121.5
150	K	30	Very low	31.6	Very low	155 Å²	155	140.4 Å²	140.4	67%	0.674	78%	0.776	S	S	*	*				45.8	130.9	127.4	-66.6	167.8	146.5	-90.3	0	121.8
151	E	26.1	Very low	31.2	Very low	146 Å²	146	139 Å²	139	68%	0.682	78%	0.777	S	S	*	*			trans	68.9	148.2	136.3	-69	158.8	-132.8	0	0	117.2
152	L	27.2	Very low	30.8	Very low	156 Å²	156	137.7 Å²	137.7	82%	0.817	78%	0.78	S	S	*	*			cis	-130.2	171.6	3.3	-74.4	174.6	0	0	0	111.5
153	S	30.1	Very low	30.8	Very low	120 Å²	120	132.2 Å²	132.2	84%	0.839	77%	0.767	S	S	*	*			trans	-70	152.6	162.9	-52.8	0	0	0	0	112.8
154	S	27.5	Very low	31	Very low	121 Å²	121	136.2 Å²	136.2	85%	0.846	77%	0.774	S	S	*	*			trans	-151.7	147.2	142.8	60.3	0	0	0	0	110.8
155	S	32.1	Very low	31.1	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	78%	0.776	S	S	*	*			trans	-144.2	136.1	173.5	-62.4	0	0	0	0	108.2
156	N	29.7	Very low	31.2	Very low	159 Å²	159	130.4 Å²	130.4	85%	0.85	76%	0.764	S	S	*	*			trans	173.6	119.9	158.8	-87.2	-23.5	0	0	0	105.6
157	S	32.9	Very low	31.4	Very low	92 Å²	92	125.8 Å²	125.8	64%	0.643	76%	0.756	S	S	*	*			cis	95.5	152.4	45.4	73.2	0	0	0	0	112.9
158	S	33.2	Very low	30.4	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	76%	0.755	S	S	*	*			trans	80.3	144.2	177.8	-53.2	0	0	0	0	115.8
159	L	31.2	Very low	30.5	Very low	159 Å²	159	126.6 Å²	126.6	83%	0.832	75%	0.748	S	S	*	*			cis	-156.2	175.3	-5.4	-117.9	170.5	0	0	0	112.4
160	S	29.3	Very low	30.6	Very low	98 Å²	98	126 Å²	126	69%	0.685	75%	0.75	S	S	*	*			trans	-89	165.3	-168.1	-39.4	0	0	0	0	116.6
161	S	32.7	Very low	30.6	Very low	101 Å²	101	123.7 Å²	123.7	71%	0.706	75%	0.753	S	S	*	*				145.9	144	118.5	-73.6	0	0	0	0	116.8
162	T	29.5	Very low	31.8	Very low	130 Å²	130	121.9 Å²	121.9	80%	0.798	75%	0.754	S	S	*	*			trans	52.5	141.7	148.8	51.9	0	0	0	0	121.2
163	S	36.6	Very low	31.8	Very low	90 Å²	90	121.8 Å²	121.8	63%	0.629	75%	0.754	S	S	*	*			cis	-174.5	-162.3	-14.9	47.6	0	0	0	0	106.7
164	E	37.8	Very low	32.2	Very low	158 Å²	158	122.1 Å²	122.1	74%	0.738	75%	0.752	S	S	*	*			cis	-165.8	-176.9	4.8	-147	150.7	114.3	0	0	111.3
165	T	31.5	Very low	32.9	Very low	133 Å²	133	122 Å²	122	82%	0.816	75%	0.748	S	S	*	*			trans	70.9	147.9	167.5	69.3	0	0	0	0	119.9
166	A	32.4	Very low	32.8	Very low	79 Å²	79	125.4 Å²	125.4	65%	0.653	75%	0.751	S	S	*	*			cis	-168	169.1	-26.2	0	0	0	0	0	110
167	N	30.2	Very low	32.7	Very low	140 Å²	140	123.6 Å²	123.6	75%	0.749	75%	0.752	S	S	*	*			trans	68.4	142.6	169.6	-73.6	52.9	0	0	0	117
168	E	27.7	Very low	32.7	Very low	154 Å²	154	123.7 Å²	123.7	72%	0.72	76%	0.758	S	S	*	*			cis	-165	141.7	-11.8	-159.1	173.9	144.5	0	0	111.5
169	S	27.4	Very low	33.5	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	75%	0.75	S	S	*	*			trans	61.1	162.5	161.6	74.3	0	0	0	0	119.7
170	T	27.3	Very low	33.7	Very low	132 Å²	132	125.9 Å²	125.9	81%	0.81	75%	0.75	S	S	*	*			cis	-162.3	148	-34.2	-83.5	0	0	0	0	108
171	S	30.9	Very low	33.8	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	75%	0.752	S	S	*	*			trans	-124.5	178.4	172.5	-44.5	0	0	0	0	109.9
172	P	50.1	Low	33.9	Very low	107 Å²	107	132.6 Å²	132.6	70%	0.695	76%	0.758	S	S	*	*			cis	-130.6	-161.6	-10.4	42	-24.6	0	0	0	111.9
173	N	26.9	Very low	34.3	Very low	154 Å²	154	137.4 Å²	137.4	82%	0.824	76%	0.761	S	S	*	*				178	154.7	127.5	-90	-26.1	0	0	0	113.5
174	T	39.1	Very low	34.3	Very low	128 Å²	128	145.1 Å²	145.1	79%	0.785	78%	0.777	S	S	*	*			trans	-121.8	165.6	170.2	60.5	0	0	0	0	109.4
175	P	43.4	Very low	34.3	Very low	118 Å²	118	141.2 Å²	141.2	77%	0.766	78%	0.779	S	S	*	*				-150.6	148.1	86.6	37.8	-18.6	0	0	0	117.9
176	E	29.5	Very low	34.6	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	78%	0.779	S	S	*	*			trans	12.2	125.7	134.9	-174	170.7	-136.5	0	0	121.7
177	S	26.5	Very low	34.8	Very low	122 Å²	122	144 Å²	144	85%	0.853	79%	0.792	S	S	*	*			trans	-177.3	149	132.2	-83.8	0	0	0	0	113.7
178	A	33.3	Very low	35.3	Very low	93 Å²	93	142.2 Å²	142.2	77%	0.769	79%	0.791	S	S	*	*			trans	-116.5	-178.1	164.8	0	0	0	0	0	108.5
179	P	49.3	Very low	36.1	Very low	91 Å²	91	140.7 Å²	140.7	59%	0.591	79%	0.792	S	S	*	*			cis	-147.1	-170.1	5.9	45.2	-25.2	0	0	0	116.6
180	R	36.8	Very low	37	Very low	221 Å²	221	142.5 Å²	142.5	83%	0.834	79%	0.794	S	S	*	*			trans	68.1	126.1	145.3	-78.7	174.7	-169.2	120.2	1.3	122.9
181	V	31.7	Very low	37.7	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.715	79%	0.785	S	S	*	*				92.8	119.8	120.7	167.7	0	0	0	0	123.1
182	R	33.9	Very low	38.3	Very low	223 Å²	223	141.5 Å²	141.5	84%	0.842	78%	0.781	S	S	*	*			trans	74.3	120.2	145.8	-83.6	173.1	-176.9	-159.3	1.6	124.2
183	R	37.7	Very low	37.9	Very low	230 Å²	230	142 Å²	142	87%	0.868	78%	0.782	S	S	*	*				49.7	99.3	124.7	-66.2	-173.9	176.6	-147.6	1.1	120.6
184	R	36.2	Very low	38.8	Very low	253 Å²	253	141.3 Å²	141.3	96%	0.955	78%	0.778	S	S	*	*				-172.8	158.2	111.6	-96.9	172.7	-172.1	-114.8	4.5	106.1
185	G	38.6	Very low	39.2	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	77%	0.767	S	S	*	*			cis	126.5	90.2	10.1	0	0	0	0	0	108.8
186	G	38.3	Very low	39.5	Very low	80 Å²	80	141.6 Å²	141.6	83%	0.825	77%	0.768	S	S	*	*			trans	123.9	105.4	-169.4	0	0	0	0	0	110.8
187	M	35.5	Very low	40.5	Very low	190 Å²	190	136.9 Å²	136.9	94%	0.936	75%	0.749	S	S	*	*			trans	-100.4	144.6	165	-72.7	175.7	65.5	0	0	108.3
188	S	41.4	Very low	41.5	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	73%	0.733	S	S	*	*			trans	-74.7	151.8	-177.5	42.6	0	0	0	0	112.6	D190	S188-D190 VanDerWaalsContact C-N 3.26Å; S188-D190 PolarHBondContact O-N 3.15Å
189	V	44.5	Very low	42.1	Very low	122 Å²	122	138.7 Å²	138.7	74%	0.739	73%	0.731	S	S	*	*	S	Bend	trans	-86.1	64.5	-179.5	-170.7	0	0	0	0	110.1	I192	V189-I192 HydrophobicContact CG1-CD1 4.31Å
190	D	46.9	Very low	42.4	Very low	142 Å²	142	137.5 Å²	137.5	76%	0.759	73%	0.725	S	S	*	*			trans	-146.3	58	178.9	-91.8	-49.2	0	0	0	111.3	S188	S188-D190 VanDerWaalsContact C-N 3.26Å; S188-D190 PolarHBondContact O-N 3.15Å
191	S	41	Very low	43	Very low	89 Å²	89	133.5 Å²	133.5	62%	0.622	71%	0.71	S	S	*	*			trans	-150.3	42.6	169.2	-55.7	0	0	0	0	110.5	T193	S191-T193 PolarHBondContact O-N 3.19Å
192	I	43	Very low	43.9	Very low	131 Å²	131	133.3 Å²	133.3	67%	0.672	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	59.3	-179.4	-47.6	-178.9	0	0	0	109.4	V189 L195	V189-I192 HydrophobicContact CG1-CD1 4.31Å; I192-L195 HydrophobicContact CG2-CD1 4.4Å
193	T	42.8	Very low	44.8	Very low	117 Å²	117	128 Å²	128	72%	0.718	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	-24.1	178.6	48	0	0	0	0	113.4	S191	S191-T193 PolarHBondContact O-N 3.19Å
194	D	45.8	Very low	45.7	Very low	139 Å²	139	122.4 Å²	122.4	74%	0.743	68%	0.675	S	S	*	*			trans	-109.7	75.2	-179.2	-61.6	-54.5	0	0	0	111
195	L	46.8	Very low	46.3	Very low	105 Å²	105	113.1 Å²	113.1	55%	0.55	65%	0.653	S	S	.	*			trans	-128.4	14.8	-172.8	-94.3	175.3	0	0	0	117.1	I192 N198	I192-L195 HydrophobicContact CG2-CD1 4.4Å; L195-N198 VanDerWaalsContact CD2-ND2 3.32Å; L195-N198 WeakPolarHBondContact CD2-ND2 3.47Å
196	D	50.2	Low	46.9	Very low	147 Å²	147	114.3 Å²	114.3	79%	0.786	64%	0.641	S	S	*	*	S	Bend	trans	-86	-21	172.6	-70.2	-62.1	0	0	0	113.8	N198	D196-N198 PolarHBondContact O-N 3.42Å; D196-N198 VanDerWaalsContact O-N 3.13Å
197	D	51	Low	47.7	Very low	84 Å²	84	117.3 Å²	117.3	45%	0.449	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-10	-171.3	-130.5	21.5	0	0	0	114.6	Q199 S200 R201	D197-Q199 PolarHBondContact O-N 3.17Å; D197-S200 WeakPolarHBondContact O-CB 3.26Å; D197-S200 PolarHBondContact O-N 3.43Å; D197-R201 PolarHBondContact O-N 3.19Å; D197-R201 VanDerWaalsContact O-N 3.14Å; D197-R201 IonicContact OD2-CZ 2.76Å; D197-R201 IonicContact OD2-NE 3.64Å; D197-R201 IonicContact OD2-NH2 3.32Å; D197-R201 PolarHBondContact OD2-NH2 3.21Å
198	N	46.8	Very low	48.1	Very low	99 Å²	99	114.8 Å²	114.8	53%	0.529	62%	0.623	S	S	.	*	H	α-helix	trans	-73.2	-23.8	-174.1	-80.9	-21.8	0	0	0	113.8	L195 D196 L202	L195-N198 VanDerWaalsContact CD2-ND2 3.32Å; L195-N198 WeakPolarHBondContact CD2-ND2 3.47Å; D196-N198 PolarHBondContact O-N 3.42Å; D196-N198 VanDerWaalsContact O-N 3.13Å; N198-L202 PolarHBondContact O-N 2.99Å
199	Q	46.5	Very low	47.9	Very low	154 Å²	154	113.9 Å²	113.9	72%	0.72	62%	0.617	S	S	*	*	H	α-helix	trans	-71.7	-44.4	171.4	-59.1	-166.5	35.2	0	0	110.4	D197 R201 L202 L203	D197-Q199 PolarHBondContact O-N 3.17Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 2.84Å; Q199-L202 PolarHBondContact O-N 3.12Å; Q199-L203 WeakPolarHBondContact O-CG 3.4Å; Q199-L203 PolarHBondContact O-N 3.29Å
200	S	56.1	Low	48.1	Very low	66 Å²	66	114 Å²	114	46%	0.462	61%	0.613	S	S	.	*	H	α-helix	trans	-54.6	-47	176.1	-46.4	0	0	0	0	111.9	D197 L203 E204	D197-S200 WeakPolarHBondContact O-CB 3.26Å; D197-S200 PolarHBondContact O-N 3.43Å; S200-L203 PolarHBondContact O-N 3.08Å; S200-E204 WeakPolarHBondContact O-CB 3.49Å; S200-E204 PolarHBondContact O-N 2.9Å
201	R	48.1	Very low	47.6	Very low	137 Å²	137	112.7 Å²	112.7	52%	0.517	61%	0.611	S	S	.	*	H	α-helix	trans	-70.2	-32.3	-179.5	-67	-179.8	-169.3	-68.7	-12.3	113.8	D197 Q199 A205	D197-R201 PolarHBondContact O-N 3.19Å; D197-R201 VanDerWaalsContact O-N 3.14Å; D197-R201 IonicContact OD2-CZ 2.76Å; D197-R201 IonicContact OD2-NE 3.64Å; D197-R201 IonicContact OD2-NH2 3.32Å; D197-R201 PolarHBondContact OD2-NH2 3.21Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 2.84Å; R201-A205 VanDerWaalsContact O-CB 3.27Å; R201-A205 WeakPolarHBondContact O-CB 3.14Å; R201-A205 PolarHBondContact O-N 3.31Å
202	L	51.6	Low	47.4	Very low	114 Å²	114	113 Å²	113	60%	0.597	62%	0.62	S	S	*	*	H	α-helix	trans	-71.2	-40.7	175.2	-173.4	65.8	0	0	0	111.1	N198 Q199 A205 L206	N198-L202 PolarHBondContact O-N 2.99Å; Q199-L202 PolarHBondContact O-N 3.12Å; L202-A205 PolarHBondContact O-N 3.33Å; L202-L206 HydrophobicContact CG-CD1 4.32Å; L202-L206 WeakPolarHBondContact O-CB 3.45Å; L202-L206 WeakPolarHBondContact O-CG 3.22Å; L202-L206 PolarHBondContact O-N 2.84Å
203	L	52.8	Low	47	Very low	111 Å²	111	113 Å²	113	58%	0.581	62%	0.616	S	S	*	*	H	α-helix	trans	-63.1	-45.8	173.1	-70.1	168	0	0	0	111.2	Q199 S200 A205 L206 Q207	Q199-L203 WeakPolarHBondContact O-CG 3.4Å; Q199-L203 PolarHBondContact O-N 3.29Å; S200-L203 PolarHBondContact O-N 3.08Å; L203-A205 PolarHBondContact O-N 2.94Å; L203-L206 PolarHBondContact O-N 3.35Å; L203-Q207 WeakPolarHBondContact O-CB 3.4Å; L203-Q207 PolarHBondContact O-N 2.68Å
204	E	56.1	Low	46.6	Very low	113 Å²	113	113.3 Å²	113.3	53%	0.528	62%	0.619	S	S	.	*	H	α-helix	trans	-59.1	-45	175	-174.5	178.1	-147.5	0	0	112	S200 L206 Q207 L208	S200-E204 WeakPolarHBondContact O-CB 3.49Å; S200-E204 PolarHBondContact O-N 2.9Å; E204-L206 PolarHBondContact O-N 2.98Å; E204-Q207 WeakPolarHBondContact O-CB 3.36Å; E204-Q207 PolarHBondContact O-N 2.73Å; E204-L208 HydrophobicContact CG-CD1 4.17Å; E204-L208 WeakPolarHBondContact O-CB 3.3Å; E204-L208 VanDerWaalsContact O-CG 3.29Å; E204-L208 WeakPolarHBondContact O-CG 3.47Å; E204-L208 PolarHBondContact O-N 3.03Å
205	A	48.3	Very low	46.1	Very low	58 Å²	58	116 Å²	116	48%	0.479	63%	0.627	S	S	.	*	H	α-helix	trans	-65.2	-36	176.7	0	0	0	0	0	113.2	R201 L202 L203 L208 S209	R201-A205 VanDerWaalsContact O-CB 3.27Å; R201-A205 WeakPolarHBondContact O-CB 3.14Å; R201-A205 PolarHBondContact O-N 3.31Å; L202-A205 PolarHBondContact O-N 3.33Å; L203-A205 PolarHBondContact O-N 2.94Å; A205-L208 PolarHBondContact O-N 2.81Å; A205-S209 PolarHBondContact O-N 3.21Å
206	L	52.1	Low	45.4	Very low	100 Å²	100	115.5 Å²	115.5	52%	0.524	63%	0.632	S	S	.	*	H	α-helix	trans	-68.8	-41.9	172.6	-75.4	166.1	0	0	0	111.4	L202 L203 E204 L208 S209	L202-L206 HydrophobicContact CG-CD1 4.32Å; L202-L206 WeakPolarHBondContact O-CB 3.45Å; L202-L206 WeakPolarHBondContact O-CG 3.22Å; L202-L206 PolarHBondContact O-N 2.84Å; L203-L206 PolarHBondContact O-N 3.35Å; E204-L206 PolarHBondContact O-N 2.98Å; L206-L208 PolarHBondContact O-N 3.14Å; L206-S209 WeakPolarHBondContact O-CB 3.07Å; L206-S209 PolarHBondContact O-N 2.82Å; L206-S209 PolarHBondContact O-OG 3.09Å
207	Q	54.1	Low	44.9	Very low	143 Å²	143	118.7 Å²	118.7	67%	0.668	64%	0.639	S	S	*	*	H	α-helix	trans	-56.3	-40	174.4	-146	83.6	-16.7	0	0	111.4	L203 E204 S209	L203-Q207 WeakPolarHBondContact O-CB 3.4Å; L203-Q207 PolarHBondContact O-N 2.68Å; E204-Q207 WeakPolarHBondContact O-CB 3.36Å; E204-Q207 PolarHBondContact O-N 2.73Å; Q207-S209 VanDerWaalsContact C-N 3.33Å
208	L	44.2	Very low	44.3	Very low	136 Å²	136	123.7 Å²	123.7	71%	0.712	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-8	178	-69	169	0	0	0	114.3	E204 A205 L206	E204-L208 HydrophobicContact CG-CD1 4.17Å; E204-L208 WeakPolarHBondContact O-CB 3.3Å; E204-L208 VanDerWaalsContact O-CG 3.29Å; E204-L208 WeakPolarHBondContact O-CG 3.47Å; E204-L208 PolarHBondContact O-N 3.03Å; A205-L208 PolarHBondContact O-N 2.81Å; L206-L208 PolarHBondContact O-N 3.14Å
209	S	38.2	Very low	43.7	Very low	85 Å²	85	127.5 Å²	127.5	59%	0.594	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-10.2	176.8	76.3	0	0	0	0	113.8	A205 L206 Q207	A205-S209 PolarHBondContact O-N 3.21Å; L206-S209 WeakPolarHBondContact O-CB 3.07Å; L206-S209 PolarHBondContact O-N 2.82Å; L206-S209 PolarHBondContact O-OG 3.09Å; Q207-S209 VanDerWaalsContact C-N 3.33Å
210	L	48.1	Very low	43.4	Very low	125 Å²	125	129.2 Å²	129.2	65%	0.654	68%	0.677	S	S	*	*	S	Bend	trans	-64.2	133.9	167.2	-70.2	168.9	0	0	0	109.6	A212	L210-A212 PolarHBondContact O-N 3.22Å; L210-A212 VanDerWaalsContact O-N 3.07Å
211	P	35.1	Very low	42.4	Very low	113 Å²	113	133.1 Å²	133.1	73%	0.734	69%	0.687	S	S	*	*			trans	-63.7	116.3	-176	25.3	-33.7	0	0	0	110.6	E213	P211-E213 PolarHBondContact O-N 2.83Å
212	A	37.6	Very low	41.9	Very low	96 Å²	96	134.6 Å²	134.6	79%	0.793	69%	0.693	S	S	*	*			trans	-64.6	97.4	179	0	0	0	0	0	110.8	L210 T214	L210-A212 PolarHBondContact O-N 3.22Å; L210-A212 VanDerWaalsContact O-N 3.07Å; A212-T214 PolarHBondContact O-N 2.78Å
213	E	35.2	Very low	41.7	Very low	130 Å²	130	135 Å²	135	61%	0.607	70%	0.695	S	S	*	*			trans	-59.8	105.7	175.9	-70.2	-175.9	142.8	0	0	110.6	P211 Q215 R222	P211-E213 PolarHBondContact O-N 2.83Å; E213-Q215 PolarHBondContact O-N 3.22Å; E213-R222 IonicContact OE1-CZ 3.94Å; E213-R222 IonicContact OE1-NH1 3.6Å; E213-R222 IonicContact OE1-NH2 3.34Å; E213-R222 PolarHBondContact OE1-NH2 2.95Å; E213-R222 IonicContact OE2-CZ 2.67Å; E213-R222 IonicContact OE2-NH1 3.76Å; E213-R222 PolarHBondContact OE2-NH1 2.93Å; E213-R222 IonicContact OE2-NH2 3.27Å; E213-R222 PolarHBondContact OE2-NH2 3.11Å
214	T	35.1	Very low	41.9	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	70%	0.698	S	S	*	*			trans	-58.8	130.6	176.5	54.2	0	0	0	0	110.1	A212 S216	A212-T214 PolarHBondContact O-N 2.78Å; T214-S216 PolarHBondContact O-N 3.46Å
215	Q	34.1	Very low	42.2	Very low	195 Å²	195	143 Å²	143	91%	0.911	72%	0.717	S	S	*	*			trans	-68.8	71.3	-174.6	-65.7	-176.5	-1.9	0	0	113	E213 K217	E213-Q215 PolarHBondContact O-N 3.22Å; Q215-K217 PolarHBondContact O-N 3.42Å
216	S	31.9	Very low	43.6	Very low	96 Å²	96	143 Å²	143	67%	0.671	71%	0.709	S	S	*	*			trans	-72.3	124.4	172.3	64.2	0	0	0	0	109.9	T214 K218	T214-S216 PolarHBondContact O-N 3.46Å; S216-K218 PolarHBondContact O-N 3.08Å
217	K	39.6	Very low	44.9	Very low	213 Å²	213	140.6 Å²	140.6	93%	0.926	70%	0.7	S	S	*	*	S	Bend	trans	-74.1	70.9	-176.5	-73.6	-178.7	176.3	174	0	112.4	Q215	Q215-K217 PolarHBondContact O-N 3.42Å
218	K	38.8	Very low	45.8	Very low	190 Å²	190	136.2 Å²	136.2	83%	0.826	68%	0.681	S	S	*	*			trans	-161.1	80.8	162.5	-107.5	170.4	-175.2	179.9	0	108.8	S216 K220	S216-K218 PolarHBondContact O-N 3.08Å; K218-K220 PolarHBondContact O-N 2.86Å
219	E	35.1	Very low	47.2	Very low	178 Å²	178	134.6 Å²	134.6	83%	0.832	67%	0.673	S	S	*	*			trans	-68.2	81.3	172.4	-169.6	179.7	-175.7	0	0	109.6
220	K	39.4	Very low	48.8	Very low	191 Å²	191	133 Å²	133	83%	0.83	66%	0.66	S	S	*	*			trans	-63.6	132.4	164.5	-168.6	-176.6	-179	-169.9	0	106.6	K218 R222	K218-K220 PolarHBondContact O-N 2.86Å; K220-R222 PolarHBondContact O-N 3.48Å
221	H	35.9	Very low	49.9	Very low	148 Å²	148	128.2 Å²	128.2	69%	0.685	64%	0.635	S	S	*	*			trans	-34.4	100.8	-171.7	-162.7	-99.8	0	0	0	112.5	D223	H221-D223 IonicContact CE1-OD1 3.39Å; H221-D223 PolarHBondContact CE1-OD1 3.47Å; H221-D223 IonicContact CG-OD1 3.54Å; H221-D223 IonicContact ND1-OD1 2.79Å; H221-D223 PolarHBondContact ND1-OD1 3.46Å; H221-D223 PolarHBondContact O-N 3.48Å
222	R	37.7	Very low	51.4	Low	167 Å²	167	130.6 Å²	130.6	63%	0.63	63%	0.631	S	S	*	*			trans	-74.9	106.1	166	-98.5	-168.7	150.1	142.4	5.7	106.5	E213 K220 K224	E213-R222 IonicContact OE1-CZ 3.94Å; E213-R222 IonicContact OE1-NH1 3.6Å; E213-R222 IonicContact OE1-NH2 3.34Å; E213-R222 PolarHBondContact OE1-NH2 2.95Å; E213-R222 IonicContact OE2-CZ 2.67Å; E213-R222 IonicContact OE2-NH1 3.76Å; E213-R222 PolarHBondContact OE2-NH1 2.93Å; E213-R222 IonicContact OE2-NH2 3.27Å; E213-R222 PolarHBondContact OE2-NH2 3.11Å; K220-R222 PolarHBondContact O-N 3.48Å; R222-K224 PolarHBondContact O-N 3.16Å
223	D	45.6	Very low	53.4	Low	122 Å²	122	131.5 Å²	131.5	65%	0.652	61%	0.614	S	S	*	*			trans	-57.8	129.8	177.9	-57.7	-56.9	0	0	0	109.2	H221 R225	H221-D223 IonicContact CE1-OD1 3.39Å; H221-D223 PolarHBondContact CE1-OD1 3.47Å; H221-D223 IonicContact CG-OD1 3.54Å; H221-D223 IonicContact ND1-OD1 2.79Å; H221-D223 PolarHBondContact ND1-OD1 3.46Å; H221-D223 PolarHBondContact O-N 3.48Å; D223-R225 PolarHBondContact O-N 2.72Å
224	K	57.9	Low	55.9	Low	145 Å²	145	126.3 Å²	126.3	63%	0.63	59%	0.59	S	S	*	*			trans	-63.4	108.3	177.3	-67.6	-178.2	177.4	-174.9	0	106.9	Q70 R222 L226	Q70-K224 VanDerWaalsContact OE1-NZ 3.08Å; R222-K224 PolarHBondContact O-N 3.16Å; K224-L226 PolarHBondContact O-N 3.42Å
225	R	63.4	Low	58.7	Low	249 Å²	249	121.7 Å²	121.7	94%	0.94	56%	0.561	S	S	*	*			trans	-58	105.3	171.2	-78.7	-173.9	166.9	-174.3	-6	108.2	D223	D223-R225 PolarHBondContact O-N 2.72Å
226	L	77.6	Confident	61.6	Low	58 Å²	58	112.4 Å²	112.4	30%	0.304	52%	0.518	S	S	.	.			trans	-67.6	144.8	179.3	-57.4	-177.2	0	0	0	109.1	E39 L40 A43 K224 L228	E39-L226 HydrophobicContact CB-CB 4.22Å; E39-L226 HydrophobicContact CG-CB 4.07Å; E39-L226 HydrophobicContact CG-CD2 4.12Å; E39-L226 HydrophobicContact CG-CG 4.49Å; L40-L226 HydrophobicContact CB-CB 4.09Å; L40-L226 HydrophobicContact CD1-CD1 4.07Å; A43-L226 HydrophobicContact CB-CD1 3.46Å; A43-L226 VanDerWaalsContact CB-CD1 3.46Å; K224-L226 PolarHBondContact O-N 3.42Å; L226-L228 PolarHBondContact O-N 2.73Å
227	S	77.8	Confident	64.5	Low	49 Å²	49	109.5 Å²	109.5	34%	0.343	49%	0.492	S	S	.	.			trans	-68.9	132.2	-178.2	54.1	0	0	0	0	111.8	S38 E39 N229	S38-S227 WeakPolarHBondContact CB-O 3.35Å; E39-S227 WeakPolarHBondContact CB-O 3.34Å; E39-S227 VanDerWaalsContact CB-OG 3.3Å; E39-S227 WeakPolarHBondContact CB-OG 3.48Å; E39-S227 PolarHBondContact N-O 2.85Å; E39-S227 VanDerWaalsContact N-O 3.13Å; E39-S227 WeakPolarHBondContact OE2-CB 3.03Å; E39-S227 PolarHBondContact OE2-N 2.69Å; E39-S227 PolarHBondContact OE2-OG 2.82Å; S227-N229 VanDerWaalsContact C-N 3.27Å
228	L	74.6	Confident	67.2	Low	51 Å²	51	99.5 Å²	99.5	27%	0.267	45%	0.449	S	S	.	.	S	Bend	trans	-81.5	-5.8	173.5	-59.5	-174.6	0	0	0	113	S38 L40 L226 V448 Y451 R455	S38-L228 WeakPolarHBondContact CB-O 3.13Å; L40-L228 HydrophobicContact CB-CD2 4.17Å; L40-L228 HydrophobicContact CD2-CD2 3.58Å; L226-L228 PolarHBondContact O-N 2.73Å; L228-V448 HydrophobicContact CD1-CG1 4.24Å; L228-V448 HydrophobicContact CD1-CG2 4.21Å; L228-V448 HydrophobicContact CD2-CG1 3.59Å; L228-V448 HydrophobicContact CD2-CG2 4.46Å; L228-Y451 HydrophobicContact CB-CD1 4.19Å; L228-Y451 HydrophobicContact CB-CE1 3.79Å; L228-Y451 HydrophobicContact CD1-CD1 4Å; L228-Y451 HydrophobicContact CD1-CE1 4.32Å; L228-Y451 HydrophobicContact CD1-CG 4.5Å; L228-R455 PolarHBondContact O-NH1 3.37Å
229	N	73.5	Confident	70	Confident	102 Å²	102	90.4 Å²	90.4	55%	0.545	41%	0.409	S	S	.	.	S	Bend	trans	-82.9	150.3	173.4	-69	-15.6	0	0	0	110.3	S38 S227	S38-N229 WeakPolarHBondContact CA-O 3.32Å; S227-N229 VanDerWaalsContact C-N 3.27Å
230	P	70.5	Confident	72.8	Confident	50 Å²	50	84.4 Å²	84.4	33%	0.325	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-56.3	140.8	170.5	-23.9	35	0	0	0	111.6	Y232	P230-Y232 PolarHBondContact O-N 3.17Å
231	I	70.8	Confident	75.5	Confident	25 Å²	25	76.9 Å²	76.9	13%	0.128	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-79.2	122.6	177.7	-40.1	-179.9	0	0	0	109.8	E39 R233 Q234 A338	E39-I231 HydrophobicContact CB-CD1 3.99Å; E39-I231 HydrophobicContact CB-CG1 4.09Å; E39-I231 HydrophobicContact CG-CD1 4.17Å; I231-R233 PolarHBondContact O-N 3.5Å; I231-Q234 HydrophobicContact CG2-CG 3.76Å; I231-A338 HydrophobicContact CD1-CB 4.11Å
232	Y	68.4	Low	78.5	Confident	163 Å²	163	69.9 Å²	69.9	64%	0.639	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-52.2	126.5	168.3	-64.7	-82	0	0	0	111.2	P230 Q234 N495	P230-Y232 PolarHBondContact O-N 3.17Å; Y232-Q234 WeakPolarHBondContact O-CG 3.19Å; Y232-Q234 PolarHBondContact O-N 3.39Å; Y232-Q234 VanDerWaalsContact O-N 3.07Å; Y232-N495 PolarHBondContact OH-O 3.46Å
233	R	78.6	Confident	81.3	Confident	115 Å²	115	61.9 Å²	61.9	43%	0.434	29%	0.292	S	S	.	.			trans	-37	112.3	-177.4	-94.5	-166.6	179.7	-158.8	0.6	111	Q35 I231 V235 E349	Q35-R233 HydrophobicContact CB-CG 4.38Å; Q35-R233 HydrophobicContact CG-CG 4.24Å; I231-R233 PolarHBondContact O-N 3.5Å; R233-V235 VanDerWaalsContact C-N 3.33Å; R233-V235 HydrophobicContact CB-CG2 4.42Å; R233-V235 PolarHBondContact O-N 2.66Å; R233-E349 IonicContact CZ-OE1 2.73Å; R233-E349 IonicContact CZ-OE2 3.84Å; R233-E349 IonicContact NH1-OE1 2.63Å; R233-E349 PolarHBondContact NH1-OE1 3.01Å; R233-E349 IonicContact NH1-OE2 3.3Å; R233-E349 PolarHBondContact NH1-OE2 2.89Å; R233-E349 IonicContact NH2-OE1 3.76Å; R233-E349 PolarHBondContact NH2-OE1 3.07Å; R233-E349 IonicContact NH2-OE2 3.72Å
234	Q	88.6	Confident	83.8	Confident	22 Å²	22	60.6 Å²	60.6	10%	0.103	28%	0.282	C	S	.	.			trans	-87.7	67.4	-172.1	-59.5	-161	100.6	0	0	112.1	I106 I231 Y232 A338 C339 D342 T343	I106-Q234 HydrophobicContact CD1-CB 4.28Å; I106-Q234 VanDerWaalsContact CD1-O 3.23Å; I106-Q234 WeakPolarHBondContact CD1-O 3.35Å; I231-Q234 HydrophobicContact CG2-CG 3.76Å; Y232-Q234 WeakPolarHBondContact O-CG 3.19Å; Y232-Q234 PolarHBondContact O-N 3.39Å; Y232-Q234 VanDerWaalsContact O-N 3.07Å; Q234-A338 VanDerWaalsContact NE2-CB 3.32Å; Q234-C339 HydrophobicContact CB-CB 4.45Å; Q234-D342 HydrophobicContact CB-CB 4.16Å; Q234-D342 WeakPolarHBondContact CB-OD2 3.41Å; Q234-D342 PolarHBondContact N-OD2 3.45Å; Q234-T343 PolarHBondContact O-OG1 2.93Å; Q234-T343 VanDerWaalsContact O-OG1 3.12Å
235	V	93.7	Very high	85.7	Confident	26 Å²	26	54 Å²	54	16%	0.158	25%	0.253	C	S	.	.			trans	-113	134.2	-178.1	-171.3	0	0	0	0	110.6	R233 V239 D240 D342 R346	R233-V235 VanDerWaalsContact C-N 3.33Å; R233-V235 HydrophobicContact CB-CG2 4.42Å; R233-V235 PolarHBondContact O-N 2.66Å; V235-V239 HydrophobicContact CG1-CB 4.07Å; V235-V239 HydrophobicContact CG1-CG1 4.06Å; V235-D240 HydrophobicContact CG1-CB 4.2Å; V235-D342 HydrophobicContact CG2-CB 4.4Å; V235-R346 HydrophobicContact CG1-CB 4.27Å; V235-R346 HydrophobicContact CG1-CG 4.2Å; V235-R346 HydrophobicContact CG2-CB 4Å
236	P	94.8	Very high	87.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.			trans	-62.6	144.6	171.8	-23	33	0	0	0	113.2	L102 V105 I106 V238 V239 D240 F297 T343	L102-P236 HydrophobicContact CD1-CG 3.36Å; V105-P236 HydrophobicContact CG1-CB 3.85Å; V105-P236 HydrophobicContact CG1-CG 4.34Å; I106-P236 HydrophobicContact CD1-CG 4.46Å; I106-P236 HydrophobicContact CG1-CG 4.07Å; P236-V238 VanDerWaalsContact C-N 3.26Å; P236-V238 PolarHBondContact O-N 3.47Å; P236-V239 HydrophobicContact CB-CG2 4.2Å; P236-V239 HydrophobicContact CG-CG2 4.17Å; P236-V239 PolarHBondContact O-N 2.77Å; P236-V239 VanDerWaalsContact O-N 3.09Å; P236-D240 PolarHBondContact O-N 2.82Å; P236-D240 VanDerWaalsContact O-N 3.11Å; P236-F297 HydrophobicContact CB-CZ 4.02Å; P236-F297 HydrophobicContact CG-CE1 4.19Å; P236-F297 HydrophobicContact CG-CZ 3.87Å; P236-T343 VanDerWaalsContact CD-OG1 3.29Å; P236-T343 WeakPolarHBondContact CD-OG1 3.36Å
237	R	93.1	Very high	88.2	Confident	35 Å²	35	41.8 Å²	41.8	13%	0.132	21%	0.205	C	C	.	.	H	α-helix	trans	-57.5	-38.6	174.3	-80.1	170.3	50	-118.1	11.2	112.1	D109 H112 V239 D240 S241 D278	D109-R237 HydrophobicContact CB-CG 4.34Å; D109-R237 VanDerWaalsContact OD1-CD 3.3Å; D109-R237 WeakPolarHBondContact OD1-CD 3.47Å; D109-R237 IonicContact OD1-CZ 3.32Å; D109-R237 IonicContact OD1-NE 3.43Å; D109-R237 IonicContact OD1-NH1 2.92Å; D109-R237 PolarHBondContact OD1-NH1 2.84Å; D109-R237 PolarHBondContact OD2-N 2.97Å; H112-R237 PolarHBondContact CE1-NH2 3.21Å; H112-R237 VanDerWaalsContact CE1-NH2 3.26Å; R237-V239 VanDerWaalsContact C-N 3.31Å; R237-V239 PolarHBondContact O-N 3.23Å; R237-D240 PolarHBondContact O-N 3.41Å; R237-S241 VanDerWaalsContact O-CB 3.26Å; R237-S241 WeakPolarHBondContact O-CB 3.25Å; R237-S241 PolarHBondContact O-N 3.38Å; R237-S241 PolarHBondContact O-OG 2.88Å; R237-S241 VanDerWaalsContact O-OG 3.11Å; R237-D278 IonicContact CZ-OD1 3.94Å; R237-D278 IonicContact NE-OD1 2.98Å; R237-D278 IonicContact NH2-OD1 3.89Å; R237-D278 PolarHBondContact NH2-OD1 3.2Å
238	V	95.4	Very high	89.1	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-44	176.1	-170.2	0	0	0	0	111.8	A97 F98 P236 C242 F273 F297	A97-V238 HydrophobicContact CB-CG2 3.81Å; F98-V238 HydrophobicContact CE2-CG1 4.18Å; F98-V238 HydrophobicContact CZ-CG1 3.92Å; P236-V238 VanDerWaalsContact C-N 3.26Å; P236-V238 PolarHBondContact O-N 3.47Å; V238-C242 VanDerWaalsContact O-CB 3.26Å; V238-C242 WeakPolarHBondContact O-CB 3.47Å; V238-C242 PolarHBondContact O-N 3.49Å; V238-C242 PolarHBondContact O-SG 3.13Å; V238-F273 HydrophobicContact CG1-CD2 4.3Å; V238-F273 HydrophobicContact CG1-CE2 4.41Å; V238-F273 HydrophobicContact CG1-CG 4.44Å; V238-F273 HydrophobicContact CG2-CB 4.12Å; V238-F273 HydrophobicContact CG2-CD1 3.72Å; V238-F273 HydrophobicContact CG2-CE1 4.2Å; V238-F273 HydrophobicContact CG2-CG 3.91Å; V238-F297 HydrophobicContact CB-CD2 4.16Å; V238-F297 HydrophobicContact CB-CE2 4.29Å; V238-F297 HydrophobicContact CG1-CB 4.42Å; V238-F297 HydrophobicContact CG1-CD2 4.01Å; V238-F297 HydrophobicContact CG1-CG 4.26Å; V238-F297 HydrophobicContact CG2-CD2 4.44Å; V238-F297 HydrophobicContact CG2-CE2 4.37Å
239	V	96.9	Very high	90.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69.5	-51.9	-179.2	175.3	0	0	0	0	110.1	V235 P236 R237 C242 C243 L294 F297 T343	V235-V239 HydrophobicContact CG1-CB 4.07Å; V235-V239 HydrophobicContact CG1-CG1 4.06Å; P236-V239 HydrophobicContact CB-CG2 4.2Å; P236-V239 HydrophobicContact CG-CG2 4.17Å; P236-V239 PolarHBondContact O-N 2.77Å; P236-V239 VanDerWaalsContact O-N 3.09Å; R237-V239 VanDerWaalsContact C-N 3.31Å; R237-V239 PolarHBondContact O-N 3.23Å; V239-C242 PolarHBondContact O-N 3.1Å; V239-C243 PolarHBondContact O-N 2.72Å; V239-C243 PolarHBondContact O-SG 2.75Å; V239-C243 VanDerWaalsContact O-SG 3.33Å; V239-L294 HydrophobicContact CB-CD1 4.41Å; V239-L294 HydrophobicContact CG1-CD1 4.19Å; V239-L294 HydrophobicContact CG2-CD1 4.28Å; V239-F297 HydrophobicContact CG2-CD1 3.63Å; V239-F297 HydrophobicContact CG2-CE1 3.45Å; V239-F297 VanDerWaalsContact CG2-CE1 3.45Å; V239-F297 HydrophobicContact CG2-CZ 4.3Å; V239-T343 HydrophobicContact CG1-CG2 4.39Å; V239-T343 HydrophobicContact CG2-CG2 4.24Å
240	D	95.4	Very high	91.1	Very high	51 Å²	51	41.9 Å²	41.9	27%	0.273	19%	0.191	S	C	.	.	H	α-helix	trans	-66.3	-43.5	-173.6	-164.3	28.4	0	0	0	112.1	V235 P236 R237 C242 C243 Q244 R346	V235-D240 HydrophobicContact CG1-CB 4.2Å; P236-D240 PolarHBondContact O-N 2.82Å; P236-D240 VanDerWaalsContact O-N 3.11Å; R237-D240 PolarHBondContact O-N 3.41Å; D240-C242 PolarHBondContact O-N 3.46Å; D240-C243 PolarHBondContact O-N 3.13Å; D240-Q244 WeakPolarHBondContact O-CB 3.5Å; D240-Q244 VanDerWaalsContact O-CG 3.22Å; D240-Q244 WeakPolarHBondContact O-CG 3.38Å; D240-Q244 PolarHBondContact O-N 2.86Å; D240-Q244 PolarHBondContact OD1-NE2 2.65Å; D240-Q244 PolarHBondContact OD2-NE2 2.85Å; D240-R346 IonicContact OD1-CZ 2.64Å; D240-R346 IonicContact OD1-NE 2.72Å; D240-R346 PolarHBondContact OD1-NE 3.35Å; D240-R346 VanDerWaalsContact OD1-NE 3.08Å; D240-R346 IonicContact OD1-NH2 2.65Å
241	S	95.7	Very high	92.3	Very high	34 Å²	34	40.4 Å²	40.4	24%	0.238	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-37.5	174.2	-61.4	0	0	0	0	112.8	R237 H245	R237-S241 VanDerWaalsContact O-CB 3.26Å; R237-S241 WeakPolarHBondContact O-CB 3.25Å; R237-S241 PolarHBondContact O-N 3.38Å; R237-S241 PolarHBondContact O-OG 2.88Å; R237-S241 VanDerWaalsContact O-OG 3.11Å; S241-H245 WeakPolarHBondContact O-CB 3.12Å; S241-H245 PolarHBondContact O-N 3.12Å
242	C	97.6	Very high	93.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.6	-42.4	174.2	-75.7	0	0	0	0	112.4	V238 V239 D240 I246 V290 L294	V238-C242 VanDerWaalsContact O-CB 3.26Å; V238-C242 WeakPolarHBondContact O-CB 3.47Å; V238-C242 PolarHBondContact O-N 3.49Å; V238-C242 PolarHBondContact O-SG 3.13Å; V239-C242 PolarHBondContact O-N 3.1Å; D240-C242 PolarHBondContact O-N 3.46Å; C242-I246 WeakPolarHBondContact O-CD1 3.14Å; C242-I246 VanDerWaalsContact O-CG1 3.3Å; C242-I246 WeakPolarHBondContact O-CG1 3.35Å; C242-I246 PolarHBondContact O-N 2.86Å; C242-V290 HydrophobicContact CB-CG1 3.82Å; C242-L294 HydrophobicContact CB-CB 3.98Å; C242-L294 HydrophobicContact CB-CD1 4.22Å; C242-L294 HydrophobicContact CB-CD2 4.33Å; C242-L294 HydrophobicContact CB-CG 4.4Å
243	C	97.8	Very high	94.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-51.7	175.7	-68.1	0	0	0	0	110.9	V239 D240 H245 I246 E247 F350	V239-C243 PolarHBondContact O-N 2.72Å; V239-C243 PolarHBondContact O-SG 2.75Å; V239-C243 VanDerWaalsContact O-SG 3.33Å; D240-C243 PolarHBondContact O-N 3.13Å; C243-H245 VanDerWaalsContact C-N 3.34Å; C243-H245 PolarHBondContact O-N 2.95Å; C243-I246 PolarHBondContact O-N 3.49Å; C243-I246 VanDerWaalsContact O-N 3.09Å; C243-E247 WeakPolarHBondContact O-CB 3.3Å; C243-E247 WeakPolarHBondContact O-CG 3.25Å; C243-E247 PolarHBondContact O-N 2.92Å; C243-F350 HydrophobicContact CB-CB 4.17Å; C243-F350 HydrophobicContact CB-CD2 3.72Å; C243-F350 HydrophobicContact CB-CE2 4.27Å; C243-F350 HydrophobicContact CB-CG 3.88Å; C243-F350 VanDerWaalsContact SG-CG 3.54Å
244	Q	97.3	Very high	95.6	Very high	94 Å²	94	36.2 Å²	36.2	44%	0.439	18%	0.179	S	C	.	.	H	α-helix	trans	-58.6	-41	-179.5	-71.1	170.1	22.8	0	0	112.9	D240 E247 K248	D240-Q244 WeakPolarHBondContact O-CB 3.5Å; D240-Q244 VanDerWaalsContact O-CG 3.22Å; D240-Q244 WeakPolarHBondContact O-CG 3.38Å; D240-Q244 PolarHBondContact O-N 2.86Å; D240-Q244 PolarHBondContact OD1-NE2 2.65Å; D240-Q244 PolarHBondContact OD2-NE2 2.85Å; Q244-E247 WeakPolarHBondContact CA-OE2 3.41Å; Q244-K248 VanDerWaalsContact O-CB 3.23Å; Q244-K248 WeakPolarHBondContact O-CB 3.45Å; Q244-K248 PolarHBondContact O-N 3.17Å
245	H	97.7	Very high	95.9	Very high	7 Å²	7	35.3 Å²	35.3	3%	0.032	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-41.3	176.1	175	91	0	0	0	111.9	S241 C243 K248 Y249 L281 D282 H285 V290	S241-H245 WeakPolarHBondContact O-CB 3.12Å; S241-H245 PolarHBondContact O-N 3.12Å; C243-H245 VanDerWaalsContact C-N 3.34Å; C243-H245 PolarHBondContact O-N 2.95Å; H245-K248 PolarHBondContact O-N 3.36Å; H245-Y249 AromaticContact CE1-CD2 3.49Å; H245-Y249 VanDerWaalsContact CE1-CD2 3.49Å; H245-Y249 WeakPolarHBondContact CE1-CD2 3.49Å; H245-Y249 AromaticContact CE1-CE2 3.48Å; H245-Y249 VanDerWaalsContact CE1-CE2 3.48Å; H245-Y249 WeakPolarHBondContact CE1-CE2 3.47Å; H245-Y249 AromaticContact ND1-CD2 3.49Å; H245-Y249 WeakPolarHBondContact ND1-CD2 3.33Å; H245-Y249 AromaticContact ND1-CE2 3.86Å; H245-Y249 AromaticContact NE2-CD2 3.8Å; H245-Y249 WeakPolarHBondContact O-CB 3.11Å; H245-Y249 WeakPolarHBondContact O-CD2 3.34Å; H245-Y249 PolarHBondContact O-N 2.92Å; H245-L281 HydrophobicContact CB-CB 3.93Å; H245-L281 HydrophobicContact CB-CD1 4.15Å; H245-L281 WeakPolarHBondContact CE1-CB 3.33Å; H245-L281 CovalentContact CE1-O 1.83Å; H245-L281 PolarHBondContact CE1-O 3.38Å; H245-L281 PolarHBondContact ND1-O 3.27Å; H245-D282 PolarHBondContact NE2-O 2.78Å; H245-H285 WeakPolarHBondContact NE2-CB 3.38Å; H245-H285 PolarHBondContact NE2-O 3.43Å; H245-V290 HydrophobicContact CB-CG1 4.35Å
246	I	97.7	Very high	96.1	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-76.5	-31.5	-179.6	-60.6	166.5	0	0	0	111.5	C242 C243 K248 G250 L251 I256 F257 V290 A291 F350	C242-I246 WeakPolarHBondContact O-CD1 3.14Å; C242-I246 VanDerWaalsContact O-CG1 3.3Å; C242-I246 WeakPolarHBondContact O-CG1 3.35Å; C242-I246 PolarHBondContact O-N 2.86Å; C243-I246 PolarHBondContact O-N 3.49Å; C243-I246 VanDerWaalsContact O-N 3.09Å; I246-K248 VanDerWaalsContact C-N 3.35Å; I246-G250 CarbonylContact O-C 3.59Å; I246-G250 WeakPolarHBondContact O-CA 3.23Å; I246-G250 PolarHBondContact O-N 2.76Å; I246-L251 PolarHBondContact O-N 3.44Å; I246-I256 HydrophobicContact CG2-CD1 4.31Å; I246-I256 HydrophobicContact CG2-CG1 3.97Å; I246-F257 HydrophobicContact CD1-CE1 4.1Å; I246-F257 HydrophobicContact CD1-CE2 4.47Å; I246-F257 HydrophobicContact CD1-CZ 3.61Å; I246-F257 HydrophobicContact CG2-CE2 4.5Å; I246-V290 HydrophobicContact CD1-CG1 4.15Å; I246-V290 HydrophobicContact CG1-CG1 4.17Å; I246-A291 HydrophobicContact CD1-CB 3.87Å; I246-F350 HydrophobicContact CB-CE2 3.84Å; I246-F350 HydrophobicContact CB-CZ 3.86Å; I246-F350 HydrophobicContact CD1-CZ 4.17Å; I246-F350 HydrophobicContact CG2-CE2 3.9Å; I246-F350 HydrophobicContact CG2-CZ 3.71Å
247	E	97.1	Very high	96.2	Very high	51 Å²	51	34.2 Å²	34.2	24%	0.238	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-39.9	168.8	-73.4	161.7	169.4	0	0	111.5	C243 Q244 L251 R346 F350	C243-E247 WeakPolarHBondContact O-CB 3.3Å; C243-E247 WeakPolarHBondContact O-CG 3.25Å; C243-E247 PolarHBondContact O-N 2.92Å; Q244-E247 WeakPolarHBondContact CA-OE2 3.41Å; E247-L251 WeakPolarHBondContact O-CD1 3.27Å; E247-L251 WeakPolarHBondContact O-CG 3.34Å; E247-R346 VanDerWaalsContact CD-NH2 3.27Å; E247-R346 IonicContact OE1-CZ 2.7Å; E247-R346 IonicContact OE1-NH1 3.88Å; E247-R346 PolarHBondContact OE1-NH1 2.97Å; E247-R346 IonicContact OE1-NH2 2.71Å; E247-R346 PolarHBondContact OE1-NH2 3.06Å; E247-R346 IonicContact OE2-CZ 3.72Å; E247-R346 IonicContact OE2-NH1 3.72Å; E247-R346 IonicContact OE2-NH2 3.79Å; E247-R346 PolarHBondContact OE2-NH2 3.36Å; E247-F350 HydrophobicContact CG-CD2 3.7Å; E247-F350 HydrophobicContact CG-CE2 4.01Å
248	K	96.3	Very high	96.3	Very high	144 Å²	144	41.4 Å²	41.4	63%	0.626	20%	0.196	S	C	*	.	H	α-helix	trans	-79.1	-36.4	-177.5	-172.6	178.7	175.5	-158.4	0	114.2	Q244 H245 I246	Q244-K248 VanDerWaalsContact O-CB 3.23Å; Q244-K248 WeakPolarHBondContact O-CB 3.45Å; Q244-K248 PolarHBondContact O-N 3.17Å; H245-K248 PolarHBondContact O-N 3.36Å; I246-K248 VanDerWaalsContact C-N 3.35Å
249	Y	95.8	Very high	96.3	Very high	59 Å²	59	44.3 Å²	44.3	23%	0.231	21%	0.213	C	C	.	.	H	α-helix	trans	-124.5	-12.2	-170.1	-60	-70.8	0	0	0	114.8	H245 E283	H245-Y249 AromaticContact CE1-CD2 3.49Å; H245-Y249 VanDerWaalsContact CE1-CD2 3.49Å; H245-Y249 WeakPolarHBondContact CE1-CD2 3.49Å; H245-Y249 AromaticContact CE1-CE2 3.48Å; H245-Y249 VanDerWaalsContact CE1-CE2 3.48Å; H245-Y249 WeakPolarHBondContact CE1-CE2 3.47Å; H245-Y249 AromaticContact ND1-CD2 3.49Å; H245-Y249 WeakPolarHBondContact ND1-CD2 3.33Å; H245-Y249 AromaticContact ND1-CE2 3.86Å; H245-Y249 AromaticContact NE2-CD2 3.8Å; H245-Y249 WeakPolarHBondContact O-CB 3.11Å; H245-Y249 WeakPolarHBondContact O-CD2 3.34Å; H245-Y249 PolarHBondContact O-N 2.92Å; Y249-E283 HydrophobicContact CD1-CB 4.17Å; Y249-E283 HydrophobicContact CD1-CG 3.83Å; Y249-E283 HydrophobicContact CE1-CB 3.56Å; Y249-E283 HydrophobicContact CE1-CG 3.59Å; Y249-E283 WeakPolarHBondContact CE1-OE2 3.47Å
250	G	94.7	Very high	96.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-8.8	-165	0	0	0	0	0	116.6	I246 Q252 T253	I246-G250 CarbonylContact O-C 3.59Å; I246-G250 WeakPolarHBondContact O-CA 3.23Å; I246-G250 PolarHBondContact O-N 2.76Å; G250-Q252 VanDerWaalsContact C-N 3.3Å; G250-Q252 PolarHBondContact O-N 3.38Å; G250-T253 VanDerWaalsContact O-CB 3.25Å; G250-T253 WeakPolarHBondContact O-CB 3.25Å; G250-T253 PolarHBondContact O-N 3.12Å
251	L	95.7	Very high	96.2	Very high	20 Å²	20	47.1 Å²	47.1	11%	0.105	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.6	-170.7	-69.4	177.4	0	0	0	114.5	I246 E247 T353 V354 H357 N372	I246-L251 PolarHBondContact O-N 3.44Å; E247-L251 WeakPolarHBondContact O-CD1 3.27Å; E247-L251 WeakPolarHBondContact O-CG 3.34Å; L251-T353 HydrophobicContact CD1-CG2 4.45Å; L251-T353 HydrophobicContact CD2-CG2 4.12Å; L251-V354 HydrophobicContact CD2-CG2 4.12Å; L251-H357 HydrophobicContact CB-CB 4.49Å; L251-N372 WeakPolarHBondContact O-CB 3.46Å; L251-N372 PolarHBondContact O-ND2 2.93Å
252	Q	94.5	Very high	96.3	Very high	95 Å²	95	47.8 Å²	47.8	44%	0.444	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	4.9	176.2	-59.8	75.3	14.9	0	0	112.8	G250 V254 I369	G250-Q252 VanDerWaalsContact C-N 3.3Å; G250-Q252 PolarHBondContact O-N 3.38Å; Q252-V254 PolarHBondContact O-N 3.06Å; Q252-V254 VanDerWaalsContact O-N 3.11Å; Q252-I369 HydrophobicContact CG-CG2 3.84Å
253	T	95.6	Very high	96.1	Very high	33 Å²	33	55.8 Å²	55.8	20%	0.202	29%	0.287	C	S	.	.			trans	-76.1	104.3	-177.6	-67.7	0	0	0	0	111.2	G250 G255 I256 V287 H288 N372	G250-T253 VanDerWaalsContact O-CB 3.25Å; G250-T253 WeakPolarHBondContact O-CB 3.25Å; G250-T253 PolarHBondContact O-N 3.12Å; T253-G255 PolarHBondContact O-N 3.25Å; T253-I256 HydrophobicContact CG2-CB 4.43Å; T253-I256 HydrophobicContact CG2-CD1 4.33Å; T253-I256 WeakPolarHBondContact O-CB 3.49Å; T253-I256 PolarHBondContact O-N 3.28Å; T253-V287 HydrophobicContact CG2-CG2 3.88Å; T253-H288 WeakPolarHBondContact CG2-CE1 3.47Å; T253-N372 WeakPolarHBondContact O-CB 3.15Å
254	V	95.8	Very high	96.1	Very high	86 Å²	86	63.9 Å²	63.9	52%	0.521	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	121.2	179	-178.5	0	0	0	0	111.7	Q252 N372 K373	Q252-V254 PolarHBondContact O-N 3.06Å; Q252-V254 VanDerWaalsContact O-N 3.11Å; V254-N372 WeakPolarHBondContact CA-O 3.31Å; V254-K373 HydrophobicContact CG1-CG 4.22Å
255	G	95.4	Very high	96.1	Very high	3 Å²	3	64.6 Å²	64.6	3%	0.031	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	26.6	-179.6	0	0	0	0	0	114.4	T253 R258 V259 N372	T253-G255 PolarHBondContact O-N 3.25Å; G255-R258 CarbonylContact O-C 3.52Å; G255-R258 WeakPolarHBondContact O-CA 3.48Å; G255-R258 WeakPolarHBondContact O-CB 3.36Å; G255-R258 PolarHBondContact O-N 2.7Å; G255-V259 WeakPolarHBondContact O-CG2 3.44Å; G255-V259 PolarHBondContact O-N 2.9Å; G255-N372 PolarHBondContact N-O 3.45Å
256	I	97.3	Very high	96.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	143.7	168.2	-167.5	62.4	0	0	0	110.7	I246 T253 R258 V287 A291 V354 N372 M374	I246-I256 HydrophobicContact CG2-CD1 4.31Å; I246-I256 HydrophobicContact CG2-CG1 3.97Å; T253-I256 HydrophobicContact CG2-CB 4.43Å; T253-I256 HydrophobicContact CG2-CD1 4.33Å; T253-I256 WeakPolarHBondContact O-CB 3.49Å; T253-I256 PolarHBondContact O-N 3.28Å; I256-R258 PolarHBondContact O-N 2.85Å; I256-V287 HydrophobicContact CD1-CB 4.11Å; I256-V287 HydrophobicContact CD1-CG2 4.14Å; I256-A291 HydrophobicContact CD1-CB 3.73Å; I256-A291 HydrophobicContact CG1-CB 4.33Å; I256-V354 HydrophobicContact CG2-CG1 3.81Å; I256-N372 HydrophobicContact CG2-CB 4.27Å; I256-M374 HydrophobicContact CG2-CB 4.37Å; I256-M374 HydrophobicContact CG2-CG 3.86Å; I256-M374 WeakPolarHBondContact O-CE 3.5Å; I256-M374 WeakPolarHBondContact O-CG 3.14Å
257	F	97.6	Very high	96	Very high	4 Å²	4	71.9 Å²	71.9	2%	0.018	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	-21.7	-165.6	-57.5	-75.9	0	0	0	117.7	I246 A291 L294 K295 F350 L379 I382 F383	I246-F257 HydrophobicContact CD1-CE1 4.1Å; I246-F257 HydrophobicContact CD1-CE2 4.47Å; I246-F257 HydrophobicContact CD1-CZ 3.61Å; I246-F257 HydrophobicContact CG2-CE2 4.5Å; F257-A291 HydrophobicContact CD1-CB 3.58Å; F257-A291 WeakPolarHBondContact CD1-O 3.48Å; F257-A291 HydrophobicContact CE1-CB 3.5Å; F257-A291 VanDerWaalsContact CE1-CB 3.5Å; F257-A291 WeakPolarHBondContact CE1-O 3.36Å; F257-A291 HydrophobicContact CG-CB 4.19Å; F257-A291 HydrophobicContact CZ-CB 4.06Å; F257-L294 HydrophobicContact CE1-CD2 4.11Å; F257-L294 HydrophobicContact CZ-CD2 4.17Å; F257-K295 HydrophobicContact CB-CD 4.42Å; F257-K295 HydrophobicContact CD1-CD 3.99Å; F257-K295 HydrophobicContact CD1-CG 4.08Å; F257-K295 PolarHBondContact O-NZ 3.41Å; F257-F350 AromaticContact CE2-CE1 3.72Å; F257-F350 HydrophobicContact CE2-CE1 3.72Å; F257-F350 AromaticContact CE2-CZ 3.73Å; F257-F350 HydrophobicContact CE2-CZ 3.73Å; F257-F350 AromaticContact CZ-CE1 3.48Å; F257-F350 HydrophobicContact CZ-CE1 3.48Å; F257-F350 VanDerWaalsContact CZ-CE1 3.48Å; F257-F350 AromaticContact CZ-CZ 3.57Å; F257-F350 HydrophobicContact CZ-CZ 3.57Å; F257-L379 HydrophobicContact CD2-CD2 4.02Å; F257-I382 HydrophobicContact CB-CD1 4.16Å; F257-I382 HydrophobicContact CB-CG2 4.3Å; F257-F383 HydrophobicContact CB-CE2 4.27Å; F257-F383 AromaticContact CD1-CE2 3.7Å; F257-F383 HydrophobicContact CD1-CE2 3.7Å; F257-F383 AromaticContact CD1-CZ 3.55Å; F257-F383 HydrophobicContact CD1-CZ 3.55Å; F257-F383 HydrophobicContact CD2-CE2 4.05Å; F257-F383 HydrophobicContact CD2-CZ 4.46Å; F257-F383 HydrophobicContact CE1-CE2 4.06Å; F257-F383 AromaticContact CE1-CZ 3.54Å; F257-F383 HydrophobicContact CE1-CZ 3.54Å; F257-F383 HydrophobicContact CE2-CE2 4.38Å; F257-F383 HydrophobicContact CE2-CZ 4.44Å; F257-F383 AromaticContact CG-CE2 3.72Å; F257-F383 HydrophobicContact CG-CE2 3.72Å; F257-F383 HydrophobicContact CG-CZ 4.06Å; F257-F383 HydrophobicContact CZ-CE2 4.4Å; F257-F383 HydrophobicContact CZ-CZ 4.01Å
258	R	96	Very high	95.9	Very high	186 Å²	186	74 Å²	74	70%	0.702	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-39.3	178.3	-162	-177.4	81.9	171.7	3.9	113.4	G255 I256 M374 I382	G255-R258 CarbonylContact O-C 3.52Å; G255-R258 WeakPolarHBondContact O-CA 3.48Å; G255-R258 WeakPolarHBondContact O-CB 3.36Å; G255-R258 PolarHBondContact O-N 2.7Å; I256-R258 PolarHBondContact O-N 2.85Å; R258-M374 HydrophobicContact CB-CE 4.19Å; R258-M374 HydrophobicContact CB-SD 4.05Å; R258-I382 HydrophobicContact CB-CD1 4.05Å; R258-I382 HydrophobicContact CG-CD1 4.44Å
259	V	95.3	Very high	95.9	Very high	63 Å²	63	67.6 Å²	67.6	38%	0.382	33%	0.331	S	S	.	.	S	Bend	trans	-67.8	147.7	-179.6	173.2	0	0	0	0	111.1	G255	G255-V259 WeakPolarHBondContact O-CG2 3.44Å; G255-V259 PolarHBondContact O-N 2.9Å
260	G	92.6	Very high	95.9	Very high	66 Å²	66	67.2 Å²	67.2	68%	0.68	33%	0.329	S	S	*	.			trans	-73.5	148.2	-177.9	0	0	0	0	0	113.8
261	S	96.3	Very high	95.8	Very high	45 Å²	45	72.3 Å²	72.3	32%	0.315	35%	0.353	S	S	.	.			trans	-113.7	161.5	-175.1	57.8	0	0	0	0	113.6	K263 H288 D289 A292	S261-K263 PolarHBondContact O-N 2.87Å; S261-K263 VanDerWaalsContact O-N 3.12Å; S261-H288 WeakPolarHBondContact CB-O 3.39Å; S261-D289 VanDerWaalsContact CA-OD1 3.3Å; S261-D289 WeakPolarHBondContact CA-OD1 3.37Å; S261-D289 WeakPolarHBondContact CB-OD1 3.45Å; S261-A292 WeakPolarHBondContact OG-CB 3.31Å
262	S	97.5	Very high	95.7	Very high	48 Å²	48	73.1 Å²	73.1	34%	0.336	36%	0.356	S	S	.	.			trans	-76.3	96.8	173.6	-176.4	0	0	0	0	110.7	K264 R265 V266 D289	S262-K264 PolarHBondContact O-N 2.73Å; S262-R265 PolarHBondContact O-N 3.4Å; S262-V266 WeakPolarHBondContact O-CG2 3.38Å; S262-V266 PolarHBondContact O-N 3.33Å; S262-D289 WeakPolarHBondContact CB-OD2 3.31Å; S262-D289 PolarHBondContact N-OD1 2.97Å
263	K	95.4	Very high	95.6	Very high	168 Å²	168	69 Å²	69	73%	0.73	34%	0.337	S	S	*	.	H	α-helix	trans	-50	-23.7	176.8	-64.2	-177.4	-179.2	178.9	0	114.5	S261 R267	S261-K263 PolarHBondContact O-N 2.87Å; S261-K263 VanDerWaalsContact O-N 3.12Å; K263-R267 WeakPolarHBondContact O-CB 3.48Å; K263-R267 WeakPolarHBondContact O-CD 3.42Å; K263-R267 VanDerWaalsContact O-CG 3.24Å; K263-R267 WeakPolarHBondContact O-CG 3.4Å; K263-R267 PolarHBondContact O-N 3.04Å
264	K	96.9	Very high	95.5	Very high	169 Å²	169	68.3 Å²	68.3	74%	0.735	33%	0.332	S	S	*	.	H	α-helix	trans	-74.7	-49.9	173.8	-171.6	-172.4	174.8	-168.1	0	111.8	S262 R267 Q268	S262-K264 PolarHBondContact O-N 2.73Å; K264-R267 PolarHBondContact O-N 3.47Å; K264-Q268 PolarHBondContact O-N 3.33Å
265	R	96.7	Very high	95.2	Very high	110 Å²	110	70.3 Å²	70.3	42%	0.415	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-37.8	-179.7	-68.2	-169.5	-55.9	-168.6	2.1	111.8	S262 R267 Q268 L269 D289	S262-R265 PolarHBondContact O-N 3.4Å; R265-R267 VanDerWaalsContact C-N 3.33Å; R265-R267 PolarHBondContact O-N 2.91Å; R265-Q268 PolarHBondContact O-N 3.17Å; R265-L269 WeakPolarHBondContact O-CG 3.32Å; R265-L269 PolarHBondContact O-N 3.42Å; R265-D289 VanDerWaalsContact CB-OD2 3.31Å; R265-D289 WeakPolarHBondContact CB-OD2 3.2Å; R265-D289 IonicContact CZ-OD2 3.23Å; R265-D289 IonicContact NE-OD2 2.73Å; R265-D289 PolarHBondContact NE-OD2 3.22Å; R265-D289 IonicContact NH2-OD1 2.79Å; R265-D289 IonicContact NH2-OD2 2.8Å; R265-D289 PolarHBondContact NH2-OD2 3.31Å
266	V	97.1	Very high	94.7	Very high	3 Å²	3	71.1 Å²	71.1	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-59.1	-43.3	173.6	179.6	0	0	0	0	111.2	S262 R270 D289 A292 L293 E296	S262-V266 WeakPolarHBondContact O-CG2 3.38Å; S262-V266 PolarHBondContact O-N 3.33Å; V266-R270 WeakPolarHBondContact O-CB 3.27Å; V266-R270 PolarHBondContact O-N 2.81Å; V266-D289 HydrophobicContact CG2-CB 3.8Å; V266-A292 HydrophobicContact CG1-CB 4.43Å; V266-A292 HydrophobicContact CG2-CB 3.87Å; V266-L293 HydrophobicContact CG1-CB 4.42Å; V266-L293 HydrophobicContact CG1-CD1 4.24Å; V266-E296 HydrophobicContact CG1-CG 4.15Å
267	R	95.8	Very high	94.1	Very high	156 Å²	156	74.6 Å²	74.6	59%	0.589	36%	0.356	S	S	*	.	H	α-helix	trans	-64.3	-43	174.2	-77.5	175.4	-179.4	-170.6	-2.4	112.7	K263 K264 R265 L269 R270 E271	K263-R267 WeakPolarHBondContact O-CB 3.48Å; K263-R267 WeakPolarHBondContact O-CD 3.42Å; K263-R267 VanDerWaalsContact O-CG 3.24Å; K263-R267 WeakPolarHBondContact O-CG 3.4Å; K263-R267 PolarHBondContact O-N 3.04Å; K264-R267 PolarHBondContact O-N 3.47Å; R265-R267 VanDerWaalsContact C-N 3.33Å; R265-R267 PolarHBondContact O-N 2.91Å; R267-L269 PolarHBondContact O-N 2.98Å; R267-R270 WeakPolarHBondContact O-CB 3.2Å; R267-R270 PolarHBondContact O-N 3.32Å; R267-E271 WeakPolarHBondContact O-CB 3.49Å; R267-E271 VanDerWaalsContact O-CG 3.25Å; R267-E271 WeakPolarHBondContact O-CG 3.46Å; R267-E271 PolarHBondContact O-N 2.88Å
268	Q	95.5	Very high	93.4	Very high	97 Å²	97	77.6 Å²	77.6	45%	0.453	37%	0.372	S	S	.	.	H	α-helix	trans	-57.7	-50.3	176.1	178.5	-178.7	-20.1	0	0	111.5	K264 R265 R270 E271 E272	K264-Q268 PolarHBondContact O-N 3.33Å; R265-Q268 PolarHBondContact O-N 3.17Å; Q268-R270 VanDerWaalsContact C-N 3.33Å; Q268-R270 PolarHBondContact O-N 3.05Å; Q268-E271 CarbonylContact O-C 3.52Å; Q268-E271 WeakPolarHBondContact O-CB 3.39Å; Q268-E271 PolarHBondContact O-N 3.46Å; Q268-E271 VanDerWaalsContact O-N 3.15Å; Q268-E272 WeakPolarHBondContact CG-OE1 3.4Å; Q268-E272 PolarHBondContact NE2-OE1 3.22Å; Q268-E272 VanDerWaalsContact O-CG 3.3Å; Q268-E272 WeakPolarHBondContact O-CG 3.32Å; Q268-E272 PolarHBondContact O-N 3.18Å
269	L	96.3	Very high	92.9	Very high	8 Å²	8	69.4 Å²	69.4	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-42.6	176.7	-68.7	169.5	0	0	0	111.7	R265 R267 E271 E272 F273 V279 L281 L293	R265-L269 WeakPolarHBondContact O-CG 3.32Å; R265-L269 PolarHBondContact O-N 3.42Å; R267-L269 PolarHBondContact O-N 2.98Å; L269-E271 VanDerWaalsContact C-N 3.34Å; L269-E271 PolarHBondContact O-N 2.98Å; L269-E272 PolarHBondContact O-N 2.99Å; L269-F273 VanDerWaalsContact O-CD2 3.28Å; L269-F273 WeakPolarHBondContact O-CD2 3.42Å; L269-F273 PolarHBondContact O-N 3.3Å; L269-V279 HydrophobicContact CD2-CG1 3.97Å; L269-L281 HydrophobicContact CD2-CD2 4Å; L269-L293 HydrophobicContact CB-CD1 4.23Å; L269-L293 HydrophobicContact CB-CD2 3.74Å; L269-L293 HydrophobicContact CD1-CD2 4.31Å
270	R	95.3	Very high	92.6	Very high	52 Å²	52	72.8 Å²	72.8	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-57.8	-45.2	174.3	-168.8	-170.8	-173.2	-67.6	2.4	111.5	F98 S99 V266 R267 Q268 E272 D274 L293 D300	F98-R270 HydrophobicContact CB-CG 4.45Å; F98-R270 VanDerWaalsContact CB-CZ 3.46Å; F98-R270 HydrophobicContact CD1-CG 3.79Å; F98-R270 HydrophobicContact CD2-CG 3.68Å; F98-R270 HydrophobicContact CE1-CG 3.88Å; F98-R270 HydrophobicContact CE2-CB 4.37Å; F98-R270 HydrophobicContact CE2-CG 3.82Å; F98-R270 HydrophobicContact CG-CG 3.71Å; F98-R270 HydrophobicContact CZ-CB 4.4Å; F98-R270 HydrophobicContact CZ-CG 3.93Å; S99-R270 PolarHBondContact OG-NH2 3.48Å; V266-R270 WeakPolarHBondContact O-CB 3.27Å; V266-R270 PolarHBondContact O-N 2.81Å; R267-R270 WeakPolarHBondContact O-CB 3.2Å; R267-R270 PolarHBondContact O-N 3.32Å; Q268-R270 VanDerWaalsContact C-N 3.33Å; Q268-R270 PolarHBondContact O-N 3.05Å; R270-E272 VanDerWaalsContact C-N 3.35Å; R270-D274 IonicContact CZ-OD2 3.57Å; R270-D274 IonicContact NH1-OD2 2.81Å; R270-D274 PolarHBondContact NH1-OD2 2.8Å; R270-D274 VanDerWaalsContact O-CB 3.28Å; R270-D274 WeakPolarHBondContact O-CB 3.42Å; R270-D274 PolarHBondContact O-N 3.17Å; R270-L293 HydrophobicContact CB-CD1 3.84Å; R270-D300 IonicContact CZ-OD2 3.7Å; R270-D300 IonicContact NE-OD2 2.78Å; R270-D300 PolarHBondContact NE-OD2 3.16Å; R270-D300 IonicContact NH2-OD2 3.71Å; R270-D300 PolarHBondContact NH2-OD2 3.22Å
271	E	94.1	Very high	92.6	Very high	106 Å²	106	70.6 Å²	70.6	50%	0.495	33%	0.327	S	S	.	.	H	α-helix	trans	-68.7	-28.5	177.5	-72	163.8	-147.8	0	0	112.8	R267 Q268 L269 R275	R267-E271 WeakPolarHBondContact O-CB 3.49Å; R267-E271 VanDerWaalsContact O-CG 3.25Å; R267-E271 WeakPolarHBondContact O-CG 3.46Å; R267-E271 PolarHBondContact O-N 2.88Å; Q268-E271 CarbonylContact O-C 3.52Å; Q268-E271 WeakPolarHBondContact O-CB 3.39Å; Q268-E271 PolarHBondContact O-N 3.46Å; Q268-E271 VanDerWaalsContact O-N 3.15Å; L269-E271 VanDerWaalsContact C-N 3.34Å; L269-E271 PolarHBondContact O-N 2.98Å; E271-R275 WeakPolarHBondContact O-CB 3.15Å; E271-R275 VanDerWaalsContact O-CG 3.31Å; E271-R275 WeakPolarHBondContact O-CG 3.36Å; E271-R275 PolarHBondContact O-N 3.17Å; E271-R275 PolarHBondContact O-NE 2.8Å
272	E	92.9	Very high	92.3	Very high	38 Å²	38	72.6 Å²	72.6	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-73.5	-48.1	174.8	-70.7	161.8	177.8	0	0	111.1	Q268 L269 R270 R275 G276 I277 V279	Q268-E272 WeakPolarHBondContact CG-OE1 3.4Å; Q268-E272 PolarHBondContact NE2-OE1 3.22Å; Q268-E272 VanDerWaalsContact O-CG 3.3Å; Q268-E272 WeakPolarHBondContact O-CG 3.32Å; Q268-E272 PolarHBondContact O-N 3.18Å; L269-E272 PolarHBondContact O-N 2.99Å; R270-E272 VanDerWaalsContact C-N 3.35Å; E272-R275 PolarHBondContact O-N 3.14Å; E272-G276 PolarHBondContact O-N 2.84Å; E272-I277 HydrophobicContact CB-CD1 4.41Å; E272-I277 HydrophobicContact CG-CD1 4.39Å; E272-I277 WeakPolarHBondContact O-CB 3.43Å; E272-I277 PolarHBondContact O-N 3.32Å; E272-V279 HydrophobicContact CB-CG2 3.62Å
273	F	93.3	Very high	91.9	Very high	7 Å²	7	77.4 Å²	77.4	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-64.3	-38.8	172.1	-77.1	-66.4	0	0	0	113	A97 F98 V238 L269 R275 G276 V279 L293	A97-F273 HydrophobicContact CB-CB 4.34Å; F98-F273 HydrophobicContact CE2-CB 3.93Å; V238-F273 HydrophobicContact CG1-CD2 4.3Å; V238-F273 HydrophobicContact CG1-CE2 4.41Å; V238-F273 HydrophobicContact CG1-CG 4.44Å; V238-F273 HydrophobicContact CG2-CB 4.12Å; V238-F273 HydrophobicContact CG2-CD1 3.72Å; V238-F273 HydrophobicContact CG2-CE1 4.2Å; V238-F273 HydrophobicContact CG2-CG 3.91Å; L269-F273 VanDerWaalsContact O-CD2 3.28Å; L269-F273 WeakPolarHBondContact O-CD2 3.42Å; L269-F273 PolarHBondContact O-N 3.3Å; F273-R275 VanDerWaalsContact C-N 3.27Å; F273-R275 PolarHBondContact O-N 2.77Å; F273-G276 WeakPolarHBondContact O-CA 3.24Å; F273-G276 PolarHBondContact O-N 2.82Å; F273-V279 HydrophobicContact CD1-CB 4.3Å; F273-V279 HydrophobicContact CD1-CG2 4.04Å; F273-V279 HydrophobicContact CD2-CB 4.49Å; F273-V279 HydrophobicContact CD2-CG2 4.18Å; F273-V279 HydrophobicContact CE1-CB 3.81Å; F273-V279 HydrophobicContact CE1-CG2 4.07Å; F273-V279 HydrophobicContact CE2-CB 4Å; F273-V279 HydrophobicContact CE2-CG1 4.04Å; F273-V279 HydrophobicContact CE2-CG2 4.19Å; F273-V279 HydrophobicContact CG-CG2 4.12Å; F273-V279 HydrophobicContact CZ-CB 3.65Å; F273-V279 HydrophobicContact CZ-CG1 4.03Å; F273-V279 HydrophobicContact CZ-CG2 4.15Å; F273-L293 HydrophobicContact CD2-CD2 3.89Å; F273-L293 HydrophobicContact CE2-CD2 3.7Å
274	D	93.1	Very high	91.7	Very high	20 Å²	20	78.1 Å²	78.1	11%	0.107	36%	0.358	C	S	.	.	H	α-helix	trans	-67.3	-25	176.8	-92.8	-23.9	0	0	0	113.6	P95 Q96 A97 F98 R270	P95-D274 HydrophobicContact CB-CB 4.43Å; P95-D274 WeakPolarHBondContact CB-OD1 3.44Å; Q96-D274 WeakPolarHBondContact CB-O 3.4Å; Q96-D274 WeakPolarHBondContact CG-O 3.49Å; Q96-D274 PolarHBondContact N-O 3.15Å; A97-D274 PolarHBondContact N-OD1 3.04Å; F98-D274 PolarHBondContact N-OD1 2.97Å; R270-D274 IonicContact CZ-OD2 3.57Å; R270-D274 IonicContact NH1-OD2 2.81Å; R270-D274 PolarHBondContact NH1-OD2 2.8Å; R270-D274 VanDerWaalsContact O-CB 3.28Å; R270-D274 WeakPolarHBondContact O-CB 3.42Å; R270-D274 PolarHBondContact O-N 3.17Å
275	R	89.8	Confident	91.6	Very high	128 Å²	128	72.8 Å²	72.8	48%	0.483	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-6.1	169.1	-77.6	176.5	-71.8	166.8	-2.1	113.1	E271 E272 F273 I277	E271-R275 WeakPolarHBondContact O-CB 3.15Å; E271-R275 VanDerWaalsContact O-CG 3.31Å; E271-R275 WeakPolarHBondContact O-CG 3.36Å; E271-R275 PolarHBondContact O-N 3.17Å; E271-R275 PolarHBondContact O-NE 2.8Å; E272-R275 PolarHBondContact O-N 3.14Å; F273-R275 VanDerWaalsContact C-N 3.27Å; F273-R275 PolarHBondContact O-N 2.77Å; R275-I277 HydrophobicContact CB-CD1 4.11Å; R275-I277 HydrophobicContact CB-CG1 3.96Å
276	G	83.7	Confident	91.5	Very high	19 Å²	19	69.3 Å²	69.3	20%	0.196	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	30.1	-174.9	0	0	0	0	0	113.4	H112 E272 F273	H112-G276 PolarHBondContact CD2-O 3.06Å; H112-G276 VanDerWaalsContact CD2-O 3.22Å; H112-G276 PolarHBondContact NE2-O 3.27Å; E272-G276 PolarHBondContact O-N 2.84Å; F273-G276 WeakPolarHBondContact O-CA 3.24Å; F273-G276 PolarHBondContact O-N 2.82Å
277	I	84.9	Confident	91.5	Very high	73 Å²	73	70 Å²	70	37%	0.374	33%	0.332	S	S	.	.			trans	-74.9	148.6	174.6	-59.5	176.1	0	0	0	109.2	E272 R275 V279	E272-I277 HydrophobicContact CB-CD1 4.41Å; E272-I277 HydrophobicContact CG-CD1 4.39Å; E272-I277 WeakPolarHBondContact O-CB 3.43Å; E272-I277 PolarHBondContact O-N 3.32Å; R275-I277 HydrophobicContact CB-CD1 4.11Å; R275-I277 HydrophobicContact CB-CG1 3.96Å; I277-V279 HydrophobicContact CB-CG2 4.49Å; I277-V279 PolarHBondContact O-N 2.84Å; I277-V279 VanDerWaalsContact O-N 3.11Å
278	D	82.5	Confident	91.6	Very high	67 Å²	67	64.7 Å²	64.7	36%	0.358	31%	0.313	S	S	.	.			trans	-80.5	85.5	172.2	-156.2	23.6	0	0	0	110.3	Q116 R237 Q280	Q116-D278 PolarHBondContact NE2-OD2 2.94Å; R237-D278 IonicContact CZ-OD1 3.94Å; R237-D278 IonicContact NE-OD1 2.98Å; R237-D278 IonicContact NH2-OD1 3.89Å; R237-D278 PolarHBondContact NH2-OD1 3.2Å; D278-Q280 PolarHBondContact O-N 3.28Å
279	V	86.9	Confident	91.7	Very high	14 Å²	14	60.2 Å²	60.2	9%	0.085	29%	0.293	C	S	.	.			trans	-77.4	105.9	-177.1	-176.7	0	0	0	0	110	L269 E272 F273 I277 L281	L269-V279 HydrophobicContact CD2-CG1 3.97Å; E272-V279 HydrophobicContact CB-CG2 3.62Å; F273-V279 HydrophobicContact CD1-CB 4.3Å; F273-V279 HydrophobicContact CD1-CG2 4.04Å; F273-V279 HydrophobicContact CD2-CB 4.49Å; F273-V279 HydrophobicContact CD2-CG2 4.18Å; F273-V279 HydrophobicContact CE1-CB 3.81Å; F273-V279 HydrophobicContact CE1-CG2 4.07Å; F273-V279 HydrophobicContact CE2-CB 4Å; F273-V279 HydrophobicContact CE2-CG1 4.04Å; F273-V279 HydrophobicContact CE2-CG2 4.19Å; F273-V279 HydrophobicContact CG-CG2 4.12Å; F273-V279 HydrophobicContact CZ-CB 3.65Å; F273-V279 HydrophobicContact CZ-CG1 4.03Å; F273-V279 HydrophobicContact CZ-CG2 4.15Å; I277-V279 HydrophobicContact CB-CG2 4.49Å; I277-V279 PolarHBondContact O-N 2.84Å; I277-V279 VanDerWaalsContact O-N 3.11Å; V279-L281 HydrophobicContact CG1-CD2 3.81Å; V279-L281 HydrophobicContact CG1-CG 4.28Å
280	Q	88.1	Confident	91.8	Very high	134 Å²	134	59.9 Å²	59.9	63%	0.626	29%	0.291	S	S	*	.			trans	-86.1	115.8	172.9	-63.1	-173.8	-6.9	0	0	109.3	D278 D282 H285	D278-Q280 PolarHBondContact O-N 3.28Å; Q280-D282 PolarHBondContact O-N 3.01Å; Q280-H285 PolarHBondContact O-CE1 2.86Å
281	L	91.8	Very high	91.9	Very high	20 Å²	20	57.4 Å²	57.4	11%	0.105	28%	0.282	C	S	.	.			trans	-91.1	75.6	-174.9	-67.6	176.9	0	0	0	111	H245 L269 V279 H285 V290	H245-L281 HydrophobicContact CB-CB 3.93Å; H245-L281 HydrophobicContact CB-CD1 4.15Å; H245-L281 WeakPolarHBondContact CE1-CB 3.33Å; H245-L281 CovalentContact CE1-O 1.83Å; H245-L281 PolarHBondContact CE1-O 3.38Å; H245-L281 PolarHBondContact ND1-O 3.27Å; L269-L281 HydrophobicContact CD2-CD2 4Å; V279-L281 HydrophobicContact CG1-CD2 3.81Å; V279-L281 HydrophobicContact CG1-CG 4.28Å; L281-H285 HydrophobicContact CD2-CB 4.39Å; L281-V290 HydrophobicContact CD1-CG1 3.92Å; L281-V290 HydrophobicContact CD1-CG2 4.31Å; L281-V290 HydrophobicContact CD2-CG2 4.19Å
282	D	90.9	Very high	92.1	Very high	88 Å²	88	52.7 Å²	52.7	47%	0.471	26%	0.261	S	S	.	.			trans	-73.1	169.7	174.1	-62.5	-54	0	0	0	113.2	H245 Q280 E284 H285	H245-D282 PolarHBondContact NE2-O 2.78Å; Q280-D282 PolarHBondContact O-N 3.01Å; D282-E284 PolarHBondContact O-N 3.37Å; D282-E284 VanDerWaalsContact O-N 3.08Å; D282-H285 PolarHBondContact N-ND1 2.81Å; D282-H285 VanDerWaalsContact O-CB 3.3Å; D282-H285 WeakPolarHBondContact O-CB 3.26Å; D282-H285 PolarHBondContact O-N 3.02Å; D282-H285 PolarHBondContact O-ND1 2.82Å
283	E	89.9	Confident	92.3	Very high	148 Å²	148	50.9 Å²	50.9	69%	0.692	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.1	-176.1	-165.4	170.6	156.8	0	0	114.8	Y249 H285	Y249-E283 HydrophobicContact CD1-CB 4.17Å; Y249-E283 HydrophobicContact CD1-CG 3.83Å; Y249-E283 HydrophobicContact CE1-CB 3.56Å; Y249-E283 HydrophobicContact CE1-CG 3.59Å; Y249-E283 WeakPolarHBondContact CE1-OE2 3.47Å; E283-H285 PolarHBondContact O-N 3.43Å
284	E	90.2	Very high	92.6	Very high	184 Å²	184	50.6 Å²	50.6	86%	0.86	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.9	173.2	-58.6	-170	-175	0	0	112.9	D282 S286	D282-E284 PolarHBondContact O-N 3.37Å; D282-E284 VanDerWaalsContact O-N 3.08Å; E284-S286 PolarHBondContact O-N 3.44Å
285	H	93.9	Very high	92.7	Very high	57 Å²	57	51.6 Å²	51.6	26%	0.264	26%	0.255	S	S	.	.	S	Bend	trans	-76.9	123	176.4	-62.4	91.6	0	0	0	110.5	H245 Q280 L281 D282 E283 V287 V290	H245-H285 WeakPolarHBondContact NE2-CB 3.38Å; H245-H285 PolarHBondContact NE2-O 3.43Å; Q280-H285 PolarHBondContact O-CE1 2.86Å; L281-H285 HydrophobicContact CD2-CB 4.39Å; D282-H285 PolarHBondContact N-ND1 2.81Å; D282-H285 VanDerWaalsContact O-CB 3.3Å; D282-H285 WeakPolarHBondContact O-CB 3.26Å; D282-H285 PolarHBondContact O-N 3.02Å; D282-H285 PolarHBondContact O-ND1 2.82Å; E283-H285 PolarHBondContact O-N 3.43Å; H285-V287 PolarHBondContact O-N 2.81Å; H285-V290 HydrophobicContact CB-CG2 4.25Å
286	S	95.9	Very high	93	Very high	37 Å²	37	47.9 Å²	47.9	26%	0.259	24%	0.243	S	C	.	.			trans	-69.1	120	179.4	-172.6	0	0	0	0	110.9	E284 H288 D289 V290	E284-S286 PolarHBondContact O-N 3.44Å; S286-H288 PolarHBondContact O-N 2.91Å; S286-D289 WeakPolarHBondContact O-CA 3.27Å; S286-D289 WeakPolarHBondContact O-CB 3.47Å; S286-D289 PolarHBondContact O-N 3.16Å; S286-V290 PolarHBondContact O-N 3.4Å
287	V	97.3	Very high	93.6	Very high	18 Å²	18	47 Å²	47	11%	0.109	23%	0.234	C	C	.	.	H	α-helix	trans	-51.1	-31.3	178.4	-63.9	0	0	0	0	113.7	T253 I256 H285 D289 A291	T253-V287 HydrophobicContact CG2-CG2 3.88Å; I256-V287 HydrophobicContact CD1-CB 4.11Å; I256-V287 HydrophobicContact CD1-CG2 4.14Å; H285-V287 PolarHBondContact O-N 2.81Å; V287-D289 VanDerWaalsContact C-N 3.35Å; V287-A291 WeakPolarHBondContact O-CB 3.38Å; V287-A291 PolarHBondContact O-N 2.7Å
288	H	97.8	Very high	94.2	Very high	43 Å²	43	43.6 Å²	43.6	20%	0.199	22%	0.216	C	C	.	.	H	α-helix	trans	-68	-31.4	175.2	-62.8	-48	0	0	0	113.4	T253 S261 S286 A292	T253-H288 WeakPolarHBondContact CG2-CE1 3.47Å; S261-H288 WeakPolarHBondContact CB-O 3.39Å; S286-H288 PolarHBondContact O-N 2.91Å; H288-A292 WeakPolarHBondContact O-CB 3.14Å; H288-A292 PolarHBondContact O-N 2.9Å
289	D	97.8	Very high	94.7	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-79.5	-39.7	178.4	-66.4	-2.3	0	0	0	110.7	S261 S262 R265 V266 S286 V287 A292 L293	S261-D289 VanDerWaalsContact CA-OD1 3.3Å; S261-D289 WeakPolarHBondContact CA-OD1 3.37Å; S261-D289 WeakPolarHBondContact CB-OD1 3.45Å; S262-D289 WeakPolarHBondContact CB-OD2 3.31Å; S262-D289 PolarHBondContact N-OD1 2.97Å; R265-D289 VanDerWaalsContact CB-OD2 3.31Å; R265-D289 WeakPolarHBondContact CB-OD2 3.2Å; R265-D289 IonicContact CZ-OD2 3.23Å; R265-D289 IonicContact NE-OD2 2.73Å; R265-D289 PolarHBondContact NE-OD2 3.22Å; R265-D289 IonicContact NH2-OD1 2.79Å; R265-D289 IonicContact NH2-OD2 2.8Å; R265-D289 PolarHBondContact NH2-OD2 3.31Å; V266-D289 HydrophobicContact CG2-CB 3.8Å; S286-D289 WeakPolarHBondContact O-CA 3.27Å; S286-D289 WeakPolarHBondContact O-CB 3.47Å; S286-D289 PolarHBondContact O-N 3.16Å; V287-D289 VanDerWaalsContact C-N 3.35Å; D289-A292 WeakPolarHBondContact O-CB 3.48Å; D289-A292 PolarHBondContact O-N 3.34Å; D289-L293 WeakPolarHBondContact O-CB 3.32Å; D289-L293 PolarHBondContact O-N 3.33Å
290	V	97.9	Very high	94.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-43.1	171.2	-177.8	0	0	0	0	110.6	C242 H245 I246 L281 H285 S286 A292 L293 L294	C242-V290 HydrophobicContact CB-CG1 3.82Å; H245-V290 HydrophobicContact CB-CG1 4.35Å; I246-V290 HydrophobicContact CD1-CG1 4.15Å; I246-V290 HydrophobicContact CG1-CG1 4.17Å; L281-V290 HydrophobicContact CD1-CG1 3.92Å; L281-V290 HydrophobicContact CD1-CG2 4.31Å; L281-V290 HydrophobicContact CD2-CG2 4.19Å; H285-V290 HydrophobicContact CB-CG2 4.25Å; S286-V290 PolarHBondContact O-N 3.4Å; V290-A292 VanDerWaalsContact C-N 3.27Å; V290-A292 PolarHBondContact O-N 3.05Å; V290-L293 WeakPolarHBondContact O-CB 3.31Å; V290-L293 PolarHBondContact O-N 3.28Å; V290-L294 PolarHBondContact O-N 2.85Å
291	A	98	Very high	95.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-31	173.6	0	0	0	0	0	113	I246 I256 F257 V287 K295	I246-A291 HydrophobicContact CD1-CB 3.87Å; I256-A291 HydrophobicContact CD1-CB 3.73Å; I256-A291 HydrophobicContact CG1-CB 4.33Å; F257-A291 HydrophobicContact CD1-CB 3.58Å; F257-A291 WeakPolarHBondContact CD1-O 3.48Å; F257-A291 HydrophobicContact CE1-CB 3.5Å; F257-A291 VanDerWaalsContact CE1-CB 3.5Å; F257-A291 WeakPolarHBondContact CE1-O 3.36Å; F257-A291 HydrophobicContact CG-CB 4.19Å; F257-A291 HydrophobicContact CZ-CB 4.06Å; V287-A291 WeakPolarHBondContact O-CB 3.38Å; V287-A291 PolarHBondContact O-N 2.7Å; A291-K295 WeakPolarHBondContact O-CE 3.46Å; A291-K295 WeakPolarHBondContact O-CG 3.41Å
292	A	97.9	Very high	94.9	Very high	7 Å²	7	42.7 Å²	42.7	6%	0.058	21%	0.211	C	C	.	.	H	α-helix	trans	-72.8	-45	171.3	0	0	0	0	0	111.7	S261 V266 H288 D289 V290 L294 K295 E296	S261-A292 WeakPolarHBondContact OG-CB 3.31Å; V266-A292 HydrophobicContact CG1-CB 4.43Å; V266-A292 HydrophobicContact CG2-CB 3.87Å; H288-A292 WeakPolarHBondContact O-CB 3.14Å; H288-A292 PolarHBondContact O-N 2.9Å; D289-A292 WeakPolarHBondContact O-CB 3.48Å; D289-A292 PolarHBondContact O-N 3.34Å; V290-A292 VanDerWaalsContact C-N 3.27Å; V290-A292 PolarHBondContact O-N 3.05Å; A292-L294 PolarHBondContact O-N 2.87Å; A292-K295 WeakPolarHBondContact O-CB 3.43Å; A292-K295 PolarHBondContact O-N 3.08Å; A292-K295 VanDerWaalsContact O-N 3.13Å; A292-E296 WeakPolarHBondContact O-CG 3.44Å; A292-E296 PolarHBondContact O-N 3Å
293	L	97.9	Very high	94.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.7	-44	179.4	-172.4	71	0	0	0	112.3	F98 V266 L269 R270 F273 D289 V290 K295 E296 F297	F98-L293 HydrophobicContact CE1-CD1 4.09Å; F98-L293 HydrophobicContact CE2-CD1 4.44Å; F98-L293 HydrophobicContact CZ-CD1 3.57Å; F98-L293 HydrophobicContact CZ-CG 3.99Å; V266-L293 HydrophobicContact CG1-CB 4.42Å; V266-L293 HydrophobicContact CG1-CD1 4.24Å; L269-L293 HydrophobicContact CB-CD1 4.23Å; L269-L293 HydrophobicContact CB-CD2 3.74Å; L269-L293 HydrophobicContact CD1-CD2 4.31Å; R270-L293 HydrophobicContact CB-CD1 3.84Å; F273-L293 HydrophobicContact CD2-CD2 3.89Å; F273-L293 HydrophobicContact CE2-CD2 3.7Å; D289-L293 WeakPolarHBondContact O-CB 3.32Å; D289-L293 PolarHBondContact O-N 3.33Å; V290-L293 WeakPolarHBondContact O-CB 3.31Å; V290-L293 PolarHBondContact O-N 3.28Å; L293-K295 VanDerWaalsContact C-N 3.34Å; L293-K295 PolarHBondContact O-N 2.8Å; L293-E296 PolarHBondContact O-N 3.1Å; L293-F297 PolarHBondContact O-N 3.15Å
294	L	97.9	Very high	94.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.7	-42.4	175.6	180	58.1	0	0	0	112.1	V239 C242 F257 V290 A292 F297 L298 L347 F350	V239-L294 HydrophobicContact CB-CD1 4.41Å; V239-L294 HydrophobicContact CG1-CD1 4.19Å; V239-L294 HydrophobicContact CG2-CD1 4.28Å; C242-L294 HydrophobicContact CB-CB 3.98Å; C242-L294 HydrophobicContact CB-CD1 4.22Å; C242-L294 HydrophobicContact CB-CD2 4.33Å; C242-L294 HydrophobicContact CB-CG 4.4Å; F257-L294 HydrophobicContact CE1-CD2 4.11Å; F257-L294 HydrophobicContact CZ-CD2 4.17Å; V290-L294 PolarHBondContact O-N 2.85Å; A292-L294 PolarHBondContact O-N 2.87Å; L294-F297 PolarHBondContact O-N 3.08Å; L294-L298 HydrophobicContact CD1-CD1 4.31Å; L294-L298 HydrophobicContact CG-CD1 4.35Å; L294-L298 WeakPolarHBondContact O-CD1 3.47Å; L294-L298 WeakPolarHBondContact O-CG 3.13Å; L294-L298 PolarHBondContact O-N 2.97Å; L294-L347 HydrophobicContact CD2-CD1 4.27Å; L294-F350 HydrophobicContact CD2-CE1 4.12Å
295	K	96.4	Very high	95	Very high	42 Å²	42	25.6 Å²	25.6	18%	0.183	13%	0.13	C	C	.	.	H	α-helix	trans	-67.7	-39.1	174.4	-66.9	178.7	-64.5	172.1	0	112	F257 A291 A292 L293 F297 R299 I382 F383	F257-K295 HydrophobicContact CB-CD 4.42Å; F257-K295 HydrophobicContact CD1-CD 3.99Å; F257-K295 HydrophobicContact CD1-CG 4.08Å; F257-K295 PolarHBondContact O-NZ 3.41Å; A291-K295 WeakPolarHBondContact O-CE 3.46Å; A291-K295 WeakPolarHBondContact O-CG 3.41Å; A292-K295 WeakPolarHBondContact O-CB 3.43Å; A292-K295 PolarHBondContact O-N 3.08Å; A292-K295 VanDerWaalsContact O-N 3.13Å; L293-K295 VanDerWaalsContact C-N 3.34Å; L293-K295 PolarHBondContact O-N 2.8Å; K295-F297 VanDerWaalsContact C-N 3.35Å; K295-R299 WeakPolarHBondContact O-CB 3.47Å; K295-R299 PolarHBondContact O-N 2.91Å; K295-R299 VanDerWaalsContact O-N 3.08Å; K295-I382 HydrophobicContact CD-CG2 3.58Å; K295-F383 HydrophobicContact CG-CE1 4.12Å; K295-F383 HydrophobicContact CG-CZ 4.02Å
296	E	95.8	Very high	95	Very high	49 Å²	49	23 Å²	23	23%	0.229	12%	0.118	C	C	.	.	H	α-helix	trans	-63.5	-41.5	176.5	-55.6	-121.7	105.7	0	0	110.6	V266 A292 L293 R299 D300	V266-E296 HydrophobicContact CG1-CG 4.15Å; A292-E296 WeakPolarHBondContact O-CG 3.44Å; A292-E296 PolarHBondContact O-N 3Å; L293-E296 PolarHBondContact O-N 3.1Å; E296-R299 VanDerWaalsContact CD-NH2 3.32Å; E296-R299 PolarHBondContact O-N 3.25Å; E296-R299 IonicContact OE1-CZ 3.68Å; E296-R299 IonicContact OE1-NH1 3.48Å; E296-R299 PolarHBondContact OE1-NH1 3.38Å; E296-R299 IonicContact OE1-NH2 2.94Å; E296-R299 PolarHBondContact OE1-NH2 3.21Å; E296-D300 WeakPolarHBondContact O-CB 3.27Å; E296-D300 PolarHBondContact O-N 3.24Å
297	F	96.6	Very high	94.8	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.009	11%	0.107	C	C	.	.	H	α-helix	trans	-58.3	-54.9	177.1	178	-95	0	0	0	111.5	A97 F98 L102 V105 P236 V238 V239 L293 L294 K295 R299 D300 M301	A97-F297 WeakPolarHBondContact O-CE2 3.48Å; F98-F297 HydrophobicContact CD1-CB 4.2Å; F98-F297 HydrophobicContact CD1-CD2 4.17Å; F98-F297 VanDerWaalsContact CE1-CA 3.46Å; F98-F297 HydrophobicContact CE1-CB 3.58Å; F98-F297 HydrophobicContact CE1-CD2 4.04Å; F98-F297 HydrophobicContact CE1-CG 4.33Å; F98-F297 HydrophobicContact CE2-CD2 4.41Å; F98-F297 HydrophobicContact CG-CD2 4.42Å; F98-F297 HydrophobicContact CZ-CB 4.07Å; F98-F297 HydrophobicContact CZ-CD2 4.14Å; L102-F297 HydrophobicContact CD1-CE1 4.39Å; L102-F297 HydrophobicContact CD1-CZ 4.35Å; V105-F297 HydrophobicContact CG1-CE2 4.4Å; V105-F297 HydrophobicContact CG1-CZ 4.45Å; V105-F297 HydrophobicContact CG2-CE2 4.35Å; V105-F297 HydrophobicContact CG2-CZ 4.33Å; P236-F297 HydrophobicContact CB-CZ 4.02Å; P236-F297 HydrophobicContact CG-CE1 4.19Å; P236-F297 HydrophobicContact CG-CZ 3.87Å; V238-F297 HydrophobicContact CB-CD2 4.16Å; V238-F297 HydrophobicContact CB-CE2 4.29Å; V238-F297 HydrophobicContact CG1-CB 4.42Å; V238-F297 HydrophobicContact CG1-CD2 4.01Å; V238-F297 HydrophobicContact CG1-CG 4.26Å; V238-F297 HydrophobicContact CG2-CD2 4.44Å; V238-F297 HydrophobicContact CG2-CE2 4.37Å; V239-F297 HydrophobicContact CG2-CD1 3.63Å; V239-F297 HydrophobicContact CG2-CE1 3.45Å; V239-F297 VanDerWaalsContact CG2-CE1 3.45Å; V239-F297 HydrophobicContact CG2-CZ 4.3Å; L293-F297 PolarHBondContact O-N 3.15Å; L294-F297 PolarHBondContact O-N 3.08Å; K295-F297 VanDerWaalsContact C-N 3.35Å; F297-R299 VanDerWaalsContact C-N 3.34Å; F297-R299 PolarHBondContact O-N 3.21Å; F297-D300 PolarHBondContact O-N 3.33Å; F297-M301 HydrophobicContact CE1-SD 4.17Å; F297-M301 VanDerWaalsContact O-CG 3.25Å; F297-M301 WeakPolarHBondContact O-CG 3.37Å; F297-M301 PolarHBondContact O-N 3.33Å
298	L	95.9	Very high	94.4	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-42	-177.9	-66.9	164.1	0	0	0	112.1	L294 M301 L305 L347 F383 L387	L294-L298 HydrophobicContact CD1-CD1 4.31Å; L294-L298 HydrophobicContact CG-CD1 4.35Å; L294-L298 WeakPolarHBondContact O-CD1 3.47Å; L294-L298 WeakPolarHBondContact O-CG 3.13Å; L294-L298 PolarHBondContact O-N 2.97Å; L298-M301 HydrophobicContact CD2-CE 4.33Å; L298-L305 HydrophobicContact CD2-CD2 4.17Å; L298-L347 HydrophobicContact CD1-CD1 4.3Å; L298-L347 HydrophobicContact CD1-CD2 3.72Å; L298-L347 HydrophobicContact CD2-CD2 4.17Å; L298-F383 HydrophobicContact CD1-CD1 3.95Å; L298-F383 HydrophobicContact CD1-CE1 3.74Å; L298-L387 HydrophobicContact CB-CD2 4.35Å; L298-L387 HydrophobicContact CD1-CD2 4.03Å; L298-L387 HydrophobicContact CD2-CD2 3.92Å; L298-L387 HydrophobicContact CG-CD2 4.32Å
299	R	93.9	Very high	94	Very high	103 Å²	103	25.8 Å²	25.8	39%	0.389	12%	0.123	S	C	.	.	H	α-helix	trans	-71.3	-36.9	180	-174.5	-161.9	66.6	-148.6	-3.3	113.8	K295 E296 F297 M301 N386	K295-R299 WeakPolarHBondContact O-CB 3.47Å; K295-R299 PolarHBondContact O-N 2.91Å; K295-R299 VanDerWaalsContact O-N 3.08Å; E296-R299 VanDerWaalsContact CD-NH2 3.32Å; E296-R299 PolarHBondContact O-N 3.25Å; E296-R299 IonicContact OE1-CZ 3.68Å; E296-R299 IonicContact OE1-NH1 3.48Å; E296-R299 PolarHBondContact OE1-NH1 3.38Å; E296-R299 IonicContact OE1-NH2 2.94Å; E296-R299 PolarHBondContact OE1-NH2 3.21Å; F297-R299 VanDerWaalsContact C-N 3.34Å; F297-R299 PolarHBondContact O-N 3.21Å; R299-M301 VanDerWaalsContact C-N 3.26Å; R299-M301 PolarHBondContact O-N 3.01Å; R299-N386 HydrophobicContact CB-CB 4.38Å; R299-N386 VanDerWaalsContact CB-OD1 3.31Å; R299-N386 WeakPolarHBondContact CB-OD1 3.41Å; R299-N386 WeakPolarHBondContact CG-OD1 3.47Å
300	D	92.3	Very high	93.7	Very high	39 Å²	39	25.6 Å²	25.6	21%	0.209	12%	0.122	C	C	.	.	H	α-helix	trans	-81	-4.5	-176.8	-73.2	12.5	0	0	0	112.3	S99 R270 E296 F297	S99-D300 WeakPolarHBondContact CA-O 3.39Å; R270-D300 IonicContact CZ-OD2 3.7Å; R270-D300 IonicContact NE-OD2 2.78Å; R270-D300 PolarHBondContact NE-OD2 3.16Å; R270-D300 IonicContact NH2-OD2 3.71Å; R270-D300 PolarHBondContact NH2-OD2 3.22Å; E296-D300 WeakPolarHBondContact O-CB 3.27Å; E296-D300 PolarHBondContact O-N 3.24Å; F297-D300 PolarHBondContact O-N 3.33Å
301	M	90.3	Very high	93.4	Very high	14 Å²	14	26.4 Å²	26.4	7%	0.069	13%	0.125	C	C	.	.	S	Bend	trans	-62	142.3	177.4	-65.5	-158.7	-64.3	0	0	112.3	L102 F297 L298 R299 D303 L305	L102-M301 HydrophobicContact CB-SD 4.25Å; L102-M301 HydrophobicContact CD1-SD 4.09Å; F297-M301 HydrophobicContact CE1-SD 4.17Å; F297-M301 VanDerWaalsContact O-CG 3.25Å; F297-M301 WeakPolarHBondContact O-CG 3.37Å; F297-M301 PolarHBondContact O-N 3.33Å; L298-M301 HydrophobicContact CD2-CE 4.33Å; R299-M301 VanDerWaalsContact C-N 3.26Å; R299-M301 PolarHBondContact O-N 3.01Å; M301-D303 WeakPolarHBondContact CB-O 3.31Å; M301-D303 PolarHBondContact O-N 2.8Å; M301-L305 HydrophobicContact CE-CB 3.86Å; M301-L305 HydrophobicContact CE-CD1 4.26Å
302	P	88	Confident	93.2	Very high	60 Å²	60	29.6 Å²	29.6	39%	0.39	14%	0.144	S	C	.	.	S	Bend	trans	-72.2	-15.5	-177.5	29.4	-35.4	0	0	0	114	I100 P101 R308	I100-P302 VanDerWaalsContact C-CD 3.5Å; I100-P302 WeakPolarHBondContact O-CD 3.3Å; P101-P302 HydrophobicContact CB-CG 4.3Å; P101-P302 HydrophobicContact CG-CG 4.01Å; P302-R308 VanDerWaalsContact O-CZ 3.25Å; P302-R308 PolarHBondContact O-NH1 3.33Å; P302-R308 PolarHBondContact O-NH2 2.64Å
303	D	87.4	Confident	92.9	Very high	59 Å²	59	29.4 Å²	29.4	32%	0.316	14%	0.143	S	C	.	.	S	Bend	trans	-134.3	154.5	162.7	-166.6	19.1	0	0	0	109.9	M301 R308	M301-D303 WeakPolarHBondContact CB-O 3.31Å; M301-D303 PolarHBondContact O-N 2.8Å; D303-R308 WeakPolarHBondContact OD1-CD 3.47Å; D303-R308 WeakPolarHBondContact OD1-CG 3.34Å; D303-R308 IonicContact OD1-CZ 3.55Å; D303-R308 PolarHBondContact OD1-N 2.78Å; D303-R308 IonicContact OD1-NE 2.7Å; D303-R308 PolarHBondContact OD1-NE 3.45Å
304	A	91.6	Very high	92.8	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	14%	0.143	C	C	.	.			trans	-69	155.6	-179.1	0	0	0	0	0	111.6	L306 T307	A304-L306 VanDerWaalsContact C-N 3.31Å; A304-L306 PolarHBondContact O-N 2.97Å; A304-T307 WeakPolarHBondContact O-CA 3.31Å; A304-T307 PolarHBondContact O-N 2.73Å
305	L	94.4	Very high	92.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-39.5	-179.7	-172.5	59.6	0	0	0	112.2	L102 L298 M301 T307 N340 T343 L344 L347 L387	L102-L305 HydrophobicContact CD2-CD1 3.84Å; L298-L305 HydrophobicContact CD2-CD2 4.17Å; M301-L305 HydrophobicContact CE-CB 3.86Å; M301-L305 HydrophobicContact CE-CD1 4.26Å; L305-T307 PolarHBondContact O-N 2.84Å; L305-N340 HydrophobicContact CD1-CB 4.3Å; L305-N340 WeakPolarHBondContact O-CB 3.49Å; L305-N340 PolarHBondContact O-ND2 2.93Å; L305-T343 HydrophobicContact CD1-CG2 3.93Å; L305-T343 HydrophobicContact CD2-CG2 4.35Å; L305-L344 HydrophobicContact CD2-CB 4.02Å; L305-L344 HydrophobicContact CD2-CD1 3.92Å; L305-L344 HydrophobicContact CG-CB 4.3Å; L305-L344 HydrophobicContact CG-CD1 4.42Å; L305-L347 HydrophobicContact CD2-CD2 4.09Å; L305-L387 HydrophobicContact CB-CD2 3.88Å; L305-L387 HydrophobicContact CD2-CD2 3.78Å; L305-L387 HydrophobicContact CG-CD2 4.48Å
306	L	94.4	Very high	92.4	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	6.7	174.2	-62.6	-174.6	0	0	0	114	A304 F314 L336 L344 L387 L388 M419	A304-L306 VanDerWaalsContact C-N 3.31Å; A304-L306 PolarHBondContact O-N 2.97Å; L306-F314 HydrophobicContact CB-CD2 4.16Å; L306-F314 HydrophobicContact CB-CE2 3.87Å; L306-F314 HydrophobicContact CD1-CD2 4.42Å; L306-F314 HydrophobicContact CD1-CE2 4.39Å; L306-F314 HydrophobicContact CD2-CE2 4.3Å; L306-F314 HydrophobicContact CD2-CZ 4.16Å; L306-F314 HydrophobicContact CG-CE2 4.41Å; L306-L336 HydrophobicContact CD2-CD1 3.95Å; L306-L336 WeakPolarHBondContact O-CD2 3.39Å; L306-L344 HydrophobicContact CD2-CD1 3.69Å; L306-L344 HydrophobicContact CD2-CD2 3.44Å; L306-L344 VanDerWaalsContact CD2-CD2 3.44Å; L306-L344 HydrophobicContact CD2-CG 4.17Å; L306-L387 PolarHBondContact N-O 2.91Å; L306-L388 HydrophobicContact CB-CD1 3.88Å; L306-L388 HydrophobicContact CD1-CB 4.18Å; L306-L388 HydrophobicContact CD1-CD1 4.13Å; L306-L388 HydrophobicContact CD1-CD2 4.37Å; L306-L388 HydrophobicContact CD1-CG 4.46Å; L306-M419 HydrophobicContact CD1-CE 4.04Å; L306-M419 HydrophobicContact CD1-SD 4.17Å; L306-M419 HydrophobicContact CD2-CE 3.85Å
307	T	91.8	Very high	92.3	Very high	5 Å²	5	27.6 Å²	27.6	3%	0.031	14%	0.136	C	C	.	.			trans	62.8	159	-174.5	77.8	0	0	0	0	114.5	P66 A304 L305 L310 L336	P66-T307 HydrophobicContact CB-CG2 3.86Å; P66-T307 HydrophobicContact CG-CG2 4Å; P66-T307 WeakPolarHBondContact CG-OG1 3.48Å; A304-T307 WeakPolarHBondContact O-CA 3.31Å; A304-T307 PolarHBondContact O-N 2.73Å; L305-T307 PolarHBondContact O-N 2.84Å; T307-L310 PolarHBondContact OG1-N 3.49Å; T307-L336 HydrophobicContact CG2-CD2 3.95Å
308	R	87.8	Confident	92.2	Very high	76 Å²	76	29.7 Å²	29.7	29%	0.287	15%	0.149	S	C	.	.	S	Bend	trans	-80.3	-28.7	172.2	-75.4	156.8	-171.5	155.3	22.2	113.7	P302 D303 L310 Y311 Q391	P302-R308 VanDerWaalsContact O-CZ 3.25Å; P302-R308 PolarHBondContact O-NH1 3.33Å; P302-R308 PolarHBondContact O-NH2 2.64Å; D303-R308 WeakPolarHBondContact OD1-CD 3.47Å; D303-R308 WeakPolarHBondContact OD1-CG 3.34Å; D303-R308 IonicContact OD1-CZ 3.55Å; D303-R308 PolarHBondContact OD1-N 2.78Å; D303-R308 IonicContact OD1-NE 2.7Å; D303-R308 PolarHBondContact OD1-NE 3.45Å; R308-L310 VanDerWaalsContact C-N 3.32Å; R308-L310 PolarHBondContact O-N 3.27Å; R308-Y311 WeakPolarHBondContact O-CB 3.45Å; R308-Y311 PolarHBondContact O-N 3.42Å; R308-Q391 HydrophobicContact CG-CB 4.34Å
309	E	89.6	Confident	91.9	Very high	76 Å²	76	36 Å²	36	36%	0.355	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-35.5	-178.7	-77.1	-180	-110	0	0	111.5	T64 P66 K67	T64-E309 PolarHBondContact OG1-OE2 2.86Å; P66-E309 HydrophobicContact CB-CB 4.42Å; P66-E309 HydrophobicContact CG-CB 4.19Å; K67-E309 PolarHBondContact N-OE1 3.25Å; K67-E309 IonicContact NZ-OE2 2.85Å; K67-E309 PolarHBondContact NZ-OE2 3.08Å
310	L	92.2	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	3.7	178.3	-56.9	179.5	0	0	0	114.6	I63 P66 T307 R308 T312 A313 F314 L332 L335 L336	I63-L310 HydrophobicContact CG2-CD2 4.03Å; P66-L310 HydrophobicContact CG-CD1 3.95Å; P66-L310 HydrophobicContact CG-CD2 4.33Å; P66-L310 HydrophobicContact CG-CG 3.79Å; T307-L310 PolarHBondContact OG1-N 3.49Å; R308-L310 VanDerWaalsContact C-N 3.32Å; R308-L310 PolarHBondContact O-N 3.27Å; L310-T312 PolarHBondContact O-N 3.46Å; L310-A313 PolarHBondContact O-N 3.2Å; L310-A313 VanDerWaalsContact O-N 3.17Å; L310-F314 HydrophobicContact CB-CD2 3.77Å; L310-F314 HydrophobicContact CB-CE2 3.7Å; L310-F314 HydrophobicContact CD1-CE2 4.02Å; L310-F314 WeakPolarHBondContact O-CD2 3.46Å; L310-F314 PolarHBondContact O-N 3.02Å; L310-L332 HydrophobicContact CD2-CD2 4.29Å; L310-L335 HydrophobicContact CD1-CB 3.93Å; L310-L335 HydrophobicContact CD2-CB 4.43Å; L310-L335 HydrophobicContact CD2-CD2 3.93Å; L310-L336 HydrophobicContact CD1-CD2 3.86Å; L310-L336 HydrophobicContact CD1-CG 4.33Å
311	Y	92.3	Very high	91.8	Very high	18 Å²	18	36.3 Å²	36.3	7%	0.071	19%	0.192	C	C	.	.	H	α-helix	trans	-54.2	-54.7	-172.7	175.9	-95.1	0	0	0	112.5	R308 A313 F314 I315 L388 K390 V412	R308-Y311 WeakPolarHBondContact O-CB 3.45Å; R308-Y311 PolarHBondContact O-N 3.42Å; Y311-A313 VanDerWaalsContact C-N 3.32Å; Y311-A313 PolarHBondContact O-N 3.39Å; Y311-F314 PolarHBondContact O-N 2.89Å; Y311-I315 HydrophobicContact CD1-CG1 4.43Å; Y311-I315 HydrophobicContact CE1-CG1 3.98Å; Y311-I315 HydrophobicContact CE2-CD1 4.32Å; Y311-I315 HydrophobicContact CE2-CG1 4.25Å; Y311-I315 WeakPolarHBondContact O-CG1 3.46Å; Y311-I315 PolarHBondContact O-N 2.79Å; Y311-I315 VanDerWaalsContact O-N 3.13Å; Y311-L388 HydrophobicContact CD2-CD1 3.66Å; Y311-L388 HydrophobicContact CD2-CG 3.76Å; Y311-L388 HydrophobicContact CE2-CD1 4.34Å; Y311-L388 HydrophobicContact CE2-CG 3.92Å; Y311-L388 HydrophobicContact CG-CD1 4.49Å; Y311-K390 HydrophobicContact CD1-CB 4.34Å; Y311-K390 HydrophobicContact CD1-CG 4.15Å; Y311-K390 HydrophobicContact CE1-CB 3.87Å; Y311-K390 HydrophobicContact CE1-CD 4.02Å; Y311-K390 HydrophobicContact CE1-CG 3.85Å; Y311-K390 HydrophobicContact CE2-CB 4.36Å; Y311-V412 HydrophobicContact CE2-CG2 4.34Å
312	T	91.9	Very high	91.7	Very high	67 Å²	67	41.8 Å²	41.8	41%	0.411	22%	0.22	S	C	.	.	H	α-helix	trans	-64.7	-36.3	-178.9	-47	0	0	0	0	111.9	C61 L310 I315 N316	C61-T312 HydrophobicContact CB-CG2 3.71Å; L310-T312 PolarHBondContact O-N 3.46Å; T312-I315 PolarHBondContact O-N 2.89Å; T312-N316 WeakPolarHBondContact O-CB 3.36Å; T312-N316 VanDerWaalsContact O-CG 3.26Å; T312-N316 PolarHBondContact O-N 3.11Å; T312-N316 PolarHBondContact O-OD1 2.85Å
313	A	93.6	Very high	91.5	Very high	3 Å²	3	45.9 Å²	45.9	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-44.3	178.5	0	0	0	0	0	111.6	L59 I63 L310 Y311 N316 T317 L332	L59-A313 HydrophobicContact CD1-CB 4.41Å; I63-A313 HydrophobicContact CG1-CB 4.35Å; L310-A313 PolarHBondContact O-N 3.2Å; L310-A313 VanDerWaalsContact O-N 3.17Å; Y311-A313 VanDerWaalsContact C-N 3.32Å; Y311-A313 PolarHBondContact O-N 3.39Å; A313-N316 PolarHBondContact O-N 3Å; A313-T317 WeakPolarHBondContact O-CG2 3.41Å; A313-T317 PolarHBondContact O-N 3.01Å; A313-L332 HydrophobicContact CB-CD1 4.08Å; A313-L332 HydrophobicContact CB-CD2 3.69Å
314	F	94.9	Very high	91.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-44.6	173.8	-82	-64.7	0	0	0	112.2	L306 L310 Y311 T317 L332 L388 V415 M419	L306-F314 HydrophobicContact CB-CD2 4.16Å; L306-F314 HydrophobicContact CB-CE2 3.87Å; L306-F314 HydrophobicContact CD1-CD2 4.42Å; L306-F314 HydrophobicContact CD1-CE2 4.39Å; L306-F314 HydrophobicContact CD2-CE2 4.3Å; L306-F314 HydrophobicContact CD2-CZ 4.16Å; L306-F314 HydrophobicContact CG-CE2 4.41Å; L310-F314 HydrophobicContact CB-CD2 3.77Å; L310-F314 HydrophobicContact CB-CE2 3.7Å; L310-F314 HydrophobicContact CD1-CE2 4.02Å; L310-F314 WeakPolarHBondContact O-CD2 3.46Å; L310-F314 PolarHBondContact O-N 3.02Å; Y311-F314 PolarHBondContact O-N 2.89Å; F314-T317 PolarHBondContact O-N 3.06Å; F314-T317 PolarHBondContact O-OG1 2.95Å; F314-L332 HydrophobicContact CD1-CB 4.3Å; F314-L332 HydrophobicContact CD1-CD1 3.97Å; F314-L332 HydrophobicContact CE1-CB 3.66Å; F314-L332 HydrophobicContact CE1-CD1 4.2Å; F314-L332 HydrophobicContact CE2-CB 4.41Å; F314-L332 HydrophobicContact CG-CD1 4.33Å; F314-L332 HydrophobicContact CZ-CB 3.72Å; F314-L388 HydrophobicContact CB-CD1 4.23Å; F314-L388 HydrophobicContact CB-CD2 3.94Å; F314-L388 HydrophobicContact CD2-CD1 4.2Å; F314-V415 HydrophobicContact CB-CG1 4.47Å; F314-V415 HydrophobicContact CD1-CG1 4.22Å; F314-V415 VanDerWaalsContact O-CG2 3.26Å; F314-V415 WeakPolarHBondContact O-CG2 3.42Å; F314-M419 HydrophobicContact CE1-SD 4.47Å
315	I	93.1	Very high	91.7	Very high	22 Å²	22	46.9 Å²	46.9	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-47.7	176.1	-61.7	-59.3	0	0	0	111	Y311 T312 T317 T318 L388 A411 V412	Y311-I315 HydrophobicContact CD1-CG1 4.43Å; Y311-I315 HydrophobicContact CE1-CG1 3.98Å; Y311-I315 HydrophobicContact CE2-CD1 4.32Å; Y311-I315 HydrophobicContact CE2-CG1 4.25Å; Y311-I315 WeakPolarHBondContact O-CG1 3.46Å; Y311-I315 PolarHBondContact O-N 2.79Å; Y311-I315 VanDerWaalsContact O-N 3.13Å; T312-I315 PolarHBondContact O-N 2.89Å; I315-T317 PolarHBondContact O-N 3.17Å; I315-T317 VanDerWaalsContact O-N 3.13Å; I315-T318 PolarHBondContact O-N 2.83Å; I315-T318 PolarHBondContact O-OG1 2.73Å; I315-T318 VanDerWaalsContact O-OG1 3.06Å; I315-L388 HydrophobicContact CD1-CD2 4.15Å; I315-A411 HydrophobicContact CD1-CB 4.04Å; I315-A411 HydrophobicContact CG2-CB 3.96Å; I315-V412 HydrophobicContact CD1-CB 4.47Å; I315-V412 HydrophobicContact CD1-CG2 3.56Å
316	N	93.2	Very high	91.6	Very high	30 Å²	30	51.1 Å²	51.1	16%	0.16	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-15.8	-175.5	-72.1	12.5	0	0	0	113.2	L59 T312 A313 T318 L319	L59-N316 HydrophobicContact CD2-CB 3.88Å; L59-N316 WeakPolarHBondContact O-CB 3.25Å; L59-N316 PolarHBondContact O-ND2 3.41Å; T312-N316 WeakPolarHBondContact O-CB 3.36Å; T312-N316 VanDerWaalsContact O-CG 3.26Å; T312-N316 PolarHBondContact O-N 3.11Å; T312-N316 PolarHBondContact O-OD1 2.85Å; A313-N316 PolarHBondContact O-N 3Å; N316-T318 PolarHBondContact O-N 2.82Å; N316-L319 HydrophobicContact CB-CD1 4.38Å; N316-L319 WeakPolarHBondContact O-CB 3.38Å; N316-L319 PolarHBondContact O-N 2.56Å
317	T	94	Very high	91.4	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-54.2	-35.2	167.6	68	0	0	0	0	112.2	L59 A313 F314 I315 L319 L320 Q325 V328 L332	L59-T317 HydrophobicContact CD2-CG2 4.48Å; A313-T317 WeakPolarHBondContact O-CG2 3.41Å; A313-T317 PolarHBondContact O-N 3.01Å; F314-T317 PolarHBondContact O-N 3.06Å; F314-T317 PolarHBondContact O-OG1 2.95Å; I315-T317 PolarHBondContact O-N 3.17Å; I315-T317 VanDerWaalsContact O-N 3.13Å; T317-L319 PolarHBondContact O-N 2.84Å; T317-L320 PolarHBondContact O-N 2.9Å; T317-Q325 WeakPolarHBondContact O-CG 3.29Å; T317-Q325 PolarHBondContact O-NE2 3.48Å; T317-V328 HydrophobicContact CG2-CB 4.49Å; T317-V328 HydrophobicContact CG2-CG1 3.82Å; T317-L332 HydrophobicContact CG2-CD1 3.75Å
318	T	92.9	Very high	91.6	Very high	46 Å²	46	53.1 Å²	53.1	28%	0.282	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-68.7	-2.4	-179.3	71.5	0	0	0	0	114	I315 N316 A411 A414 V415	I315-T318 PolarHBondContact O-N 2.83Å; I315-T318 PolarHBondContact O-OG1 2.73Å; I315-T318 VanDerWaalsContact O-OG1 3.06Å; N316-T318 PolarHBondContact O-N 2.82Å; T318-A411 HydrophobicContact CG2-CB 4.25Å; T318-A414 HydrophobicContact CG2-CB 4.37Å; T318-V415 HydrophobicContact CG2-CG2 3.59Å
319	L	91.5	Very high	92	Very high	134 Å²	134	49.6 Å²	49.6	70%	0.702	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-98.9	-14.8	176	-51.4	177.4	0	0	0	113.1	N316 T317	N316-L319 HydrophobicContact CB-CD1 4.38Å; N316-L319 WeakPolarHBondContact O-CB 3.38Å; N316-L319 PolarHBondContact O-N 2.56Å; T317-L319 PolarHBondContact O-N 2.84Å
320	L	92.3	Very high	92.3	Very high	30 Å²	30	47.2 Å²	47.2	16%	0.157	25%	0.252	C	S	.	.	S	Bend	trans	-82	171.5	177.5	-57.6	178.3	0	0	0	112	L59 T317 E324 Q325 V328	L59-L320 HydrophobicContact CD2-CD1 4.02Å; T317-L320 PolarHBondContact O-N 2.9Å; L320-E324 HydrophobicContact CB-CB 4.33Å; L320-Q325 HydrophobicContact CB-CG 4.12Å; L320-Q325 VanDerWaalsContact O-CD 3.27Å; L320-Q325 PolarHBondContact O-NE2 2.89Å; L320-V328 HydrophobicContact CD1-CB 4.05Å; L320-V328 HydrophobicContact CD1-CG1 4.04Å; L320-V328 HydrophobicContact CD1-CG2 3.69Å
321	D	91.3	Very high	92.4	Very high	119 Å²	119	47.8 Å²	47.8	64%	0.636	26%	0.255	S	S	*	.			trans	-71.9	157.4	175.1	-83.2	-38.4	0	0	0	112.6	D323 E324 Q325	D321-D323 VanDerWaalsContact C-N 3.27Å; D321-D323 PolarHBondContact O-N 2.86Å; D321-E324 HydrophobicContact CB-CG 4.43Å; D321-E324 PolarHBondContact O-N 2.71Å; D321-E324 VanDerWaalsContact O-N 3.17Å; D321-Q325 WeakPolarHBondContact O-CB 3.36Å; D321-Q325 WeakPolarHBondContact O-CG 3.32Å; D321-Q325 PolarHBondContact O-N 3.48Å
322	L	86.8	Confident	92.6	Very high	128 Å²	128	46.9 Å²	46.9	67%	0.67	25%	0.251	S	S	*	.	H	α-helix	trans	-60.4	-34.8	-171.2	-86.7	72.8	0	0	0	113.7
323	D	84.3	Confident	92.8	Very high	147 Å²	147	43.7 Å²	43.7	79%	0.786	23%	0.232	S	C	*	.	H	α-helix	trans	-74.6	-36.2	-179.5	-59	-39.1	0	0	0	111.5	D321	D321-D323 VanDerWaalsContact C-N 3.27Å; D321-D323 PolarHBondContact O-N 2.86Å
324	E	91.2	Very high	92.9	Very high	72 Å²	72	43.9 Å²	43.9	34%	0.336	23%	0.232	S	C	.	.	H	α-helix	trans	-73	-36.7	175.9	-58	-172.1	136.3	0	0	112.1	Y57 L320 D321 Q326 S327 V328	Y57-E324 HydrophobicContact CE1-CB 4.06Å; Y57-E324 HydrophobicContact CE1-CG 4.18Å; L320-E324 HydrophobicContact CB-CB 4.33Å; D321-E324 HydrophobicContact CB-CG 4.43Å; D321-E324 PolarHBondContact O-N 2.71Å; D321-E324 VanDerWaalsContact O-N 3.17Å; E324-Q326 PolarHBondContact O-N 2.8Å; E324-Q326 VanDerWaalsContact O-N 3.13Å; E324-S327 PolarHBondContact O-N 3.5Å; E324-V328 WeakPolarHBondContact O-CG2 3.07Å; E324-V328 PolarHBondContact O-N 3.1Å
325	Q	93.1	Very high	92.9	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-53.5	-35.9	-175.7	-86.1	168.4	-10.6	0	0	113.7	T317 L320 D321 T329 R418	T317-Q325 WeakPolarHBondContact O-CG 3.29Å; T317-Q325 PolarHBondContact O-NE2 3.48Å; L320-Q325 HydrophobicContact CB-CG 4.12Å; L320-Q325 VanDerWaalsContact O-CD 3.27Å; L320-Q325 PolarHBondContact O-NE2 2.89Å; D321-Q325 WeakPolarHBondContact O-CB 3.36Å; D321-Q325 WeakPolarHBondContact O-CG 3.32Å; D321-Q325 PolarHBondContact O-N 3.48Å; Q325-T329 VanDerWaalsContact O-CB 3.24Å; Q325-T329 WeakPolarHBondContact O-CB 3.43Å; Q325-T329 PolarHBondContact O-N 2.9Å; Q325-T329 PolarHBondContact O-OG1 3.06Å; Q325-R418 VanDerWaalsContact CD-NH2 3.31Å
326	Q	90.9	Very high	93	Very high	90 Å²	90	42.9 Å²	42.9	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-72.4	-47.7	176	-174.7	171.5	-57.9	0	0	111.6	E324 T329 Q330 T425 L426	E324-Q326 PolarHBondContact O-N 2.8Å; E324-Q326 VanDerWaalsContact O-N 3.13Å; Q326-T329 PolarHBondContact O-N 2.85Å; Q326-Q330 WeakPolarHBondContact O-CB 3.44Å; Q326-Q330 PolarHBondContact O-N 3.34Å; Q326-T425 PolarHBondContact NE2-OG1 3.18Å; Q326-L426 HydrophobicContact CG-CD2 4.19Å
327	S	92.1	Very high	92.9	Very high	48 Å²	48	42 Å²	42	34%	0.336	22%	0.222	S	C	.	.	H	α-helix	trans	-60.9	-46.4	-179.9	-54.6	0	0	0	0	111.9	E324 Q330 L331	E324-S327 PolarHBondContact O-N 3.5Å; S327-Q330 WeakPolarHBondContact O-CB 3.43Å; S327-Q330 PolarHBondContact O-N 3.3Å; S327-L331 WeakPolarHBondContact O-CG 3.4Å; S327-L331 PolarHBondContact O-N 2.94Å
328	V	95.4	Very high	92.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-40	177.3	177.2	0	0	0	0	111.5	L53 Y57 L59 T317 L320 E324 Q330 L331 L332	L53-V328 HydrophobicContact CD2-CG1 3.84Å; Y57-V328 HydrophobicContact CD1-CG2 3.46Å; Y57-V328 VanDerWaalsContact CD1-CG2 3.46Å; Y57-V328 HydrophobicContact CD2-CG2 3.68Å; Y57-V328 HydrophobicContact CE1-CG2 3.53Å; Y57-V328 HydrophobicContact CE2-CG2 3.72Å; Y57-V328 HydrophobicContact CG-CG2 3.54Å; L59-V328 HydrophobicContact CD1-CG1 3.74Å; L59-V328 HydrophobicContact CD2-CG1 4.17Å; L59-V328 HydrophobicContact CG-CG1 4.25Å; T317-V328 HydrophobicContact CG2-CB 4.49Å; T317-V328 HydrophobicContact CG2-CG1 3.82Å; L320-V328 HydrophobicContact CD1-CB 4.05Å; L320-V328 HydrophobicContact CD1-CG1 4.04Å; L320-V328 HydrophobicContact CD1-CG2 3.69Å; E324-V328 WeakPolarHBondContact O-CG2 3.07Å; E324-V328 PolarHBondContact O-N 3.1Å; V328-Q330 VanDerWaalsContact C-N 3.31Å; V328-Q330 PolarHBondContact O-N 2.85Å; V328-L331 PolarHBondContact O-N 3Å; V328-L332 HydrophobicContact CG1-CD1 4.13Å; V328-L332 HydrophobicContact CG1-CG 4.47Å; V328-L332 WeakPolarHBondContact O-CB 3.21Å; V328-L332 VanDerWaalsContact O-CG 3.3Å; V328-L332 WeakPolarHBondContact O-CG 3.4Å; V328-L332 PolarHBondContact O-N 3.22Å
329	T	95.6	Very high	92.7	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-39.9	173.9	-61	0	0	0	0	111.4	Q325 Q326 L332 I333 M419 L426	Q325-T329 VanDerWaalsContact O-CB 3.24Å; Q325-T329 WeakPolarHBondContact O-CB 3.43Å; Q325-T329 PolarHBondContact O-N 2.9Å; Q325-T329 PolarHBondContact O-OG1 3.06Å; Q326-T329 PolarHBondContact O-N 2.85Å; T329-L332 PolarHBondContact O-N 2.99Å; T329-I333 HydrophobicContact CG2-CD1 4.03Å; T329-I333 WeakPolarHBondContact O-CD1 3.42Å; T329-I333 VanDerWaalsContact O-CG1 3.27Å; T329-I333 WeakPolarHBondContact O-CG1 3.49Å; T329-I333 PolarHBondContact O-N 2.65Å; T329-M419 HydrophobicContact CG2-CG 3.71Å; T329-M419 HydrophobicContact CG2-SD 4.2Å; T329-L426 HydrophobicContact CG2-CD1 4.31Å; T329-L426 HydrophobicContact CG2-CD2 4.03Å
330	Q	95.3	Very high	92.8	Very high	27 Å²	27	35.7 Å²	35.7	13%	0.126	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-48.2	175.8	177.5	174.6	78.7	0	0	111.8	Q326 S327 V328 L332 I333 Y334 T425 L426 M428	Q326-Q330 WeakPolarHBondContact O-CB 3.44Å; Q326-Q330 PolarHBondContact O-N 3.34Å; S327-Q330 WeakPolarHBondContact O-CB 3.43Å; S327-Q330 PolarHBondContact O-N 3.3Å; V328-Q330 VanDerWaalsContact C-N 3.31Å; V328-Q330 PolarHBondContact O-N 2.85Å; Q330-L332 PolarHBondContact O-N 2.64Å; Q330-I333 WeakPolarHBondContact O-CB 3.47Å; Q330-I333 PolarHBondContact O-N 2.84Å; Q330-I333 VanDerWaalsContact O-N 3.12Å; Q330-Y334 HydrophobicContact CG-CE1 3.93Å; Q330-Y334 HydrophobicContact CG-CE2 3.73Å; Q330-Y334 WeakPolarHBondContact CG-OH 3.29Å; Q330-Y334 PolarHBondContact NE2-OH 3.34Å; Q330-Y334 PolarHBondContact O-N 3.33Å; Q330-Y334 VanDerWaalsContact O-N 3.12Å; Q330-T425 PolarHBondContact NE2-O 3.31Å; Q330-L426 HydrophobicContact CB-CD2 3.91Å; Q330-M428 PolarHBondContact NE2-O 3.15Å; Q330-M428 VanDerWaalsContact NE2-O 3.14Å
331	L	95.7	Very high	93	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.058	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-43.7	176.3	-66.1	172.5	0	0	0	111.6	A49 R52 L53 Y57 S327 V328 I333 Y334 L335 L433	A49-L331 HydrophobicContact CB-CB 4.4Å; A49-L331 HydrophobicContact CB-CD2 3.76Å; R52-L331 HydrophobicContact CB-CD1 4.22Å; L53-L331 HydrophobicContact CD1-CB 3.88Å; L53-L331 HydrophobicContact CD2-CB 3.84Å; L53-L331 HydrophobicContact CD2-CD1 3.97Å; L53-L331 HydrophobicContact CG-CB 3.71Å; L53-L331 HydrophobicContact CG-CD1 4Å; L53-L331 HydrophobicContact CG-CG 4.49Å; Y57-L331 HydrophobicContact CD2-CD1 4.35Å; Y57-L331 HydrophobicContact CE2-CD1 3.82Å; S327-L331 WeakPolarHBondContact O-CG 3.4Å; S327-L331 PolarHBondContact O-N 2.94Å; V328-L331 PolarHBondContact O-N 3Å; L331-I333 VanDerWaalsContact C-N 3.28Å; L331-I333 PolarHBondContact O-N 3.13Å; L331-Y334 HydrophobicContact CD2-CD2 4.33Å; L331-Y334 WeakPolarHBondContact O-CB 3.38Å; L331-Y334 PolarHBondContact O-N 2.72Å; L331-L335 VanDerWaalsContact O-CD1 3.27Å; L331-L335 WeakPolarHBondContact O-CD1 3.44Å; L331-L335 PolarHBondContact O-N 2.98Å; L331-L335 VanDerWaalsContact O-N 3.17Å; L331-L433 HydrophobicContact CD2-CD1 3.78Å; L331-L433 HydrophobicContact CD2-CD2 4.47Å
332	L	96.3	Very high	93.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-31.3	175.5	-70.1	172.1	0	0	0	113.1	L53 L310 A313 F314 T317 V328 T329 Q330 Y334 L335	L53-L332 HydrophobicContact CD1-CD2 3.79Å; L53-L332 HydrophobicContact CD1-CG 4.22Å; L53-L332 HydrophobicContact CD2-CG 4.49Å; L310-L332 HydrophobicContact CD2-CD2 4.29Å; A313-L332 HydrophobicContact CB-CD1 4.08Å; A313-L332 HydrophobicContact CB-CD2 3.69Å; F314-L332 HydrophobicContact CD1-CB 4.3Å; F314-L332 HydrophobicContact CD1-CD1 3.97Å; F314-L332 HydrophobicContact CE1-CB 3.66Å; F314-L332 HydrophobicContact CE1-CD1 4.2Å; F314-L332 HydrophobicContact CE2-CB 4.41Å; F314-L332 HydrophobicContact CG-CD1 4.33Å; F314-L332 HydrophobicContact CZ-CB 3.72Å; T317-L332 HydrophobicContact CG2-CD1 3.75Å; V328-L332 HydrophobicContact CG1-CD1 4.13Å; V328-L332 HydrophobicContact CG1-CG 4.47Å; V328-L332 WeakPolarHBondContact O-CB 3.21Å; V328-L332 VanDerWaalsContact O-CG 3.3Å; V328-L332 WeakPolarHBondContact O-CG 3.4Å; V328-L332 PolarHBondContact O-N 3.22Å; T329-L332 PolarHBondContact O-N 2.99Å; Q330-L332 PolarHBondContact O-N 2.64Å; L332-Y334 VanDerWaalsContact C-N 3.34Å; L332-L335 PolarHBondContact O-N 3.35Å
333	I	95.9	Very high	93.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-69.5	-31.2	172.8	-73.8	164.3	0	0	0	111.8	T329 Q330 L331 L336 L344 M419 L426 F427	T329-I333 HydrophobicContact CG2-CD1 4.03Å; T329-I333 WeakPolarHBondContact O-CD1 3.42Å; T329-I333 VanDerWaalsContact O-CG1 3.27Å; T329-I333 WeakPolarHBondContact O-CG1 3.49Å; T329-I333 PolarHBondContact O-N 2.65Å; Q330-I333 WeakPolarHBondContact O-CB 3.47Å; Q330-I333 PolarHBondContact O-N 2.84Å; Q330-I333 VanDerWaalsContact O-N 3.12Å; L331-I333 VanDerWaalsContact C-N 3.28Å; L331-I333 PolarHBondContact O-N 3.13Å; I333-L336 HydrophobicContact CG1-CD1 4.48Å; I333-L336 WeakPolarHBondContact O-CB 3.2Å; I333-L336 PolarHBondContact O-N 3.34Å; I333-L344 HydrophobicContact CG1-CD2 4.23Å; I333-M419 HydrophobicContact CD1-CE 4.01Å; I333-M419 HydrophobicContact CG1-CE 4.26Å; I333-L426 HydrophobicContact CD1-CB 3.87Å; I333-L426 HydrophobicContact CD1-CD1 4.03Å; I333-L426 HydrophobicContact CD1-CD2 4.24Å; I333-L426 HydrophobicContact CD1-CG 4.27Å; I333-F427 HydrophobicContact CD1-CZ 4.45Å; I333-F427 HydrophobicContact CG2-CD1 3.79Å; I333-F427 HydrophobicContact CG2-CE1 3.36Å; I333-F427 HydrophobicContact CG2-CZ 3.94Å
334	Y	95.4	Very high	94.2	Very high	7 Å²	7	15.7 Å²	15.7	3%	0.027	9%	0.085	C	C	.	.	H	α-helix	trans	-70.7	-35.6	174.5	-58.6	-19.8	0	0	0	112.1	V34 L45 Q46 A49 Q330 L331 L332 L336 M428 V429 L433	V34-Y334 HydrophobicContact CG2-CD1 3.83Å; V34-Y334 HydrophobicContact CG2-CE1 3.45Å; V34-Y334 VanDerWaalsContact CG2-CE1 3.45Å; L45-Y334 HydrophobicContact CD1-CD2 3.94Å; L45-Y334 HydrophobicContact CD1-CE2 4.27Å; L45-Y334 HydrophobicContact CD2-CD1 4.12Å; L45-Y334 HydrophobicContact CD2-CD2 4.01Å; L45-Y334 HydrophobicContact CD2-CE2 4.4Å; L45-Y334 HydrophobicContact CD2-CG 3.87Å; L45-Y334 HydrophobicContact CG-CD2 3.97Å; L45-Y334 HydrophobicContact CG-CG 4.08Å; Q46-Y334 WeakPolarHBondContact CG-O 3.48Å; Q46-Y334 PolarHBondContact NE2-O 3.36Å; A49-Y334 HydrophobicContact CB-CD2 4.19Å; Q330-Y334 HydrophobicContact CG-CE1 3.93Å; Q330-Y334 HydrophobicContact CG-CE2 3.73Å; Q330-Y334 WeakPolarHBondContact CG-OH 3.29Å; Q330-Y334 PolarHBondContact NE2-OH 3.34Å; Q330-Y334 PolarHBondContact O-N 3.33Å; Q330-Y334 VanDerWaalsContact O-N 3.12Å; L331-Y334 HydrophobicContact CD2-CD2 4.33Å; L331-Y334 WeakPolarHBondContact O-CB 3.38Å; L331-Y334 PolarHBondContact O-N 2.72Å; L332-Y334 VanDerWaalsContact C-N 3.34Å; Y334-L336 PolarHBondContact O-N 3.34Å; Y334-M428 PolarHBondContact OH-O 3.03Å; Y334-M428 VanDerWaalsContact OH-O 3.07Å; Y334-V429 HydrophobicContact CE1-CG2 4.23Å; Y334-V429 WeakPolarHBondContact OH-CA 3.16Å; Y334-L433 HydrophobicContact CD2-CD1 4.4Å; Y334-L433 HydrophobicContact CE2-CD1 3.81Å
335	L	95.3	Very high	94.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.4	173.5	-89.7	65.4	0	0	0	113.7	A49 Y50 L53 I63 P66 L310 L331 L332	A49-L335 HydrophobicContact CB-CD1 3.74Å; Y50-L335 HydrophobicContact CD2-CD2 4.11Å; L53-L335 HydrophobicContact CD1-CD1 3.73Å; L53-L335 HydrophobicContact CD1-CD2 3.83Å; L53-L335 HydrophobicContact CD1-CG 4.44Å; I63-L335 HydrophobicContact CG2-CD2 3.58Å; P66-L335 WeakPolarHBondContact CD-O 3.41Å; L310-L335 HydrophobicContact CD1-CB 3.93Å; L310-L335 HydrophobicContact CD2-CB 4.43Å; L310-L335 HydrophobicContact CD2-CD2 3.93Å; L331-L335 VanDerWaalsContact O-CD1 3.27Å; L331-L335 WeakPolarHBondContact O-CD1 3.44Å; L331-L335 PolarHBondContact O-N 2.98Å; L331-L335 VanDerWaalsContact O-N 3.17Å; L332-L335 PolarHBondContact O-N 3.35Å
336	L	94.4	Very high	94.6	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.005	8%	0.076	C	C	.	.	S	Bend	trans	-64.9	143	179.7	-67.1	171.3	0	0	0	111.9	Q46 L306 T307 L310 I333 Y334 N340 L344	Q46-L336 PolarHBondContact NE2-O 3.31Å; L306-L336 HydrophobicContact CD2-CD1 3.95Å; L306-L336 WeakPolarHBondContact O-CD2 3.39Å; T307-L336 HydrophobicContact CG2-CD2 3.95Å; L310-L336 HydrophobicContact CD1-CD2 3.86Å; L310-L336 HydrophobicContact CD1-CG 4.33Å; I333-L336 HydrophobicContact CG1-CD1 4.48Å; I333-L336 WeakPolarHBondContact O-CB 3.2Å; I333-L336 PolarHBondContact O-N 3.34Å; Y334-L336 PolarHBondContact O-N 3.34Å; L336-N340 HydrophobicContact CB-CB 4.37Å; L336-L344 HydrophobicContact CD1-CD2 3.63Å
337	P	92.3	Very high	95	Very high	11 Å²	11	9.6 Å²	9.6	7%	0.071	6%	0.056	C	C	.	.			trans	-53.9	143.4	169.4	-24.8	34.2	0	0	0	111.2	P66 C339 N340 S341	P66-P337 HydrophobicContact CB-CG 4.11Å; P337-C339 PolarHBondContact O-N 2.77Å; P337-C339 VanDerWaalsContact O-N 3.1Å; P337-N340 HydrophobicContact CB-CB 4.49Å; P337-N340 WeakPolarHBondContact O-CA 3.38Å; P337-N340 WeakPolarHBondContact O-CB 3.3Å; P337-N340 PolarHBondContact O-N 2.83Å; P337-S341 PolarHBondContact O-N 3.31Å
338	A	90.4	Very high	95.3	Very high	18 Å²	18	7.3 Å²	7.3	15%	0.149	4%	0.04	C	C	.	.	H	α-helix	trans	-57.2	-34.9	-171.2	0	0	0	0	0	113.7	I231 Q234 D342	I231-A338 HydrophobicContact CD1-CB 4.11Å; Q234-A338 VanDerWaalsContact NE2-CB 3.32Å; A338-D342 WeakPolarHBondContact O-CB 3.06Å; A338-D342 PolarHBondContact O-N 3.27Å
339	C	91.5	Very high	95.4	Very high	11 Å²	11	10 Å²	10	7%	0.074	5%	0.052	C	C	.	.	H	α-helix	trans	-60.5	-44.8	172	-67.6	0	0	0	0	112.9	L102 I106 Q234 P337 T343	L102-C339 HydrophobicContact CD2-CB 4.22Å; L102-C339 HydrophobicContact CG-CB 4.4Å; I106-C339 HydrophobicContact CD1-CB 3.63Å; Q234-C339 HydrophobicContact CB-CB 4.45Å; P337-C339 PolarHBondContact O-N 2.77Å; P337-C339 VanDerWaalsContact O-N 3.1Å; C339-T343 VanDerWaalsContact O-CB 3.27Å; C339-T343 WeakPolarHBondContact O-CB 3.4Å; C339-T343 PolarHBondContact O-N 3.49Å; C339-T343 VanDerWaalsContact O-N 3.1Å; C339-T343 PolarHBondContact O-OG1 3.36Å
340	N	94.6	Very high	95.5	Very high	20 Å²	20	9.9 Å²	9.9	11%	0.107	5%	0.051	C	C	.	.	H	α-helix	trans	-68.3	-46.8	179.1	-69	58.6	0	0	0	110.7	L102 L305 L336 P337 T343 L344	L102-N340 HydrophobicContact CD2-CB 4.38Å; L305-N340 HydrophobicContact CD1-CB 4.3Å; L305-N340 WeakPolarHBondContact O-CB 3.49Å; L305-N340 PolarHBondContact O-ND2 2.93Å; L336-N340 HydrophobicContact CB-CB 4.37Å; P337-N340 HydrophobicContact CB-CB 4.49Å; P337-N340 WeakPolarHBondContact O-CA 3.38Å; P337-N340 WeakPolarHBondContact O-CB 3.3Å; P337-N340 PolarHBondContact O-N 2.83Å; N340-T343 PolarHBondContact O-N 3.35Å; N340-L344 WeakPolarHBondContact O-CB 3.07Å; N340-L344 PolarHBondContact O-N 3.49Å
341	S	94.6	Very high	95.6	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.014	5%	0.045	C	C	.	.	H	α-helix	trans	-59.6	-45	178.6	-173.4	0	0	0	0	112	R42 P337 L344 H345 F427	R42-S341 PolarHBondContact NH2-OG 3.29Å; P337-S341 PolarHBondContact O-N 3.31Å; S341-L344 PolarHBondContact O-N 3.3Å; S341-H345 PolarHBondContact O-N 3Å; S341-F427 WeakPolarHBondContact O-CE1 3.49Å
342	D	94.7	Very high	95.7	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-70.5	-41.7	179.7	-66.1	-0.1	0	0	0	112.4	Q35 R42 Q234 V235 A338 L344 H345 R346	Q35-D342 WeakPolarHBondContact CG-OD1 3.13Å; R42-D342 IonicContact CZ-OD1 2.81Å; R42-D342 VanDerWaalsContact CZ-OD1 3.23Å; R42-D342 IonicContact NH1-OD1 3.14Å; R42-D342 PolarHBondContact NH1-OD1 2.91Å; R42-D342 IonicContact NH1-OD2 3.67Å; R42-D342 PolarHBondContact NH1-OD2 2.98Å; R42-D342 IonicContact NH2-OD1 3.75Å; R42-D342 PolarHBondContact NH2-OD1 3.48Å; Q234-D342 HydrophobicContact CB-CB 4.16Å; Q234-D342 WeakPolarHBondContact CB-OD2 3.41Å; Q234-D342 PolarHBondContact N-OD2 3.45Å; V235-D342 HydrophobicContact CG2-CB 4.4Å; A338-D342 WeakPolarHBondContact O-CB 3.06Å; A338-D342 PolarHBondContact O-N 3.27Å; D342-L344 VanDerWaalsContact C-N 3.35Å; D342-H345 PolarHBondContact O-N 3.28Å; D342-R346 PolarHBondContact O-N 3.43Å; D342-R346 VanDerWaalsContact O-N 3.12Å
343	T	96.4	Very high	95.8	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.1	-38.3	176.2	-61	0	0	0	0	111.5	L102 Q234 P236 V239 L305 C339 N340 L347	L102-T343 HydrophobicContact CD1-CG2 4.34Å; Q234-T343 PolarHBondContact O-OG1 2.93Å; Q234-T343 VanDerWaalsContact O-OG1 3.12Å; P236-T343 VanDerWaalsContact CD-OG1 3.29Å; P236-T343 WeakPolarHBondContact CD-OG1 3.36Å; V239-T343 HydrophobicContact CG1-CG2 4.39Å; V239-T343 HydrophobicContact CG2-CG2 4.24Å; L305-T343 HydrophobicContact CD1-CG2 3.93Å; L305-T343 HydrophobicContact CD2-CG2 4.35Å; C339-T343 VanDerWaalsContact O-CB 3.27Å; C339-T343 WeakPolarHBondContact O-CB 3.4Å; C339-T343 PolarHBondContact O-N 3.49Å; C339-T343 VanDerWaalsContact O-N 3.1Å; C339-T343 PolarHBondContact O-OG1 3.36Å; N340-T343 PolarHBondContact O-N 3.35Å; T343-L347 WeakPolarHBondContact O-CB 3.46Å; T343-L347 PolarHBondContact O-N 3.21Å
344	L	97.1	Very high	95.9	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-64.5	-44.4	174.1	-179.8	72.1	0	0	0	111.5	L305 L306 I333 L336 N340 S341 D342 L347 L348 M419 F427	L305-L344 HydrophobicContact CD2-CB 4.02Å; L305-L344 HydrophobicContact CD2-CD1 3.92Å; L305-L344 HydrophobicContact CG-CB 4.3Å; L305-L344 HydrophobicContact CG-CD1 4.42Å; L306-L344 HydrophobicContact CD2-CD1 3.69Å; L306-L344 HydrophobicContact CD2-CD2 3.44Å; L306-L344 VanDerWaalsContact CD2-CD2 3.44Å; L306-L344 HydrophobicContact CD2-CG 4.17Å; I333-L344 HydrophobicContact CG1-CD2 4.23Å; L336-L344 HydrophobicContact CD1-CD2 3.63Å; N340-L344 WeakPolarHBondContact O-CB 3.07Å; N340-L344 PolarHBondContact O-N 3.49Å; S341-L344 PolarHBondContact O-N 3.3Å; D342-L344 VanDerWaalsContact C-N 3.35Å; L344-L347 PolarHBondContact O-N 3.38Å; L344-L348 HydrophobicContact CD1-CD1 3.94Å; L344-L348 HydrophobicContact CD1-CG 4.14Å; L344-L348 HydrophobicContact CD2-CD1 4.34Å; L344-L348 HydrophobicContact CG-CD1 3.79Å; L344-L348 HydrophobicContact CG-CG 4.31Å; L344-L348 WeakPolarHBondContact O-CG 3.45Å; L344-L348 PolarHBondContact O-N 3.12Å; L344-M419 HydrophobicContact CD1-CE 4.2Å; L344-M419 HydrophobicContact CD2-CE 3.82Å; L344-M419 HydrophobicContact CG-CE 4.45Å; L344-F427 HydrophobicContact CB-CZ 4.44Å; L344-F427 HydrophobicContact CD2-CE1 4.4Å; L344-F427 HydrophobicContact CD2-CZ 3.92Å; L344-F427 HydrophobicContact CG-CZ 4.01Å
345	H	96.5	Very high	96	Very high	24 Å²	24	11 Å²	11	11%	0.111	6%	0.063	C	C	.	.	H	α-helix	trans	-58	-52	177.2	-173.8	-167.1	0	0	0	110.9	Q35 S341 D342 L347 L348 E349 F427	Q35-H345 VanDerWaalsContact CD-ND1 3.25Å; Q35-H345 PolarHBondContact NE2-ND1 3.05Å; Q35-H345 PolarHBondContact OE1-CE1 2.92Å; Q35-H345 PolarHBondContact OE1-ND1 3.49Å; Q35-H345 VanDerWaalsContact OE1-ND1 3.1Å; S341-H345 PolarHBondContact O-N 3Å; D342-H345 PolarHBondContact O-N 3.28Å; H345-L347 VanDerWaalsContact C-N 3.26Å; H345-L347 PolarHBondContact O-N 3.04Å; H345-L348 PolarHBondContact O-N 3.21Å; H345-L348 VanDerWaalsContact O-N 3.17Å; H345-E349 WeakPolarHBondContact O-CB 3.29Å; H345-E349 PolarHBondContact O-N 2.86Å; H345-F427 HydrophobicContact CB-CD1 3.76Å; H345-F427 HydrophobicContact CB-CD2 4.04Å; H345-F427 HydrophobicContact CB-CE1 3.66Å; H345-F427 HydrophobicContact CB-CE2 3.98Å; H345-F427 HydrophobicContact CB-CG 3.95Å; H345-F427 HydrophobicContact CB-CZ 3.79Å; H345-F427 AromaticContact CD2-CD2 3.38Å; H345-F427 WeakPolarHBondContact CD2-CD2 3.4Å; H345-F427 AromaticContact CD2-CE2 3.83Å; H345-F427 AromaticContact CD2-CG 3.75Å; H345-F427 AromaticContact CG-CD1 3.97Å; H345-F427 AromaticContact CG-CD2 3.71Å; H345-F427 AromaticContact CG-CG 3.65Å; H345-F427 AromaticContact ND1-CG 4Å; H345-F427 AromaticContact NE2-CD2 3.95Å
346	R	97.1	Very high	96	Very high	19 Å²	19	15.5 Å²	15.5	7%	0.072	9%	0.087	C	C	.	.	H	α-helix	trans	-60	-36.1	178.9	-177.3	56.8	-176.6	124.2	10	112.5	V235 D240 E247 D342 E349 F350	V235-R346 HydrophobicContact CG1-CB 4.27Å; V235-R346 HydrophobicContact CG1-CG 4.2Å; V235-R346 HydrophobicContact CG2-CB 4Å; D240-R346 IonicContact OD1-CZ 2.64Å; D240-R346 IonicContact OD1-NE 2.72Å; D240-R346 PolarHBondContact OD1-NE 3.35Å; D240-R346 VanDerWaalsContact OD1-NE 3.08Å; D240-R346 IonicContact OD1-NH2 2.65Å; E247-R346 VanDerWaalsContact CD-NH2 3.27Å; E247-R346 IonicContact OE1-CZ 2.7Å; E247-R346 IonicContact OE1-NH1 3.88Å; E247-R346 PolarHBondContact OE1-NH1 2.97Å; E247-R346 IonicContact OE1-NH2 2.71Å; E247-R346 PolarHBondContact OE1-NH2 3.06Å; E247-R346 IonicContact OE2-CZ 3.72Å; E247-R346 IonicContact OE2-NH1 3.72Å; E247-R346 IonicContact OE2-NH2 3.79Å; E247-R346 PolarHBondContact OE2-NH2 3.36Å; D342-R346 PolarHBondContact O-N 3.43Å; D342-R346 VanDerWaalsContact O-N 3.12Å; R346-E349 WeakPolarHBondContact CD-OE2 3.38Å; R346-E349 IonicContact CZ-OE2 3.92Å; R346-E349 IonicContact NE-OE2 2.74Å; R346-E349 IonicContact NH1-OE2 3.08Å; R346-E349 PolarHBondContact NH1-OE2 3.26Å; R346-E349 VanDerWaalsContact NH1-OE2 3.14Å; R346-F350 VanDerWaalsContact O-CB 3.27Å; R346-F350 WeakPolarHBondContact O-CB 3.27Å; R346-F350 PolarHBondContact O-N 2.85Å; R346-F350 VanDerWaalsContact O-N 3.16Å
347	L	98.1	Very high	96.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-70.7	-40.1	176.5	-177	64.2	0	0	0	112.7	L294 L298 L305 T343 L344 H345 F350 L351 F383 L387	L294-L347 HydrophobicContact CD2-CD1 4.27Å; L298-L347 HydrophobicContact CD1-CD1 4.3Å; L298-L347 HydrophobicContact CD1-CD2 3.72Å; L298-L347 HydrophobicContact CD2-CD2 4.17Å; L305-L347 HydrophobicContact CD2-CD2 4.09Å; T343-L347 WeakPolarHBondContact O-CB 3.46Å; T343-L347 PolarHBondContact O-N 3.21Å; L344-L347 PolarHBondContact O-N 3.38Å; H345-L347 VanDerWaalsContact C-N 3.26Å; H345-L347 PolarHBondContact O-N 3.04Å; L347-F350 HydrophobicContact CD1-CD1 4.27Å; L347-L351 HydrophobicContact CD1-CD1 4.23Å; L347-L351 HydrophobicContact CD1-CG 4.29Å; L347-L351 HydrophobicContact CG-CD1 4.01Å; L347-L351 HydrophobicContact CG-CG 4.43Å; L347-L351 WeakPolarHBondContact O-CB 3.39Å; L347-L351 WeakPolarHBondContact O-CG 3.46Å; L347-L351 PolarHBondContact O-N 3.2Å; L347-F383 HydrophobicContact CD1-CE1 4.14Å; L347-F383 HydrophobicContact CD2-CD1 4.48Å; L347-L387 HydrophobicContact CD2-CD1 3.77Å; L347-L387 HydrophobicContact CD2-CD2 3.66Å; L347-L387 HydrophobicContact CD2-CG 4.32Å
348	L	98	Very high	96.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-73.8	-39.3	179.6	-68.5	173.5	0	0	0	112.2	L344 H345 F350 L351 S352 L416 M419 I420 C423 F427	L344-L348 HydrophobicContact CD1-CD1 3.94Å; L344-L348 HydrophobicContact CD1-CG 4.14Å; L344-L348 HydrophobicContact CD2-CD1 4.34Å; L344-L348 HydrophobicContact CG-CD1 3.79Å; L344-L348 HydrophobicContact CG-CG 4.31Å; L344-L348 WeakPolarHBondContact O-CG 3.45Å; L344-L348 PolarHBondContact O-N 3.12Å; H345-L348 PolarHBondContact O-N 3.21Å; H345-L348 VanDerWaalsContact O-N 3.17Å; L348-F350 VanDerWaalsContact C-N 3.33Å; L348-F350 PolarHBondContact O-N 2.76Å; L348-L351 PolarHBondContact O-N 3.46Å; L348-S352 PolarHBondContact O-N 2.93Å; L348-L416 HydrophobicContact CD2-CD1 3.77Å; L348-M419 HydrophobicContact CD1-CB 4.01Å; L348-M419 HydrophobicContact CD1-CE 4.08Å; L348-M419 HydrophobicContact CD2-CB 4.13Å; L348-I420 HydrophobicContact CD2-CG1 3.75Å; L348-C423 HydrophobicContact CB-CB 3.84Å; L348-F427 HydrophobicContact CD1-CE2 3.87Å; L348-F427 HydrophobicContact CD1-CZ 4.03Å
349	E	97.3	Very high	96.5	Very high	55 Å²	55	22.1 Å²	22.1	26%	0.257	12%	0.118	S	C	.	.	H	α-helix	trans	-52.9	-49.7	169.5	-178.1	-175.4	-108	0	0	110.6	R233 H345 R346 T353	R233-E349 IonicContact CZ-OE1 2.73Å; R233-E349 IonicContact CZ-OE2 3.84Å; R233-E349 IonicContact NH1-OE1 2.63Å; R233-E349 PolarHBondContact NH1-OE1 3.01Å; R233-E349 IonicContact NH1-OE2 3.3Å; R233-E349 PolarHBondContact NH1-OE2 2.89Å; R233-E349 IonicContact NH2-OE1 3.76Å; R233-E349 PolarHBondContact NH2-OE1 3.07Å; R233-E349 IonicContact NH2-OE2 3.72Å; H345-E349 WeakPolarHBondContact O-CB 3.29Å; H345-E349 PolarHBondContact O-N 2.86Å; R346-E349 WeakPolarHBondContact CD-OE2 3.38Å; R346-E349 IonicContact CZ-OE2 3.92Å; R346-E349 IonicContact NE-OE2 2.74Å; R346-E349 IonicContact NH1-OE2 3.08Å; R346-E349 PolarHBondContact NH1-OE2 3.26Å; R346-E349 VanDerWaalsContact NH1-OE2 3.14Å; E349-T353 PolarHBondContact O-N 3.07Å; E349-T353 VanDerWaalsContact O-N 3.17Å; E349-T353 PolarHBondContact O-OG1 3.35Å
350	F	98.2	Very high	96.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-47.5	172.6	167.6	-103.2	0	0	0	113.5	C243 I246 E247 F257 L294 R346 L347 L348 S352 T353 V354	C243-F350 HydrophobicContact CB-CB 4.17Å; C243-F350 HydrophobicContact CB-CD2 3.72Å; C243-F350 HydrophobicContact CB-CE2 4.27Å; C243-F350 HydrophobicContact CB-CG 3.88Å; C243-F350 VanDerWaalsContact SG-CG 3.54Å; I246-F350 HydrophobicContact CB-CE2 3.84Å; I246-F350 HydrophobicContact CB-CZ 3.86Å; I246-F350 HydrophobicContact CD1-CZ 4.17Å; I246-F350 HydrophobicContact CG2-CE2 3.9Å; I246-F350 HydrophobicContact CG2-CZ 3.71Å; E247-F350 HydrophobicContact CG-CD2 3.7Å; E247-F350 HydrophobicContact CG-CE2 4.01Å; F257-F350 AromaticContact CE2-CE1 3.72Å; F257-F350 HydrophobicContact CE2-CE1 3.72Å; F257-F350 AromaticContact CE2-CZ 3.73Å; F257-F350 HydrophobicContact CE2-CZ 3.73Å; F257-F350 AromaticContact CZ-CE1 3.48Å; F257-F350 HydrophobicContact CZ-CE1 3.48Å; F257-F350 VanDerWaalsContact CZ-CE1 3.48Å; F257-F350 AromaticContact CZ-CZ 3.57Å; F257-F350 HydrophobicContact CZ-CZ 3.57Å; L294-F350 HydrophobicContact CD2-CE1 4.12Å; R346-F350 VanDerWaalsContact O-CB 3.27Å; R346-F350 WeakPolarHBondContact O-CB 3.27Å; R346-F350 PolarHBondContact O-N 2.85Å; R346-F350 VanDerWaalsContact O-N 3.16Å; L347-F350 HydrophobicContact CD1-CD1 4.27Å; L348-F350 VanDerWaalsContact C-N 3.33Å; L348-F350 PolarHBondContact O-N 2.76Å; F350-S352 PolarHBondContact O-N 2.98Å; F350-T353 WeakPolarHBondContact O-CB 3.49Å; F350-T353 PolarHBondContact O-N 3.02Å; F350-V354 HydrophobicContact CD2-CG2 4.35Å; F350-V354 HydrophobicContact CE1-CG2 4.15Å; F350-V354 HydrophobicContact CE2-CG2 3.78Å; F350-V354 HydrophobicContact CZ-CG2 3.66Å; F350-V354 WeakPolarHBondContact O-CG2 3.28Å; F350-V354 PolarHBondContact O-N 3.44Å
351	L	98.3	Very high	96.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-69.1	-30.4	-177.7	-71.9	174.7	0	0	0	113.3	L347 L348 A355 L379 F383 I420	L347-L351 HydrophobicContact CD1-CD1 4.23Å; L347-L351 HydrophobicContact CD1-CG 4.29Å; L347-L351 HydrophobicContact CG-CD1 4.01Å; L347-L351 HydrophobicContact CG-CG 4.43Å; L347-L351 WeakPolarHBondContact O-CB 3.39Å; L347-L351 WeakPolarHBondContact O-CG 3.46Å; L347-L351 PolarHBondContact O-N 3.2Å; L348-L351 PolarHBondContact O-N 3.46Å; L351-A355 WeakPolarHBondContact O-CB 3.12Å; L351-A355 PolarHBondContact O-N 2.84Å; L351-L379 HydrophobicContact CB-CD1 4.34Å; L351-L379 HydrophobicContact CD2-CB 4.42Å; L351-L379 HydrophobicContact CD2-CD1 4.1Å; L351-L379 HydrophobicContact CD2-CD2 4.15Å; L351-L379 HydrophobicContact CD2-CG 4.46Å; L351-L379 WeakPolarHBondContact O-CD1 3.41Å; L351-F383 HydrophobicContact CD1-CB 4.38Å; L351-F383 HydrophobicContact CD1-CD1 4.28Å; L351-F383 HydrophobicContact CD1-CD2 4.1Å; L351-F383 HydrophobicContact CD1-CE2 4.46Å; L351-F383 HydrophobicContact CD1-CG 4Å; L351-F383 HydrophobicContact CD2-CD2 3.83Å; L351-F383 HydrophobicContact CD2-CE2 3.51Å; L351-F383 HydrophobicContact CD2-CG 4.48Å; L351-F383 HydrophobicContact CD2-CZ 3.91Å; L351-I420 HydrophobicContact CB-CD1 4.22Å; L351-I420 HydrophobicContact CB-CG1 4.1Å; L351-I420 HydrophobicContact CB-CG2 4.42Å; L351-I420 HydrophobicContact CD1-CD1 4.24Å; L351-I420 HydrophobicContact CD1-CG1 4.43Å
352	S	97.9	Very high	95.9	Very high	14 Å²	14	34.4 Å²	34.4	10%	0.098	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-50.8	168	-169.2	0	0	0	0	109.6	L348 F350 V354 A355 D356 C423	L348-S352 PolarHBondContact O-N 2.93Å; F350-S352 PolarHBondContact O-N 2.98Å; S352-V354 PolarHBondContact O-N 2.9Å; S352-V354 VanDerWaalsContact O-N 3.14Å; S352-A355 CarbonylContact O-C 3.33Å; S352-A355 WeakPolarHBondContact O-CA 3.37Å; S352-A355 WeakPolarHBondContact O-CB 3.41Å; S352-A355 PolarHBondContact O-N 2.88Å; S352-D356 VanDerWaalsContact C-OD2 3.28Å; S352-D356 PolarHBondContact O-N 3.35Å; S352-D356 PolarHBondContact OG-OD2 3.03Å; S352-C423 VanDerWaalsContact CB-SG 3.58Å
353	T	97.5	Very high	95.5	Very high	43 Å²	43	36.3 Å²	36.3	26%	0.264	19%	0.188	S	C	.	.	H	α-helix	trans	-54.4	-38.8	179.2	-53.5	0	0	0	0	111.9	L251 E349 F350 H357	L251-T353 HydrophobicContact CD1-CG2 4.45Å; L251-T353 HydrophobicContact CD2-CG2 4.12Å; E349-T353 PolarHBondContact O-N 3.07Å; E349-T353 VanDerWaalsContact O-N 3.17Å; E349-T353 PolarHBondContact O-OG1 3.35Å; F350-T353 WeakPolarHBondContact O-CB 3.49Å; F350-T353 PolarHBondContact O-N 3.02Å; T353-H357 PolarHBondContact O-ND1 3.37Å
354	V	97.8	Very high	94.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.8	-40.9	173.3	176.3	0	0	0	0	112.1	L251 I256 F350 S352 H357 N372 M374 L379	L251-V354 HydrophobicContact CD2-CG2 4.12Å; I256-V354 HydrophobicContact CG2-CG1 3.81Å; F350-V354 HydrophobicContact CD2-CG2 4.35Å; F350-V354 HydrophobicContact CE1-CG2 4.15Å; F350-V354 HydrophobicContact CE2-CG2 3.78Å; F350-V354 HydrophobicContact CZ-CG2 3.66Å; F350-V354 WeakPolarHBondContact O-CG2 3.28Å; F350-V354 PolarHBondContact O-N 3.44Å; S352-V354 PolarHBondContact O-N 2.9Å; S352-V354 VanDerWaalsContact O-N 3.14Å; V354-H357 PolarHBondContact O-N 2.74Å; V354-N372 PolarHBondContact O-ND2 3.31Å; V354-M374 HydrophobicContact CG1-CB 4.34Å; V354-L379 HydrophobicContact CB-CD1 4.05Å; V354-L379 HydrophobicContact CG1-CD1 3.96Å; V354-L379 HydrophobicContact CG1-CD2 4.18Å
355	A	97.3	Very high	94.4	Very high	11 Å²	11	53.2 Å²	53.2	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-67	-34.9	178.1	0	0	0	0	0	113.4	L351 S352 H357 A358 M374 S376 L379	L351-A355 WeakPolarHBondContact O-CB 3.12Å; L351-A355 PolarHBondContact O-N 2.84Å; S352-A355 CarbonylContact O-C 3.33Å; S352-A355 WeakPolarHBondContact O-CA 3.37Å; S352-A355 WeakPolarHBondContact O-CB 3.41Å; S352-A355 PolarHBondContact O-N 2.88Å; A355-H357 PolarHBondContact O-N 3.02Å; A355-A358 WeakPolarHBondContact O-CB 3.38Å; A355-A358 PolarHBondContact O-N 3.29Å; A355-M374 WeakPolarHBondContact CA-O 3.44Å; A355-S376 WeakPolarHBondContact CB-OG 3.37Å; A355-L379 HydrophobicContact CB-CD1 4.06Å
356	D	96.1	Very high	94	Very high	96 Å²	96	54.6 Å²	54.6	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-64.3	-25.4	177.1	-61.4	-40.6	0	0	0	111.8	S352 Q361	S352-D356 VanDerWaalsContact C-OD2 3.28Å; S352-D356 PolarHBondContact O-N 3.35Å; S352-D356 PolarHBondContact OG-OD2 3.03Å; D356-Q361 PolarHBondContact O-NE2 3.01Å
357	H	96.3	Very high	93.5	Very high	51 Å²	51	60.3 Å²	60.3	24%	0.236	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	13.2	173.7	-65.2	82.8	0	0	0	113.6	L251 T353 V354 A355 G371 N372	L251-H357 HydrophobicContact CB-CB 4.49Å; T353-H357 PolarHBondContact O-ND1 3.37Å; V354-H357 PolarHBondContact O-N 2.74Å; A355-H357 PolarHBondContact O-N 3.02Å; H357-G371 CarbonylContact O-C 3.58Å; H357-G371 VanDerWaalsContact O-CA 3.27Å; H357-G371 WeakPolarHBondContact O-CA 3.31Å; H357-N372 PolarHBondContact O-N 3.17Å; H357-N372 PolarHBondContact O-ND2 3.44Å
358	A	95.9	Very high	93	Very high	2 Å²	2	67.3 Å²	67.3	2%	0.017	35%	0.349	C	S	.	.	S	Bend	trans	-74.1	-33.2	-178.3	0	0	0	0	0	114.1	A355 N372 K373 T375	A355-A358 WeakPolarHBondContact O-CB 3.38Å; A355-A358 PolarHBondContact O-N 3.29Å; A358-N372 WeakPolarHBondContact CA-OD1 3.49Å; A358-K373 VanDerWaalsContact O-CA 3.3Å; A358-K373 WeakPolarHBondContact O-CA 3.43Å; A358-K373 PolarHBondContact O-N 3.4Å; A358-T375 HydrophobicContact CB-CG2 4.08Å
359	N	94.6	Very high	92.5	Very high	116 Å²	116	70.4 Å²	70.4	62%	0.62	36%	0.364	S	S	*	.	S	Bend	trans	-87.9	156.4	179.5	-65.4	-26.7	0	0	0	111.3	G371	N359-G371 VanDerWaalsContact O-CA 3.26Å; N359-G371 WeakPolarHBondContact O-CA 3.47Å
360	D	92.8	Very high	92.1	Very high	82 Å²	82	71.3 Å²	71.3	44%	0.439	38%	0.375	S	S	.	.			trans	-68.9	139.8	172.2	-55	-40.5	0	0	0	109.5	I369 P370 G371 K373	D360-I369 WeakPolarHBondContact CA-O 3.4Å; D360-P370 WeakPolarHBondContact OD1-CA 3.39Å; D360-G371 PolarHBondContact OD1-N 3.22Å; D360-K373 IonicContact OD1-NZ 3.73Å; D360-K373 PolarHBondContact OD1-NZ 2.9Å; D360-K373 IonicContact OD2-NZ 2.73Å; D360-K373 PolarHBondContact OD2-NZ 3.45Å
361	Q	88.9	Confident	91.9	Very high	87 Å²	87	71.5 Å²	71.5	41%	0.407	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.2	-176.6	-62.2	-175.2	6.3	0	0	109.8	D356 I369	D356-Q361 PolarHBondContact O-NE2 3.01Å; Q361-I369 PolarHBondContact N-O 2.98Å; Q361-I369 WeakPolarHBondContact O-CB 3.37Å; Q361-I369 PolarHBondContact O-N 3.03Å
362	H	87.9	Confident	91.8	Very high	121 Å²	121	71.5 Å²	71.5	56%	0.56	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	134.2	176.1	-62.5	-105.4	0	0	0	110.1	Q367 E368	H362-Q367 CarbonylContact C-O 3.38Å; H362-Q367 WeakPolarHBondContact CA-O 3.43Å; H362-E368 WeakPolarHBondContact CE1-CG 3.48Å; H362-E368 IonicContact CE1-OE1 3.86Å; H362-E368 PolarHBondContact CE1-OE1 2.97Å
363	T	85.8	Confident	91.8	Very high	42 Å²	42	75.1 Å²	75.1	26%	0.258	39%	0.391	S	S	.	.			trans	-68.6	166.6	169.5	66	0	0	0	0	111.1	D365 G366 Q367 I369	T363-D365 PolarHBondContact O-N 3.14Å; T363-D365 VanDerWaalsContact O-N 3.16Å; T363-D365 PolarHBondContact OG1-N 3.03Å; T363-G366 PolarHBondContact O-N 2.77Å; T363-Q367 HydrophobicContact CG2-CB 4.41Å; T363-Q367 PolarHBondContact N-O 2.71Å; T363-Q367 WeakPolarHBondContact OG1-CB 3.27Å; T363-Q367 PolarHBondContact OG1-N 3.06Å; T363-Q367 VanDerWaalsContact OG1-N 3.08Å; T363-I369 HydrophobicContact CG2-CD1 3.65Å; T363-I369 HydrophobicContact CG2-CG1 3.93Å
364	K	82.8	Confident	91.7	Very high	215 Å²	215	73.1 Å²	73.1	94%	0.935	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.2	173.1	-63.7	-177.4	179.9	-179.6	0	112.7	G366	K364-G366 VanDerWaalsContact C-N 3.3Å
365	D	87.5	Confident	91.7	Very high	140 Å²	140	75.8 Å²	75.8	75%	0.749	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	6.8	177.1	-41.1	-77.7	0	0	0	112.9	T363 Q367	T363-D365 PolarHBondContact O-N 3.14Å; T363-D365 VanDerWaalsContact O-N 3.16Å; T363-D365 PolarHBondContact OG1-N 3.03Å; D365-Q367 PolarHBondContact O-N 3.07Å
366	G	87.1	Confident	91.7	Very high	52 Å²	52	76.8 Å²	76.8	54%	0.536	40%	0.401	S	S	.	.	S	Bend	trans	81.1	4.8	176.3	0	0	0	0	0	115.9	T363 K364	T363-G366 PolarHBondContact O-N 2.77Å; K364-G366 VanDerWaalsContact C-N 3.3Å
367	Q	86.4	Confident	91.8	Very high	140 Å²	140	75.9 Å²	75.9	65%	0.654	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-78.1	133.3	179.6	-59	-173.9	8	0	0	111.3	H362 T363 D365 I369	H362-Q367 CarbonylContact C-O 3.38Å; H362-Q367 WeakPolarHBondContact CA-O 3.43Å; T363-Q367 HydrophobicContact CG2-CB 4.41Å; T363-Q367 PolarHBondContact N-O 2.71Å; T363-Q367 WeakPolarHBondContact OG1-CB 3.27Å; T363-Q367 PolarHBondContact OG1-N 3.06Å; T363-Q367 VanDerWaalsContact OG1-N 3.08Å; D365-Q367 PolarHBondContact O-N 3.07Å; Q367-I369 PolarHBondContact O-N 3.11Å
368	E	87.7	Confident	91.8	Very high	147 Å²	147	76.3 Å²	76.3	69%	0.687	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	117.7	174.2	-75	171.1	-168.3	0	0	111.2	H362	H362-E368 WeakPolarHBondContact CE1-CG 3.48Å; H362-E368 IonicContact CE1-OE1 3.86Å; H362-E368 PolarHBondContact CE1-OE1 2.97Å
369	I	87.8	Confident	91.9	Very high	65 Å²	65	76.2 Å²	76.2	33%	0.333	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.8	164.7	-60.8	177.5	0	0	0	107.5	Q252 D360 Q361 T363 Q367 G371	Q252-I369 HydrophobicContact CG-CG2 3.84Å; D360-I369 WeakPolarHBondContact CA-O 3.4Å; Q361-I369 PolarHBondContact N-O 2.98Å; Q361-I369 WeakPolarHBondContact O-CB 3.37Å; Q361-I369 PolarHBondContact O-N 3.03Å; T363-I369 HydrophobicContact CG2-CD1 3.65Å; T363-I369 HydrophobicContact CG2-CG1 3.93Å; Q367-I369 PolarHBondContact O-N 3.11Å; I369-G371 PolarHBondContact O-N 3.06Å
370	P	90.6	Very high	92.1	Very high	74 Å²	74	70.7 Å²	70.7	48%	0.481	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-69	126.6	177.2	27.8	-33.6	0	0	0	110.9	D360	D360-P370 WeakPolarHBondContact OD1-CA 3.39Å
371	G	93.3	Very high	92.2	Very high	4 Å²	4	70.1 Å²	70.1	4%	0.041	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-74.3	153	174.8	0	0	0	0	0	112.4	H357 N359 D360 I369 K373	H357-G371 CarbonylContact O-C 3.58Å; H357-G371 VanDerWaalsContact O-CA 3.27Å; H357-G371 WeakPolarHBondContact O-CA 3.31Å; N359-G371 VanDerWaalsContact O-CA 3.26Å; N359-G371 WeakPolarHBondContact O-CA 3.47Å; D360-G371 PolarHBondContact OD1-N 3.22Å; I369-G371 PolarHBondContact O-N 3.06Å; G371-K373 WeakPolarHBondContact O-CE 3.42Å; G371-K373 PolarHBondContact O-N 2.85Å; G371-K373 VanDerWaalsContact O-N 3.13Å
372	N	96.4	Very high	92.6	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.358	C	S	.	.			trans	-70.5	-8	-175.4	66.1	46.1	0	0	0	114.7	L251 T253 V254 G255 I256 V354 H357 A358 M374	L251-N372 WeakPolarHBondContact O-CB 3.46Å; L251-N372 PolarHBondContact O-ND2 2.93Å; T253-N372 WeakPolarHBondContact O-CB 3.15Å; V254-N372 WeakPolarHBondContact CA-O 3.31Å; G255-N372 PolarHBondContact N-O 3.45Å; I256-N372 HydrophobicContact CG2-CB 4.27Å; V354-N372 PolarHBondContact O-ND2 3.31Å; H357-N372 PolarHBondContact O-N 3.17Å; H357-N372 PolarHBondContact O-ND2 3.44Å; A358-N372 WeakPolarHBondContact CA-OD1 3.49Å; N372-M374 PolarHBondContact O-N 3.44Å; N372-M374 WeakPolarHBondContact OD1-CA 3.35Å; N372-M374 VanDerWaalsContact OD1-CB 3.24Å; N372-M374 WeakPolarHBondContact OD1-CB 3.14Å; N372-M374 PolarHBondContact OD1-N 3.19Å
373	K	96.4	Very high	93.1	Very high	89 Å²	89	61.8 Å²	61.8	39%	0.387	33%	0.331	S	S	.	.			trans	63.2	15.8	-178.8	-44.2	-55.5	-179.4	-177	0	115.5	V254 A358 D360 G371 N378	V254-K373 HydrophobicContact CG1-CG 4.22Å; A358-K373 VanDerWaalsContact O-CA 3.3Å; A358-K373 WeakPolarHBondContact O-CA 3.43Å; A358-K373 PolarHBondContact O-N 3.4Å; D360-K373 IonicContact OD1-NZ 3.73Å; D360-K373 PolarHBondContact OD1-NZ 2.9Å; D360-K373 IonicContact OD2-NZ 2.73Å; D360-K373 PolarHBondContact OD2-NZ 3.45Å; G371-K373 WeakPolarHBondContact O-CE 3.42Å; G371-K373 PolarHBondContact O-N 2.85Å; G371-K373 VanDerWaalsContact O-N 3.13Å; K373-N378 PolarHBondContact O-ND2 3.49Å
374	M	97.3	Very high	93.5	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.01	32%	0.319	C	S	.	.			trans	-104.5	71.6	-177.6	-61.9	-56.5	-58.5	0	0	112.1	I256 R258 V354 A355 N372 N378 L379 I382	I256-M374 HydrophobicContact CG2-CB 4.37Å; I256-M374 HydrophobicContact CG2-CG 3.86Å; I256-M374 WeakPolarHBondContact O-CE 3.5Å; I256-M374 WeakPolarHBondContact O-CG 3.14Å; R258-M374 HydrophobicContact CB-CE 4.19Å; R258-M374 HydrophobicContact CB-SD 4.05Å; V354-M374 HydrophobicContact CG1-CB 4.34Å; A355-M374 WeakPolarHBondContact CA-O 3.44Å; N372-M374 PolarHBondContact O-N 3.44Å; N372-M374 WeakPolarHBondContact OD1-CA 3.35Å; N372-M374 VanDerWaalsContact OD1-CB 3.24Å; N372-M374 WeakPolarHBondContact OD1-CB 3.14Å; N372-M374 PolarHBondContact OD1-N 3.19Å; M374-N378 HydrophobicContact CE-CB 3.77Å; M374-N378 HydrophobicContact SD-CB 4.36Å; M374-L379 HydrophobicContact CB-CD2 3.94Å; M374-L379 HydrophobicContact CB-CG 4.18Å; M374-L379 HydrophobicContact CE-CD2 4.03Å; M374-L379 WeakPolarHBondContact O-CD1 3.43Å; M374-I382 HydrophobicContact CE-CD1 3.47Å; M374-I382 VanDerWaalsContact CE-CD1 3.47Å
375	T	97.4	Very high	93.9	Very high	55 Å²	55	53.1 Å²	53.1	34%	0.337	30%	0.298	S	S	.	.			trans	-58	163	173.8	64.5	0	0	0	0	112.5	A358 L377 N378 L379	A358-T375 HydrophobicContact CB-CG2 4.08Å; T375-L377 PolarHBondContact O-N 2.89Å; T375-L377 VanDerWaalsContact O-N 3.1Å; T375-N378 WeakPolarHBondContact O-CA 3.39Å; T375-N378 WeakPolarHBondContact O-CB 3.35Å; T375-N378 PolarHBondContact O-N 3.1Å; T375-N378 PolarHBondContact OG1-N 2.86Å; T375-L379 PolarHBondContact O-N 2.81Å
376	S	97.3	Very high	94.2	Very high	32 Å²	32	47.7 Å²	47.7	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-55	-32	178.9	-35.6	0	0	0	0	113.4	A355 A380	A355-S376 WeakPolarHBondContact CB-OG 3.37Å; S376-A380 WeakPolarHBondContact O-CB 3.32Å; S376-A380 PolarHBondContact O-N 3.45Å
377	L	97.2	Very high	94.5	Very high	78 Å²	78	45.2 Å²	45.2	41%	0.408	24%	0.243	S	C	.	.	H	α-helix	trans	-69.2	-43.9	172.1	173.6	60.5	0	0	0	112.2	T375 L379 A380 T381 I413	T375-L377 PolarHBondContact O-N 2.89Å; T375-L377 VanDerWaalsContact O-N 3.1Å; L377-L379 VanDerWaalsContact C-N 3.33Å; L377-L379 PolarHBondContact O-N 2.84Å; L377-A380 PolarHBondContact O-N 3.38Å; L377-T381 WeakPolarHBondContact O-CB 3.21Å; L377-T381 PolarHBondContact O-N 3.1Å; L377-T381 PolarHBondContact O-OG1 3.02Å; L377-I413 HydrophobicContact CD1-CG2 3.69Å
378	N	97.4	Very high	94.7	Very high	60 Å²	60	38.9 Å²	38.9	32%	0.321	21%	0.214	S	C	.	.	H	α-helix	trans	-64.1	-39.6	176.7	-71	-13.5	0	0	0	111.2	K373 M374 T375 I382	K373-N378 PolarHBondContact O-ND2 3.49Å; M374-N378 HydrophobicContact CE-CB 3.77Å; M374-N378 HydrophobicContact SD-CB 4.36Å; T375-N378 WeakPolarHBondContact O-CA 3.39Å; T375-N378 WeakPolarHBondContact O-CB 3.35Å; T375-N378 PolarHBondContact O-N 3.1Å; T375-N378 PolarHBondContact OG1-N 2.86Å; N378-I382 WeakPolarHBondContact O-CG1 3.46Å; N378-I382 PolarHBondContact O-N 3.07Å
379	L	98.1	Very high	94.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.9	-45.9	174.2	-66.1	175.4	0	0	0	111.7	F257 L351 V354 A355 M374 T375 L377 T381 I382 F383 I420	F257-L379 HydrophobicContact CD2-CD2 4.02Å; L351-L379 HydrophobicContact CB-CD1 4.34Å; L351-L379 HydrophobicContact CD2-CB 4.42Å; L351-L379 HydrophobicContact CD2-CD1 4.1Å; L351-L379 HydrophobicContact CD2-CD2 4.15Å; L351-L379 HydrophobicContact CD2-CG 4.46Å; L351-L379 WeakPolarHBondContact O-CD1 3.41Å; V354-L379 HydrophobicContact CB-CD1 4.05Å; V354-L379 HydrophobicContact CG1-CD1 3.96Å; V354-L379 HydrophobicContact CG1-CD2 4.18Å; A355-L379 HydrophobicContact CB-CD1 4.06Å; M374-L379 HydrophobicContact CB-CD2 3.94Å; M374-L379 HydrophobicContact CB-CG 4.18Å; M374-L379 HydrophobicContact CE-CD2 4.03Å; M374-L379 WeakPolarHBondContact O-CD1 3.43Å; T375-L379 PolarHBondContact O-N 2.81Å; L377-L379 VanDerWaalsContact C-N 3.33Å; L377-L379 PolarHBondContact O-N 2.84Å; L379-T381 VanDerWaalsContact C-N 3.29Å; L379-T381 PolarHBondContact O-N 3.47Å; L379-I382 PolarHBondContact O-N 3.27Å; L379-F383 PolarHBondContact O-N 3.21Å; L379-I420 HydrophobicContact CB-CD1 4.09Å
380	A	97.5	Very high	93.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-37.9	177	0	0	0	0	0	112.5	S376 L377 I382 G384 I413 L416 Q417 I420	S376-A380 WeakPolarHBondContact O-CB 3.32Å; S376-A380 PolarHBondContact O-N 3.45Å; L377-A380 PolarHBondContact O-N 3.38Å; A380-I382 VanDerWaalsContact C-N 3.26Å; A380-I382 PolarHBondContact O-N 3.37Å; A380-G384 WeakPolarHBondContact O-CA 3.17Å; A380-G384 PolarHBondContact O-N 3.02Å; A380-I413 HydrophobicContact CB-CG2 4.05Å; A380-L416 HydrophobicContact CB-CB 4.08Å; A380-L416 HydrophobicContact CB-CD2 4.37Å; A380-L416 HydrophobicContact CB-CG 4.11Å; A380-Q417 HydrophobicContact CB-CB 3.89Å; A380-I420 HydrophobicContact CB-CD1 4.35Å
381	T	96.3	Very high	92.5	Very high	69 Å²	69	39.2 Å²	39.2	42%	0.423	21%	0.205	S	C	.	.	H	α-helix	trans	-60.1	-34.9	173.5	-57.7	0	0	0	0	112.5	L377 L379 I413	L377-T381 WeakPolarHBondContact O-CB 3.21Å; L377-T381 PolarHBondContact O-N 3.1Å; L377-T381 PolarHBondContact O-OG1 3.02Å; L379-T381 VanDerWaalsContact C-N 3.29Å; L379-T381 PolarHBondContact O-N 3.47Å; T381-I413 HydrophobicContact CG2-CD1 4.18Å
382	I	96.4	Very high	90.7	Very high	34 Å²	34	48.3 Å²	48.3	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-85	-44	179.9	-66.2	171.1	0	0	0	111.7	F257 R258 K295 M374 N378 L379 A380 N386	F257-I382 HydrophobicContact CB-CD1 4.16Å; F257-I382 HydrophobicContact CB-CG2 4.3Å; R258-I382 HydrophobicContact CB-CD1 4.05Å; R258-I382 HydrophobicContact CG-CD1 4.44Å; K295-I382 HydrophobicContact CD-CG2 3.58Å; M374-I382 HydrophobicContact CE-CD1 3.47Å; M374-I382 VanDerWaalsContact CE-CD1 3.47Å; N378-I382 WeakPolarHBondContact O-CG1 3.46Å; N378-I382 PolarHBondContact O-N 3.07Å; L379-I382 PolarHBondContact O-N 3.27Å; A380-I382 VanDerWaalsContact C-N 3.26Å; A380-I382 PolarHBondContact O-N 3.37Å; I382-N386 PolarHBondContact O-ND2 3.3Å
383	F	97.5	Very high	88.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-86.1	-29	-173.3	-82	-90.7	0	0	0	113.6	F257 K295 L298 L347 L351 L379 N386 L387 L416	F257-F383 HydrophobicContact CB-CE2 4.27Å; F257-F383 AromaticContact CD1-CE2 3.7Å; F257-F383 HydrophobicContact CD1-CE2 3.7Å; F257-F383 AromaticContact CD1-CZ 3.55Å; F257-F383 HydrophobicContact CD1-CZ 3.55Å; F257-F383 HydrophobicContact CD2-CE2 4.05Å; F257-F383 HydrophobicContact CD2-CZ 4.46Å; F257-F383 HydrophobicContact CE1-CE2 4.06Å; F257-F383 AromaticContact CE1-CZ 3.54Å; F257-F383 HydrophobicContact CE1-CZ 3.54Å; F257-F383 HydrophobicContact CE2-CE2 4.38Å; F257-F383 HydrophobicContact CE2-CZ 4.44Å; F257-F383 AromaticContact CG-CE2 3.72Å; F257-F383 HydrophobicContact CG-CE2 3.72Å; F257-F383 HydrophobicContact CG-CZ 4.06Å; F257-F383 HydrophobicContact CZ-CE2 4.4Å; F257-F383 HydrophobicContact CZ-CZ 4.01Å; K295-F383 HydrophobicContact CG-CE1 4.12Å; K295-F383 HydrophobicContact CG-CZ 4.02Å; L298-F383 HydrophobicContact CD1-CD1 3.95Å; L298-F383 HydrophobicContact CD1-CE1 3.74Å; L347-F383 HydrophobicContact CD1-CE1 4.14Å; L347-F383 HydrophobicContact CD2-CD1 4.48Å; L351-F383 HydrophobicContact CD1-CB 4.38Å; L351-F383 HydrophobicContact CD1-CD1 4.28Å; L351-F383 HydrophobicContact CD1-CD2 4.1Å; L351-F383 HydrophobicContact CD1-CE2 4.46Å; L351-F383 HydrophobicContact CD1-CG 4Å; L351-F383 HydrophobicContact CD2-CD2 3.83Å; L351-F383 HydrophobicContact CD2-CE2 3.51Å; L351-F383 HydrophobicContact CD2-CG 4.48Å; L351-F383 HydrophobicContact CD2-CZ 3.91Å; L379-F383 PolarHBondContact O-N 3.21Å; F383-N386 CarbonylContact O-C 3.54Å; F383-N386 WeakPolarHBondContact O-CA 3.29Å; F383-N386 WeakPolarHBondContact O-CB 3.35Å; F383-N386 PolarHBondContact O-N 3.4Å; F383-L387 HydrophobicContact CB-CD1 4.19Å; F383-L387 HydrophobicContact CB-CG 4.44Å; F383-L387 WeakPolarHBondContact O-CG 3.4Å; F383-L387 PolarHBondContact O-N 3.22Å; F383-L416 HydrophobicContact CB-CD2 3.67Å
384	G	94.8	Very high	85.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-44.1	-61.1	-179.2	0	0	0	0	0	114.1	A380 N386 L387 L388 V412	A380-G384 WeakPolarHBondContact O-CA 3.17Å; A380-G384 PolarHBondContact O-N 3.02Å; G384-N386 PolarHBondContact O-N 3.33Å; G384-N386 VanDerWaalsContact O-N 3.07Å; G384-L387 PolarHBondContact O-N 3.31Å; G384-L388 PolarHBondContact O-N 3.45Å; G384-V412 VanDerWaalsContact C-CG1 3.42Å
385	P	91.4	Very high	83.2	Confident	75 Å²	75	58.6 Å²	58.6	49%	0.487	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-6.3	-179.8	28	-36.5	0	0	0	114.9	H389	P385-H389 PolarHBondContact O-CD2 3.45Å
386	N	93.1	Very high	80.9	Confident	25 Å²	25	65.9 Å²	65.9	13%	0.134	35%	0.346	C	S	.	.	H	α-helix	trans	-102.1	-13.5	174.4	-56.5	-72.9	0	0	0	112.7	R299 I382 F383 G384	R299-N386 HydrophobicContact CB-CB 4.38Å; R299-N386 VanDerWaalsContact CB-OD1 3.31Å; R299-N386 WeakPolarHBondContact CB-OD1 3.41Å; R299-N386 WeakPolarHBondContact CG-OD1 3.47Å; I382-N386 PolarHBondContact O-ND2 3.3Å; F383-N386 CarbonylContact O-C 3.54Å; F383-N386 WeakPolarHBondContact O-CA 3.29Å; F383-N386 WeakPolarHBondContact O-CB 3.35Å; F383-N386 PolarHBondContact O-N 3.4Å; G384-N386 PolarHBondContact O-N 3.33Å; G384-N386 VanDerWaalsContact O-N 3.07Å
387	L	94	Very high	78.5	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-108.9	-29.3	179.3	-63	-174.1	0	0	0	113.5	L298 L305 L306 L347 F383 G384 L416	L298-L387 HydrophobicContact CB-CD2 4.35Å; L298-L387 HydrophobicContact CD1-CD2 4.03Å; L298-L387 HydrophobicContact CD2-CD2 3.92Å; L298-L387 HydrophobicContact CG-CD2 4.32Å; L305-L387 HydrophobicContact CB-CD2 3.88Å; L305-L387 HydrophobicContact CD2-CD2 3.78Å; L305-L387 HydrophobicContact CG-CD2 4.48Å; L306-L387 PolarHBondContact N-O 2.91Å; L347-L387 HydrophobicContact CD2-CD1 3.77Å; L347-L387 HydrophobicContact CD2-CD2 3.66Å; L347-L387 HydrophobicContact CD2-CG 4.32Å; F383-L387 HydrophobicContact CB-CD1 4.19Å; F383-L387 HydrophobicContact CB-CG 4.44Å; F383-L387 WeakPolarHBondContact O-CG 3.4Å; F383-L387 PolarHBondContact O-N 3.22Å; G384-L387 PolarHBondContact O-N 3.31Å; L387-L416 HydrophobicContact CD1-CD1 3.89Å; L387-L416 HydrophobicContact CD1-CD2 3.92Å
388	L	90.3	Very high	76.2	Confident	6 Å²	6	75.1 Å²	75.1	3%	0.031	38%	0.381	C	S	.	.	S	Bend	trans	-140.3	104.8	-174.8	-169.4	62.7	0	0	0	110	L306 Y311 F314 I315 G384 V412	L306-L388 HydrophobicContact CB-CD1 3.88Å; L306-L388 HydrophobicContact CD1-CB 4.18Å; L306-L388 HydrophobicContact CD1-CD1 4.13Å; L306-L388 HydrophobicContact CD1-CD2 4.37Å; L306-L388 HydrophobicContact CD1-CG 4.46Å; Y311-L388 HydrophobicContact CD2-CD1 3.66Å; Y311-L388 HydrophobicContact CD2-CG 3.76Å; Y311-L388 HydrophobicContact CE2-CD1 4.34Å; Y311-L388 HydrophobicContact CE2-CG 3.92Å; Y311-L388 HydrophobicContact CG-CD1 4.49Å; F314-L388 HydrophobicContact CB-CD1 4.23Å; F314-L388 HydrophobicContact CB-CD2 3.94Å; F314-L388 HydrophobicContact CD2-CD1 4.2Å; I315-L388 HydrophobicContact CD1-CD2 4.15Å; G384-L388 PolarHBondContact O-N 3.45Å; L388-V412 HydrophobicContact CB-CG1 4.14Å; L388-V412 HydrophobicContact CB-CG2 4.46Å; L388-V412 HydrophobicContact CD2-CG1 4.45Å; L388-V412 HydrophobicContact CD2-CG2 4.04Å; L388-V412 HydrophobicContact CG-CG2 4.22Å
389	H	83.6	Confident	73.8	Confident	49 Å²	49	77.4 Å²	77.4	23%	0.227	40%	0.402	C	S	.	.			trans	-143.7	136.1	179	58.6	40.7	0	0	0	113	P385 Q391	P385-H389 PolarHBondContact O-CD2 3.45Å; H389-Q391 PolarHBondContact O-N 3.37Å
390	K	73.3	Confident	71.5	Confident	121 Å²	121	83.4 Å²	83.4	53%	0.526	44%	0.438	S	S	.	.			trans	-60.8	130.9	171.6	-150	171.2	-164.9	169.8	0	109	Y311 K392 E408	Y311-K390 HydrophobicContact CD1-CB 4.34Å; Y311-K390 HydrophobicContact CD1-CG 4.15Å; Y311-K390 HydrophobicContact CE1-CB 3.87Å; Y311-K390 HydrophobicContact CE1-CD 4.02Å; Y311-K390 HydrophobicContact CE1-CG 3.85Å; Y311-K390 HydrophobicContact CE2-CB 4.36Å; K390-K392 PolarHBondContact O-N 3.17Å; K390-E408 WeakPolarHBondContact CD-OE1 3.43Å; K390-E408 IonicContact NZ-OE1 2.72Å; K390-E408 PolarHBondContact NZ-OE1 3.19Å
391	Q	63.1	Low	69.4	Low	123 Å²	123	86.2 Å²	86.2	58%	0.575	45%	0.451	S	S	*	.			trans	-63.8	130.8	178.1	-166.1	-178.6	-82	0	0	109.5	R308 H389 S393	R308-Q391 HydrophobicContact CG-CB 4.34Å; H389-Q391 PolarHBondContact O-N 3.37Å; Q391-S393 PolarHBondContact O-N 2.73Å
392	K	55.2	Low	67.7	Low	195 Å²	195	87.5 Å²	87.5	85%	0.848	46%	0.462	S	S	*	.			trans	-60.9	110.6	169.7	-71.4	177.4	179	171.6	0	109.2	K390	K390-K392 PolarHBondContact O-N 3.17Å
393	S	46	Very low	65.9	Low	85 Å²	85	89.3 Å²	89.3	59%	0.594	48%	0.478	S	S	*	.			trans	-59.6	153.4	152	46.3	0	0	0	0	108.9	Q391 D395	Q391-S393 PolarHBondContact O-N 2.73Å; S393-D395 PolarHBondContact O-N 3.37Å
394	S	45.1	Very low	64.2	Low	111 Å²	111	91.7 Å²	91.7	78%	0.776	50%	0.498	S	S	*	.	S	Bend	trans	-75.9	1.9	-177.9	42.2	0	0	0	0	113.9
395	D	43.1	Very low	62.9	Low	111 Å²	111	96.7 Å²	96.7	59%	0.594	52%	0.517	S	S	*	.	S	Bend	trans	-106.6	140.3	-151.4	-47.7	-46.5	0	0	0	110.8	S393 E397	S393-D395 PolarHBondContact O-N 3.37Å; D395-E397 PolarHBondContact O-N 2.98Å
396	K	47.3	Very low	62	Low	209 Å²	209	95.4 Å²	95.4	91%	0.909	51%	0.513	S	S	*	.			trans	-83.2	41.8	-154.7	-60.7	176.4	-178.1	171.9	0	114.2	F398	K396-F398 VanDerWaalsContact C-N 3.3Å; K396-F398 PolarHBondContact O-N 3.13Å
397	E	46.9	Very low	61.1	Low	131 Å²	131	99.4 Å²	99.4	61%	0.612	53%	0.531	S	S	*	.			trans	-81.9	74.9	179.9	-163.2	174.5	-116.1	0	0	111.9	D395 Q401	D395-E397 PolarHBondContact O-N 2.98Å; E397-Q401 PolarHBondContact OE2-NE2 3.33Å
398	F	50.4	Low	60.4	Low	172 Å²	172	101.8 Å²	101.8	75%	0.754	54%	0.541	S	S	*	.			trans	-115.7	80	179.9	-116.4	-87.7	0	0	0	110.8	K396	K396-F398 VanDerWaalsContact C-N 3.3Å; K396-F398 PolarHBondContact O-N 3.13Å
399	S	46.4	Very low	60.2	Low	109 Å²	109	104.1 Å²	104.1	76%	0.762	56%	0.558	S	S	*	*	S	Bend	trans	-155.7	-51.3	165.4	-165.2	0	0	0	0	113.7
400	V	49.1	Very low	60.6	Low	125 Å²	125	106.1 Å²	106.1	76%	0.758	57%	0.574	S	S	*	*	S	Bend	trans	-94.1	-20.9	-168.9	-171.3	0	0	0	0	113.9	S402	V400-S402 PolarHBondContact O-N 3.07Å
401	Q	54.4	Low	61.6	Low	60 Å²	60	100.9 Å²	100.9	28%	0.28	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	10.3	-165.6	-58.6	-172.2	-4.9	0	0	116.5	E397 R405	E397-Q401 PolarHBondContact OE2-NE2 3.33Å; Q401-R405 HydrophobicContact CB-CG 4.29Å; Q401-R405 VanDerWaalsContact O-CB 3.25Å; Q401-R405 WeakPolarHBondContact O-CB 3.11Å; Q401-R405 WeakPolarHBondContact O-CD 3.42Å; Q401-R405 WeakPolarHBondContact O-CG 3.27Å; Q401-R405 PolarHBondContact O-N 2.88Å
402	S	60.1	Low	63.1	Low	95 Å²	95	95.4 Å²	95.4	66%	0.664	53%	0.529	S	S	*	.	H	α-helix	trans	-72.2	-40.6	-172.4	50.7	0	0	0	0	114.4	V400 A406	V400-S402 PolarHBondContact O-N 3.07Å; S402-A406 PolarHBondContact O-N 3.4Å
403	S	59.6	Low	65	Low	73 Å²	73	87.6 Å²	87.6	51%	0.51	50%	0.496	S	S	.	.	H	α-helix	trans	-70.6	-52.8	176	-153.6	0	0	0	0	110.6	R405 A406 E407	S403-R405 VanDerWaalsContact C-N 3.31Å; S403-R405 PolarHBondContact O-N 2.95Å; S403-A406 WeakPolarHBondContact O-CA 3.48Å; S403-A406 VanDerWaalsContact O-CB 3.31Å; S403-A406 WeakPolarHBondContact O-CB 3.34Å; S403-A406 PolarHBondContact O-N 3.17Å; S403-E407 VanDerWaalsContact CB-OE1 3.22Å; S403-E407 WeakPolarHBondContact CB-OE1 3.43Å; S403-E407 WeakPolarHBondContact O-CG 3.34Å; S403-E407 PolarHBondContact O-N 3.34Å; S403-E407 PolarHBondContact OG-OE1 3.33Å
404	A	62.1	Low	67.3	Low	49 Å²	49	85.4 Å²	85.4	41%	0.405	48%	0.483	S	S	.	.	H	α-helix	trans	-55.2	-40.5	178.8	0	0	0	0	0	113.3	A406 E407 E408	A404-A406 VanDerWaalsContact C-N 3.34Å; A404-A406 PolarHBondContact O-N 2.91Å; A404-E407 PolarHBondContact O-N 2.91Å; A404-E408 WeakPolarHBondContact O-CB 3.49Å; A404-E408 VanDerWaalsContact O-CG 3.31Å; A404-E408 WeakPolarHBondContact O-CG 3.4Å; A404-E408 PolarHBondContact O-N 3.12Å
405	R	67.3	Low	69.8	Low	105 Å²	105	80.2 Å²	80.2	40%	0.396	45%	0.447	S	S	.	.	H	α-helix	trans	-68.9	-29.7	174.3	-73.6	174.6	-174.5	177.2	3.5	113.2	Q401 S403 S409	Q401-R405 HydrophobicContact CB-CG 4.29Å; Q401-R405 VanDerWaalsContact O-CB 3.25Å; Q401-R405 WeakPolarHBondContact O-CB 3.11Å; Q401-R405 WeakPolarHBondContact O-CD 3.42Å; Q401-R405 WeakPolarHBondContact O-CG 3.27Å; Q401-R405 PolarHBondContact O-N 2.88Å; S403-R405 VanDerWaalsContact C-N 3.31Å; S403-R405 PolarHBondContact O-N 2.95Å; R405-S409 WeakPolarHBondContact O-CB 3.32Å; R405-S409 PolarHBondContact O-N 2.8Å; R405-S409 PolarHBondContact O-OG 3.44Å
406	A	70.8	Confident	72.3	Confident	49 Å²	49	75.2 Å²	75.2	41%	0.405	42%	0.42	S	S	.	.	H	α-helix	trans	-70.7	-45.8	173.7	0	0	0	0	0	110.4	S402 S403 A404 S409 T410	S402-A406 PolarHBondContact O-N 3.4Å; S403-A406 WeakPolarHBondContact O-CA 3.48Å; S403-A406 VanDerWaalsContact O-CB 3.31Å; S403-A406 WeakPolarHBondContact O-CB 3.34Å; S403-A406 PolarHBondContact O-N 3.17Å; A404-A406 VanDerWaalsContact C-N 3.34Å; A404-A406 PolarHBondContact O-N 2.91Å; A406-S409 PolarHBondContact O-N 3.29Å; A406-S409 VanDerWaalsContact O-N 3.1Å; A406-S409 PolarHBondContact O-OG 2.95Å; A406-T410 PolarHBondContact O-N 3.47Å; A406-T410 PolarHBondContact O-OG1 3.45Å
407	E	75	Confident	74.7	Confident	109 Å²	109	68.9 Å²	68.9	51%	0.509	39%	0.393	S	S	.	.	H	α-helix	trans	-59.6	-49.5	175.1	-67.9	148.7	-134.3	0	0	111.5	S403 A404 S409 T410 A411	S403-E407 VanDerWaalsContact CB-OE1 3.22Å; S403-E407 WeakPolarHBondContact CB-OE1 3.43Å; S403-E407 WeakPolarHBondContact O-CG 3.34Å; S403-E407 PolarHBondContact O-N 3.34Å; S403-E407 PolarHBondContact OG-OE1 3.33Å; A404-E407 PolarHBondContact O-N 2.91Å; E407-S409 VanDerWaalsContact C-N 3.27Å; E407-S409 PolarHBondContact O-N 2.87Å; E407-T410 WeakPolarHBondContact CA-OG1 3.23Å; E407-T410 PolarHBondContact O-N 2.95Å; E407-T410 VanDerWaalsContact O-N 3.15Å; E407-T410 PolarHBondContact O-OG1 3.06Å; E407-A411 PolarHBondContact O-N 3.44Å
408	E	79.8	Confident	77	Confident	50 Å²	50	66.1 Å²	66.1	23%	0.234	38%	0.377	C	S	.	.	H	α-helix	trans	-53.2	-43.8	170.7	-78.3	-179.5	154.8	0	0	111.3	K390 A404 A411 V412	K390-E408 WeakPolarHBondContact CD-OE1 3.43Å; K390-E408 IonicContact NZ-OE1 2.72Å; K390-E408 PolarHBondContact NZ-OE1 3.19Å; A404-E408 WeakPolarHBondContact O-CB 3.49Å; A404-E408 VanDerWaalsContact O-CG 3.31Å; A404-E408 WeakPolarHBondContact O-CG 3.4Å; A404-E408 PolarHBondContact O-N 3.12Å; E408-A411 PolarHBondContact O-N 3.32Å; E408-V412 WeakPolarHBondContact O-CG2 3.32Å; E408-V412 PolarHBondContact O-N 3.37Å
409	S	86.8	Confident	79.2	Confident	55 Å²	55	58 Å²	58	39%	0.385	34%	0.341	S	S	.	.	H	α-helix	trans	-67.8	-36.7	179.5	78	0	0	0	0	113.1	R405 A406 E407 V412 I413	R405-S409 WeakPolarHBondContact O-CB 3.32Å; R405-S409 PolarHBondContact O-N 2.8Å; R405-S409 PolarHBondContact O-OG 3.44Å; A406-S409 PolarHBondContact O-N 3.29Å; A406-S409 VanDerWaalsContact O-N 3.1Å; A406-S409 PolarHBondContact O-OG 2.95Å; E407-S409 VanDerWaalsContact C-N 3.27Å; E407-S409 PolarHBondContact O-N 2.87Å; S409-V412 PolarHBondContact O-N 3.08Å; S409-I413 VanDerWaalsContact O-CG1 3.23Å; S409-I413 WeakPolarHBondContact O-CG1 3.24Å; S409-I413 PolarHBondContact O-N 2.94Å
410	T	91.8	Very high	81.6	Confident	91 Å²	91	52.8 Å²	52.8	56%	0.558	31%	0.305	S	S	*	.	H	α-helix	trans	-67.5	-37	175.4	48.7	0	0	0	0	112.1	A406 E407 I413 A414	A406-T410 PolarHBondContact O-N 3.47Å; A406-T410 PolarHBondContact O-OG1 3.45Å; E407-T410 WeakPolarHBondContact CA-OG1 3.23Å; E407-T410 PolarHBondContact O-N 2.95Å; E407-T410 VanDerWaalsContact O-N 3.15Å; E407-T410 PolarHBondContact O-OG1 3.06Å; T410-I413 PolarHBondContact O-N 3.12Å; T410-A414 WeakPolarHBondContact O-CB 3.27Å; T410-A414 PolarHBondContact O-N 2.9Å
411	A	93.3	Very high	83.8	Confident	11 Å²	11	50.6 Å²	50.6	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-45.5	174.1	0	0	0	0	0	111.5	I315 T318 E407 E408 I413 A414 V415	I315-A411 HydrophobicContact CD1-CB 4.04Å; I315-A411 HydrophobicContact CG2-CB 3.96Å; T318-A411 HydrophobicContact CG2-CB 4.25Å; E407-A411 PolarHBondContact O-N 3.44Å; E408-A411 PolarHBondContact O-N 3.32Å; A411-I413 VanDerWaalsContact C-N 3.25Å; A411-I413 PolarHBondContact O-N 3.03Å; A411-A414 PolarHBondContact O-N 3.23Å; A411-V415 VanDerWaalsContact O-CG2 3.28Å; A411-V415 WeakPolarHBondContact O-CG2 3.06Å; A411-V415 PolarHBondContact O-N 2.66Å
412	V	94.4	Very high	85.6	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.055	29%	0.293	C	S	.	.	H	α-helix	trans	-52.6	-44	172.4	167.8	0	0	0	0	111.7	Y311 I315 G384 L388 E408 S409 L416	Y311-V412 HydrophobicContact CE2-CG2 4.34Å; I315-V412 HydrophobicContact CD1-CB 4.47Å; I315-V412 HydrophobicContact CD1-CG2 3.56Å; G384-V412 VanDerWaalsContact C-CG1 3.42Å; L388-V412 HydrophobicContact CB-CG1 4.14Å; L388-V412 HydrophobicContact CB-CG2 4.46Å; L388-V412 HydrophobicContact CD2-CG1 4.45Å; L388-V412 HydrophobicContact CD2-CG2 4.04Å; L388-V412 HydrophobicContact CG-CG2 4.22Å; E408-V412 WeakPolarHBondContact O-CG2 3.32Å; E408-V412 PolarHBondContact O-N 3.37Å; S409-V412 PolarHBondContact O-N 3.08Å; V412-L416 WeakPolarHBondContact O-CB 3.28Å; V412-L416 PolarHBondContact O-N 3.37Å; V412-L416 VanDerWaalsContact O-N 3.09Å
413	I	95.6	Very high	87.1	Confident	30 Å²	30	44 Å²	44	15%	0.154	26%	0.263	C	S	.	.	H	α-helix	trans	-69.4	-43.9	-179.4	-66.9	168.4	0	0	0	111	L377 A380 T381 S409 T410 A411 L416 Q417	L377-I413 HydrophobicContact CD1-CG2 3.69Å; A380-I413 HydrophobicContact CB-CG2 4.05Å; T381-I413 HydrophobicContact CG2-CD1 4.18Å; S409-I413 VanDerWaalsContact O-CG1 3.23Å; S409-I413 WeakPolarHBondContact O-CG1 3.24Å; S409-I413 PolarHBondContact O-N 2.94Å; T410-I413 PolarHBondContact O-N 3.12Å; A411-I413 VanDerWaalsContact C-N 3.25Å; A411-I413 PolarHBondContact O-N 3.03Å; I413-L416 PolarHBondContact O-N 3.09Å; I413-Q417 VanDerWaalsContact O-CB 3.27Å; I413-Q417 WeakPolarHBondContact O-CB 3.49Å; I413-Q417 PolarHBondContact O-N 3.43Å
414	A	95.3	Very high	88.6	Confident	40 Å²	40	48.2 Å²	48.2	33%	0.331	27%	0.274	S	S	.	.	H	α-helix	trans	-63.5	-41.5	178.5	0	0	0	0	0	112.7	T318 T410 A411 R418	T318-A414 HydrophobicContact CG2-CB 4.37Å; T410-A414 WeakPolarHBondContact O-CB 3.27Å; T410-A414 PolarHBondContact O-N 2.9Å; A411-A414 PolarHBondContact O-N 3.23Å; A414-R418 PolarHBondContact O-N 2.84Å
415	V	95.8	Very high	90	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-53.8	173.4	172.4	0	0	0	0	110.1	F314 T318 A411 Q417 R418 M419	F314-V415 HydrophobicContact CB-CG1 4.47Å; F314-V415 HydrophobicContact CD1-CG1 4.22Å; F314-V415 VanDerWaalsContact O-CG2 3.26Å; F314-V415 WeakPolarHBondContact O-CG2 3.42Å; T318-V415 HydrophobicContact CG2-CG2 3.59Å; A411-V415 VanDerWaalsContact O-CG2 3.28Å; A411-V415 WeakPolarHBondContact O-CG2 3.06Å; A411-V415 PolarHBondContact O-N 2.66Å; V415-Q417 PolarHBondContact O-N 2.95Å; V415-R418 WeakPolarHBondContact O-CB 3.31Å; V415-R418 PolarHBondContact O-N 3.22Å; V415-M419 HydrophobicContact CG1-CG 4.45Å; V415-M419 HydrophobicContact CG1-SD 3.67Å; V415-M419 WeakPolarHBondContact O-CG 3.28Å; V415-M419 PolarHBondContact O-N 3.43Å
416	L	96.9	Very high	91.3	Very high	5 Å²	5	44 Å²	44	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-34.9	-176.7	-177.2	59.1	0	0	0	113	L348 A380 F383 L387 V412 I413 R418 M419 I420	L348-L416 HydrophobicContact CD2-CD1 3.77Å; A380-L416 HydrophobicContact CB-CB 4.08Å; A380-L416 HydrophobicContact CB-CD2 4.37Å; A380-L416 HydrophobicContact CB-CG 4.11Å; F383-L416 HydrophobicContact CB-CD2 3.67Å; L387-L416 HydrophobicContact CD1-CD1 3.89Å; L387-L416 HydrophobicContact CD1-CD2 3.92Å; V412-L416 WeakPolarHBondContact O-CB 3.28Å; V412-L416 PolarHBondContact O-N 3.37Å; V412-L416 VanDerWaalsContact O-N 3.09Å; I413-L416 PolarHBondContact O-N 3.09Å; L416-R418 VanDerWaalsContact C-N 3.3Å; L416-R418 PolarHBondContact O-N 2.93Å; L416-M419 HydrophobicContact CD1-CB 4.36Å; L416-M419 PolarHBondContact O-N 3.21Å; L416-I420 HydrophobicContact CD1-CG1 4.38Å; L416-I420 HydrophobicContact CG-CD1 4.22Å; L416-I420 WeakPolarHBondContact O-CG1 3.42Å; L416-I420 PolarHBondContact O-N 2.8Å
417	Q	96.8	Very high	92.4	Very high	77 Å²	77	41.8 Å²	41.8	36%	0.36	24%	0.236	S	C	.	.	H	α-helix	trans	-59.3	-43.5	174.1	179.9	-177.1	-14.4	0	0	111	A380 I413 V415 I420 A421	A380-Q417 HydrophobicContact CB-CB 3.89Å; I413-Q417 VanDerWaalsContact O-CB 3.27Å; I413-Q417 WeakPolarHBondContact O-CB 3.49Å; I413-Q417 PolarHBondContact O-N 3.43Å; V415-Q417 PolarHBondContact O-N 2.95Å; Q417-I420 PolarHBondContact O-N 2.97Å; Q417-A421 PolarHBondContact O-N 2.94Å; Q417-A421 VanDerWaalsContact O-N 3.08Å
418	R	95.3	Very high	93.3	Very high	73 Å²	73	39.7 Å²	39.7	28%	0.275	23%	0.227	S	C	.	.	H	α-helix	trans	-65.7	-39.9	174.8	-167.2	-173.8	-50.1	-118	2.3	111.9	Q325 A414 V415 L416 I420 A421 G422	Q325-R418 VanDerWaalsContact CD-NH2 3.31Å; A414-R418 PolarHBondContact O-N 2.84Å; V415-R418 WeakPolarHBondContact O-CB 3.31Å; V415-R418 PolarHBondContact O-N 3.22Å; L416-R418 VanDerWaalsContact C-N 3.3Å; L416-R418 PolarHBondContact O-N 2.93Å; R418-I420 VanDerWaalsContact C-N 3.32Å; R418-I420 PolarHBondContact O-N 2.93Å; R418-A421 PolarHBondContact O-N 3.34Å; R418-G422 PolarHBondContact O-N 3.27Å
419	M	96.9	Very high	94	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-32.1	177.5	-68.9	172.5	67.6	0	0	113.4	L306 F314 T329 I333 L344 L348 V415 L416 C423 L426	L306-M419 HydrophobicContact CD1-CE 4.04Å; L306-M419 HydrophobicContact CD1-SD 4.17Å; L306-M419 HydrophobicContact CD2-CE 3.85Å; F314-M419 HydrophobicContact CE1-SD 4.47Å; T329-M419 HydrophobicContact CG2-CG 3.71Å; T329-M419 HydrophobicContact CG2-SD 4.2Å; I333-M419 HydrophobicContact CD1-CE 4.01Å; I333-M419 HydrophobicContact CG1-CE 4.26Å; L344-M419 HydrophobicContact CD1-CE 4.2Å; L344-M419 HydrophobicContact CD2-CE 3.82Å; L344-M419 HydrophobicContact CG-CE 4.45Å; L348-M419 HydrophobicContact CD1-CB 4.01Å; L348-M419 HydrophobicContact CD1-CE 4.08Å; L348-M419 HydrophobicContact CD2-CB 4.13Å; V415-M419 HydrophobicContact CG1-CG 4.45Å; V415-M419 HydrophobicContact CG1-SD 3.67Å; V415-M419 WeakPolarHBondContact O-CG 3.28Å; V415-M419 PolarHBondContact O-N 3.43Å; L416-M419 HydrophobicContact CD1-CB 4.36Å; L416-M419 PolarHBondContact O-N 3.21Å; M419-C423 WeakPolarHBondContact O-CA 3.22Å; M419-C423 PolarHBondContact O-N 2.95Å; M419-L426 HydrophobicContact CB-CD1 4.2Å; M419-L426 HydrophobicContact CG-CD1 4.14Å
420	I	96.9	Very high	94.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.2	-51.9	171.1	-66	165	0	0	0	109.7	L348 L351 L379 A380 L416 Q417 R418 G422 C423	L348-I420 HydrophobicContact CD2-CG1 3.75Å; L351-I420 HydrophobicContact CB-CD1 4.22Å; L351-I420 HydrophobicContact CB-CG1 4.1Å; L351-I420 HydrophobicContact CB-CG2 4.42Å; L351-I420 HydrophobicContact CD1-CD1 4.24Å; L351-I420 HydrophobicContact CD1-CG1 4.43Å; L379-I420 HydrophobicContact CB-CD1 4.09Å; A380-I420 HydrophobicContact CB-CD1 4.35Å; L416-I420 HydrophobicContact CD1-CG1 4.38Å; L416-I420 HydrophobicContact CG-CD1 4.22Å; L416-I420 WeakPolarHBondContact O-CG1 3.42Å; L416-I420 PolarHBondContact O-N 2.8Å; Q417-I420 PolarHBondContact O-N 2.97Å; R418-I420 VanDerWaalsContact C-N 3.32Å; R418-I420 PolarHBondContact O-N 2.93Å; I420-G422 VanDerWaalsContact C-N 3.34Å; I420-G422 PolarHBondContact O-N 3.34Å; I420-C423 WeakPolarHBondContact O-CB 3.2Å; I420-C423 PolarHBondContact O-N 3.16Å; I420-C423 PolarHBondContact O-SG 3.48Å; I420-C423 VanDerWaalsContact O-SG 3.34Å
421	A	94.4	Very high	94.3	Very high	79 Å²	79	33 Å²	33	65%	0.653	19%	0.189	S	C	*	.	H	α-helix	trans	-64.4	-33.6	-177.6	0	0	0	0	0	113.9	Q417 R418	Q417-A421 PolarHBondContact O-N 2.94Å; Q417-A421 VanDerWaalsContact O-N 3.08Å; R418-A421 PolarHBondContact O-N 3.34Å
422	G	91.9	Very high	94.3	Very high	12 Å²	12	35.1 Å²	35.1	12%	0.124	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	12.2	178.1	0	0	0	0	0	114.6	R418 I420 Q424 T425 L426	R418-G422 PolarHBondContact O-N 3.27Å; I420-G422 VanDerWaalsContact C-N 3.34Å; I420-G422 PolarHBondContact O-N 3.34Å; G422-Q424 PolarHBondContact O-N 3.3Å; G422-Q424 VanDerWaalsContact O-N 3.07Å; G422-T425 PolarHBondContact O-N 2.82Å; G422-T425 PolarHBondContact O-OG1 3.08Å; G422-T425 VanDerWaalsContact O-OG1 3.1Å; G422-L426 VanDerWaalsContact O-CG 3.31Å; G422-L426 WeakPolarHBondContact O-CG 3.43Å; G422-L426 PolarHBondContact O-N 3.33Å
423	C	93.5	Very high	94.2	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.034	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-31.5	-168.9	66.6	0	0	0	0	114	L348 S352 M419 I420 F427	L348-C423 HydrophobicContact CB-CB 3.84Å; S352-C423 VanDerWaalsContact CB-SG 3.58Å; M419-C423 WeakPolarHBondContact O-CA 3.22Å; M419-C423 PolarHBondContact O-N 2.95Å; I420-C423 WeakPolarHBondContact O-CB 3.2Å; I420-C423 PolarHBondContact O-N 3.16Å; I420-C423 PolarHBondContact O-SG 3.48Å; I420-C423 VanDerWaalsContact O-SG 3.34Å; C423-F427 WeakPolarHBondContact O-CD2 3.29Å
424	Q	89.4	Confident	94.1	Very high	161 Å²	161	34 Å²	34	75%	0.752	19%	0.192	S	C	*	.	H	α-helix	trans	-71.7	-27.7	179.3	-60.2	-178.9	10.2	0	0	113.6	G422 M428	G422-Q424 PolarHBondContact O-N 3.3Å; G422-Q424 VanDerWaalsContact O-N 3.07Å; Q424-M428 WeakPolarHBondContact O-CG 3.45Å
425	T	92.1	Very high	94	Very high	63 Å²	63	33.1 Å²	33.1	39%	0.387	18%	0.182	S	C	.	.	H	α-helix	trans	-96.8	-35.4	-178.4	59.4	0	0	0	0	112.3	Q326 Q330 G422 F427 M428	Q326-T425 PolarHBondContact NE2-OG1 3.18Å; Q330-T425 PolarHBondContact NE2-O 3.31Å; G422-T425 PolarHBondContact O-N 2.82Å; G422-T425 PolarHBondContact O-OG1 3.08Å; G422-T425 VanDerWaalsContact O-OG1 3.1Å; T425-F427 PolarHBondContact O-N 2.85Å; T425-F427 VanDerWaalsContact O-N 3.11Å; T425-M428 PolarHBondContact O-N 2.82Å
426	L	94.1	Very high	93.8	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-21.8	-173.8	-72.1	172.1	0	0	0	114.8	Q326 T329 Q330 I333 M419 G422	Q326-L426 HydrophobicContact CG-CD2 4.19Å; T329-L426 HydrophobicContact CG2-CD1 4.31Å; T329-L426 HydrophobicContact CG2-CD2 4.03Å; Q330-L426 HydrophobicContact CB-CD2 3.91Å; I333-L426 HydrophobicContact CD1-CB 3.87Å; I333-L426 HydrophobicContact CD1-CD1 4.03Å; I333-L426 HydrophobicContact CD1-CD2 4.24Å; I333-L426 HydrophobicContact CD1-CG 4.27Å; M419-L426 HydrophobicContact CB-CD1 4.2Å; M419-L426 HydrophobicContact CG-CD1 4.14Å; G422-L426 VanDerWaalsContact O-CG 3.31Å; G422-L426 WeakPolarHBondContact O-CG 3.43Å; G422-L426 PolarHBondContact O-N 3.33Å
427	F	94.6	Very high	93.7	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	12.5	176.9	-60.9	-86	0	0	0	114	A33 V34 I333 S341 L344 H345 L348 C423 T425	A33-F427 WeakPolarHBondContact CA-O 3.35Å; V34-F427 WeakPolarHBondContact CG2-O 3.43Å; V34-F427 PolarHBondContact N-O 3.23Å; I333-F427 HydrophobicContact CD1-CZ 4.45Å; I333-F427 HydrophobicContact CG2-CD1 3.79Å; I333-F427 HydrophobicContact CG2-CE1 3.36Å; I333-F427 HydrophobicContact CG2-CZ 3.94Å; S341-F427 WeakPolarHBondContact O-CE1 3.49Å; L344-F427 HydrophobicContact CB-CZ 4.44Å; L344-F427 HydrophobicContact CD2-CE1 4.4Å; L344-F427 HydrophobicContact CD2-CZ 3.92Å; L344-F427 HydrophobicContact CG-CZ 4.01Å; H345-F427 HydrophobicContact CB-CD1 3.76Å; H345-F427 HydrophobicContact CB-CD2 4.04Å; H345-F427 HydrophobicContact CB-CE1 3.66Å; H345-F427 HydrophobicContact CB-CE2 3.98Å; H345-F427 HydrophobicContact CB-CG 3.95Å; H345-F427 HydrophobicContact CB-CZ 3.79Å; H345-F427 AromaticContact CD2-CD2 3.38Å; H345-F427 WeakPolarHBondContact CD2-CD2 3.4Å; H345-F427 AromaticContact CD2-CE2 3.83Å; H345-F427 AromaticContact CD2-CG 3.75Å; H345-F427 AromaticContact CG-CD1 3.97Å; H345-F427 AromaticContact CG-CD2 3.71Å; H345-F427 AromaticContact CG-CG 3.65Å; H345-F427 AromaticContact ND1-CG 4Å; H345-F427 AromaticContact NE2-CD2 3.95Å; L348-F427 HydrophobicContact CD1-CE2 3.87Å; L348-F427 HydrophobicContact CD1-CZ 4.03Å; C423-F427 WeakPolarHBondContact O-CD2 3.29Å; T425-F427 PolarHBondContact O-N 2.85Å; T425-F427 VanDerWaalsContact O-N 3.11Å
428	M	94.4	Very high	93.4	Very high	65 Å²	65	32.2 Å²	32.2	32%	0.32	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.6	176.4	-66.4	-62	-65.5	0	0	110.7	P31 A33 Q330 Y334 Q424 T425 P430	P31-M428 HydrophobicContact CB-CE 4.02Å; P31-M428 VanDerWaalsContact O-CE 3.29Å; P31-M428 WeakPolarHBondContact O-CE 3.49Å; A33-M428 HydrophobicContact CB-SD 3.75Å; Q330-M428 PolarHBondContact NE2-O 3.15Å; Q330-M428 VanDerWaalsContact NE2-O 3.14Å; Y334-M428 PolarHBondContact OH-O 3.03Å; Y334-M428 VanDerWaalsContact OH-O 3.07Å; Q424-M428 WeakPolarHBondContact O-CG 3.45Å; T425-M428 PolarHBondContact O-N 2.82Å; M428-P430 WeakPolarHBondContact O-CD 3.46Å
429	V	94.5	Very high	93.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	118.4	179	-166.2	0	0	0	0	109.5	P31 V32 V34 L37 L45 Y334 L433 Q434	P31-V429 WeakPolarHBondContact CA-O 3.39Å; V32-V429 PolarHBondContact N-O 3.31Å; V32-V429 PolarHBondContact O-N 3.01Å; V34-V429 HydrophobicContact CB-CG2 4.43Å; V34-V429 HydrophobicContact CG2-CG2 3.41Å; V34-V429 VanDerWaalsContact CG2-CG2 3.41Å; L37-V429 HydrophobicContact CD1-CG2 3.88Å; L45-V429 HydrophobicContact CD1-CG1 3.8Å; L45-V429 HydrophobicContact CD2-CG1 4.15Å; L45-V429 HydrophobicContact CD2-CG2 3.68Å; Y334-V429 HydrophobicContact CE1-CG2 4.23Å; Y334-V429 WeakPolarHBondContact OH-CA 3.16Å; V429-L433 HydrophobicContact CG1-CB 4.02Å; V429-Q434 HydrophobicContact CB-CG 4.2Å; V429-Q434 HydrophobicContact CG1-CG 3.82Å; V429-Q434 PolarHBondContact O-NE2 2.96Å
430	P	92.9	Very high	92.9	Very high	31 Å²	31	33.2 Å²	33.2	20%	0.201	19%	0.19	C	C	.	.			trans	-72.3	163.5	-177.9	33.5	-38.2	0	0	0	111.8	M428 D432 L433 Q434	M428-P430 WeakPolarHBondContact O-CD 3.46Å; P430-D432 VanDerWaalsContact C-N 3.29Å; P430-D432 WeakPolarHBondContact CB-OD1 3.31Å; P430-D432 VanDerWaalsContact CG-OD1 3.22Å; P430-D432 WeakPolarHBondContact CG-OD1 3.36Å; P430-D432 PolarHBondContact O-N 3Å; P430-L433 HydrophobicContact CG-CB 4.3Å; P430-L433 HydrophobicContact CG-CD1 3.94Å; P430-L433 HydrophobicContact CG-CG 4.09Å; P430-L433 PolarHBondContact O-N 3.42Å; P430-Q434 PolarHBondContact O-N 3.03Å; P430-Q434 VanDerWaalsContact O-N 3.16Å
431	P	91.9	Very high	92.5	Very high	24 Å²	24	33.2 Å²	33.2	16%	0.156	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-27.5	-173.1	-26.1	37.3	0	0	0	115.1	F17 L29 P31 N435	F17-P431 HydrophobicContact CB-CB 3.79Å; F17-P431 HydrophobicContact CD1-CB 4.12Å; F17-P431 HydrophobicContact CD2-CB 3.72Å; F17-P431 HydrophobicContact CE2-CB 4.32Å; F17-P431 HydrophobicContact CG-CB 3.59Å; L29-P431 HydrophobicContact CB-CB 4.08Å; P31-P431 HydrophobicContact CG-CG 4.46Å; P431-N435 VanDerWaalsContact O-CB 3.28Å; P431-N435 WeakPolarHBondContact O-CB 3.25Å; P431-N435 PolarHBondContact O-N 2.87Å
432	D	91.7	Very high	92.2	Very high	56 Å²	56	31.9 Å²	31.9	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-69.2	-52.1	177.6	59.3	-52.8	0	0	0	112	F17 R52 P430 Q434 N435 E436	F17-D432 HydrophobicContact CE1-CB 3.75Å; F17-D432 HydrophobicContact CZ-CB 3.9Å; R52-D432 IonicContact NH2-OD2 2.68Å; P430-D432 VanDerWaalsContact C-N 3.29Å; P430-D432 WeakPolarHBondContact CB-OD1 3.31Å; P430-D432 VanDerWaalsContact CG-OD1 3.22Å; P430-D432 WeakPolarHBondContact CG-OD1 3.36Å; P430-D432 PolarHBondContact O-N 3Å; D432-Q434 VanDerWaalsContact C-N 3.27Å; D432-Q434 PolarHBondContact O-N 2.91Å; D432-N435 WeakPolarHBondContact O-CA 3.17Å; D432-N435 VanDerWaalsContact O-CB 3.28Å; D432-N435 WeakPolarHBondContact O-CB 3.41Å; D432-N435 PolarHBondContact O-N 3.42Å; D432-E436 PolarHBondContact O-N 2.63Å
433	L	92.9	Very high	92	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-32.8	176	-65.1	178.3	0	0	0	111.9	L45 V48 R52 L331 Y334 V429 P430 V437	L45-L433 HydrophobicContact CD1-CB 4.21Å; V48-L433 HydrophobicContact CG1-CD2 3.97Å; R52-L433 HydrophobicContact CG-CD2 4.24Å; L331-L433 HydrophobicContact CD2-CD1 3.78Å; L331-L433 HydrophobicContact CD2-CD2 4.47Å; Y334-L433 HydrophobicContact CD2-CD1 4.4Å; Y334-L433 HydrophobicContact CE2-CD1 3.81Å; V429-L433 HydrophobicContact CG1-CB 4.02Å; P430-L433 HydrophobicContact CG-CB 4.3Å; P430-L433 HydrophobicContact CG-CD1 3.94Å; P430-L433 HydrophobicContact CG-CG 4.09Å; P430-L433 PolarHBondContact O-N 3.42Å; L433-V437 VanDerWaalsContact O-CG2 3.31Å; L433-V437 WeakPolarHBondContact O-CG2 3.27Å; L433-V437 PolarHBondContact O-N 3.36Å; L433-V437 VanDerWaalsContact O-N 3.08Å
434	Q	93.9	Very high	91.6	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-65.3	-38.2	169.6	-77.7	-175.5	79.9	0	0	112.5	L29 T30 V429 P430 D432 V437 L438	L29-Q434 HydrophobicContact CD1-CB 4.14Å; T30-Q434 PolarHBondContact O-NE2 2.91Å; V429-Q434 HydrophobicContact CB-CG 4.2Å; V429-Q434 HydrophobicContact CG1-CG 3.82Å; V429-Q434 PolarHBondContact O-NE2 2.96Å; P430-Q434 PolarHBondContact O-N 3.03Å; P430-Q434 VanDerWaalsContact O-N 3.16Å; D432-Q434 VanDerWaalsContact C-N 3.27Å; D432-Q434 PolarHBondContact O-N 2.91Å; Q434-V437 PolarHBondContact O-N 2.81Å; Q434-L438 WeakPolarHBondContact O-CG 3.36Å; Q434-L438 PolarHBondContact O-N 3.05Å
435	N	92.6	Very high	91.5	Very high	20 Å²	20	38.6 Å²	38.6	11%	0.107	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-44.9	177	-176.9	81.2	0	0	0	111.5	Y13 F17 W19 L29 P431 D432 L438 M439	Y13-N435 VanDerWaalsContact CD2-OD1 3.31Å; Y13-N435 WeakPolarHBondContact CD2-OD1 3.32Å; Y13-N435 WeakPolarHBondContact CE2-OD1 3.44Å; F17-N435 HydrophobicContact CD1-CB 4.06Å; W19-N435 PolarHBondContact NE1-OD1 3.33Å; L29-N435 HydrophobicContact CD1-CB 4.05Å; P431-N435 VanDerWaalsContact O-CB 3.28Å; P431-N435 WeakPolarHBondContact O-CB 3.25Å; P431-N435 PolarHBondContact O-N 2.87Å; D432-N435 WeakPolarHBondContact O-CA 3.17Å; D432-N435 VanDerWaalsContact O-CB 3.28Å; D432-N435 WeakPolarHBondContact O-CB 3.41Å; D432-N435 PolarHBondContact O-N 3.42Å; N435-L438 PolarHBondContact O-N 3.21Å; N435-M439 VanDerWaalsContact O-CG 3.32Å; N435-M439 WeakPolarHBondContact O-CG 3.3Å; N435-M439 PolarHBondContact O-N 2.73Å
436	E	92.5	Very high	91.2	Very high	56 Å²	56	38.5 Å²	38.5	26%	0.262	21%	0.207	S	C	.	.	H	α-helix	trans	-62.7	-40.4	175.1	-75.6	164.8	-88.4	0	0	112.7	V48 R52 D432 L438 M439 S440	V48-E436 HydrophobicContact CG1-CB 3.82Å; V48-E436 HydrophobicContact CG2-CB 4.25Å; R52-E436 IonicContact CZ-OE1 3.91Å; R52-E436 IonicContact CZ-OE2 3.8Å; R52-E436 IonicContact NE-OE1 3.3Å; R52-E436 IonicContact NE-OE2 4Å; R52-E436 PolarHBondContact NE-OE2 3.41Å; R52-E436 IonicContact NH2-OE1 3.09Å; R52-E436 PolarHBondContact NH2-OE1 3.31Å; R52-E436 IonicContact NH2-OE2 2.81Å; R52-E436 PolarHBondContact NH2-OE2 3.13Å; D432-E436 PolarHBondContact O-N 2.63Å; E436-L438 VanDerWaalsContact C-N 3.32Å; E436-L438 PolarHBondContact O-N 3.31Å; E436-M439 PolarHBondContact O-N 3.02Å; E436-S440 WeakPolarHBondContact O-CB 3.26Å; E436-S440 PolarHBondContact O-N 2.99Å
437	V	93.3	Very high	90.9	Very high	8 Å²	8	44.3 Å²	44.3	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-41.1	172.7	164.5	0	0	0	0	111.5	R44 L45 V48 L433 Q434 L441	R44-V437 HydrophobicContact CB-CG1 3.9Å; R44-V437 HydrophobicContact CB-CG2 4.27Å; L45-V437 HydrophobicContact CB-CG2 4.03Å; L45-V437 HydrophobicContact CD1-CG2 4.14Å; V48-V437 HydrophobicContact CB-CG2 4.39Å; V48-V437 HydrophobicContact CG2-CG2 3.98Å; L433-V437 VanDerWaalsContact O-CG2 3.31Å; L433-V437 WeakPolarHBondContact O-CG2 3.27Å; L433-V437 PolarHBondContact O-N 3.36Å; L433-V437 VanDerWaalsContact O-N 3.08Å; Q434-V437 PolarHBondContact O-N 2.81Å; V437-L441 HydrophobicContact CG1-CD1 4.12Å; V437-L441 WeakPolarHBondContact O-CB 3.4Å; V437-L441 VanDerWaalsContact O-CG 3.29Å; V437-L441 WeakPolarHBondContact O-CG 3.33Å; V437-L441 PolarHBondContact O-N 3.46Å; V437-L441 VanDerWaalsContact O-N 3.07Å
438	L	91.8	Very high	90.6	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-71.2	-35.7	176.3	-69.3	175.4	0	0	0	112.8	W19 L29 Q434 N435 E436 L441 L442 V449 L452 L453	W19-L438 HydrophobicContact CD2-CD1 4.29Å; W19-L438 HydrophobicContact CG-CD1 4.49Å; W19-L438 HydrophobicContact CH2-CB 3.73Å; W19-L438 HydrophobicContact CZ2-CB 3.5Å; W19-L438 HydrophobicContact CZ2-CD1 4.42Å; W19-L438 HydrophobicContact CZ3-CB 4.39Å; L29-L438 HydrophobicContact CD1-CD1 4.13Å; L29-L438 HydrophobicContact CD2-CD1 3.93Å; Q434-L438 WeakPolarHBondContact O-CG 3.36Å; Q434-L438 PolarHBondContact O-N 3.05Å; N435-L438 PolarHBondContact O-N 3.21Å; E436-L438 VanDerWaalsContact C-N 3.32Å; E436-L438 PolarHBondContact O-N 3.31Å; L438-L441 PolarHBondContact O-N 2.93Å; L438-L442 WeakPolarHBondContact O-CB 3.31Å; L438-L442 PolarHBondContact O-N 3.3Å; L438-V449 HydrophobicContact CD2-CG1 4.43Å; L438-L452 HydrophobicContact CD2-CD1 4.37Å; L438-L453 HydrophobicContact CD1-CD2 4.11Å
439	M	90.6	Very high	90.3	Very high	63 Å²	63	42.2 Å²	42.2	31%	0.31	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-47.4	173.6	-69.1	-66.7	-178.1	0	0	111.6	Y13 W19 N435 E436 L441 L442 E443	Y13-M439 HydrophobicContact CD1-CE 4.1Å; Y13-M439 HydrophobicContact CD2-CE 4.14Å; Y13-M439 HydrophobicContact CG-CE 3.68Å; W19-M439 HydrophobicContact CH2-CE 3.95Å; W19-M439 HydrophobicContact CH2-CG 4.13Å; W19-M439 HydrophobicContact CH2-SD 3.64Å; W19-M439 HydrophobicContact CZ2-CE 3.71Å; W19-M439 HydrophobicContact CZ2-CG 4Å; W19-M439 HydrophobicContact CZ2-SD 3.88Å; N435-M439 VanDerWaalsContact O-CG 3.32Å; N435-M439 WeakPolarHBondContact O-CG 3.3Å; N435-M439 PolarHBondContact O-N 2.73Å; E436-M439 PolarHBondContact O-N 3.02Å; M439-L441 VanDerWaalsContact C-N 3.26Å; M439-L441 PolarHBondContact O-N 3.49Å; M439-L442 WeakPolarHBondContact O-CB 3.49Å; M439-L442 PolarHBondContact O-N 3.37Å; M439-E443 PolarHBondContact O-N 3.36Å; M439-E443 VanDerWaalsContact O-N 3.13Å
440	S	89.9	Confident	90	Very high	31 Å²	31	42.5 Å²	42.5	22%	0.217	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-33	176.2	179.9	0	0	0	0	112.7	E436 T444	E436-S440 WeakPolarHBondContact O-CB 3.26Å; E436-S440 PolarHBondContact O-N 2.99Å; S440-T444 PolarHBondContact O-OG1 3.06Å
441	L	89.4	Confident	89.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-73.6	-32	170.6	-73.4	170	0	0	0	112.9	L40 R44 V437 L438 M439 E443 T444 D445 V449 L452	L40-L441 HydrophobicContact CD1-CD2 4.21Å; L40-L441 HydrophobicContact CD2-CD2 3.84Å; L40-L441 HydrophobicContact CG-CD2 3.9Å; R44-L441 HydrophobicContact CG-CD1 4.44Å; R44-L441 HydrophobicContact CG-CD2 3.76Å; R44-L441 HydrophobicContact CG-CG 3.93Å; V437-L441 HydrophobicContact CG1-CD1 4.12Å; V437-L441 WeakPolarHBondContact O-CB 3.4Å; V437-L441 VanDerWaalsContact O-CG 3.29Å; V437-L441 WeakPolarHBondContact O-CG 3.33Å; V437-L441 PolarHBondContact O-N 3.46Å; V437-L441 VanDerWaalsContact O-N 3.07Å; L438-L441 PolarHBondContact O-N 2.93Å; M439-L441 VanDerWaalsContact C-N 3.26Å; M439-L441 PolarHBondContact O-N 3.49Å; L441-E443 VanDerWaalsContact C-N 3.33Å; L441-E443 PolarHBondContact O-N 3.1Å; L441-T444 PolarHBondContact O-N 2.86Å; L441-D445 CarbonylContact O-C 3.6Å; L441-D445 PolarHBondContact O-N 3.35Å; L441-V449 HydrophobicContact CB-CG2 3.53Å; L441-L452 HydrophobicContact CD1-CD1 3.79Å
442	L	88.6	Confident	89.7	Confident	50 Å²	50	44 Å²	44	26%	0.262	23%	0.23	S	C	.	.	H	α-helix	trans	-67.2	-36	178.6	-169.9	68.3	0	0	0	111.8	H11 W19 L438 M439 T444 P446 V449	H11-L442 HydrophobicContact CB-CD1 3.86Å; H11-L442 HydrophobicContact CB-CD2 4.46Å; H11-L442 WeakPolarHBondContact ND1-CD1 3.38Å; W19-L442 HydrophobicContact CH2-CD2 4.39Å; W19-L442 HydrophobicContact CZ3-CD2 4.2Å; L438-L442 WeakPolarHBondContact O-CB 3.31Å; L438-L442 PolarHBondContact O-N 3.3Å; M439-L442 WeakPolarHBondContact O-CB 3.49Å; M439-L442 PolarHBondContact O-N 3.37Å; L442-T444 PolarHBondContact O-N 3.02Å; L442-P446 HydrophobicContact CD1-CB 4.08Å; L442-V449 HydrophobicContact CB-CG2 4.17Å; L442-V449 HydrophobicContact CD1-CB 4.37Å; L442-V449 HydrophobicContact CD1-CG1 4.34Å; L442-V449 HydrophobicContact CD1-CG2 4.38Å
443	E	87.1	Confident	89.5	Confident	172 Å²	172	41.3 Å²	41.3	80%	0.804	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-20.2	173.8	-68.3	-178.1	171.2	0	0	113.9	M439 L441	M439-E443 PolarHBondContact O-N 3.36Å; M439-E443 VanDerWaalsContact O-N 3.13Å; L441-E443 VanDerWaalsContact C-N 3.33Å; L441-E443 PolarHBondContact O-N 3.1Å
444	T	86.3	Confident	89.3	Confident	70 Å²	70	46 Å²	46	43%	0.429	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-42.8	-170.2	46.9	0	0	0	0	114.8	R44 S440 L441 L442	R44-T444 PolarHBondContact NH2-OG1 3.13Å; S440-T444 PolarHBondContact O-OG1 3.06Å; L441-T444 PolarHBondContact O-N 2.86Å; L442-T444 PolarHBondContact O-N 3.02Å
445	D	86.4	Confident	88.9	Confident	78 Å²	78	46.8 Å²	46.8	42%	0.417	24%	0.235	S	C	.	.			trans	-144.1	74.2	-176.6	-70.3	-73.3	0	0	0	111	L441 D447 V448 V449	L441-D445 CarbonylContact O-C 3.6Å; L441-D445 PolarHBondContact O-N 3.35Å; D445-D447 VanDerWaalsContact C-N 3.31Å; D445-D447 PolarHBondContact O-N 3.15Å; D445-V448 HydrophobicContact CB-CB 3.9Å; D445-V448 HydrophobicContact CB-CG2 3.75Å; D445-V448 WeakPolarHBondContact O-CB 3.39Å; D445-V448 PolarHBondContact O-N 3.1Å; D445-V449 PolarHBondContact O-N 2.69Å
446	P	86.3	Confident	88.6	Confident	60 Å²	60	47 Å²	47	39%	0.39	24%	0.235	S	C	.	.	H	α-helix	trans	-61.8	-32.2	-174.5	23.3	-34.3	0	0	0	114.1	H11 L442 V448 V449 D450	H11-P446 PolarHBondContact CE1-O 3.4Å; L442-P446 HydrophobicContact CD1-CB 4.08Å; P446-V448 PolarHBondContact O-N 3.21Å; P446-V449 WeakPolarHBondContact O-CB 3.42Å; P446-V449 PolarHBondContact O-N 3.3Å; P446-D450 PolarHBondContact O-N 3Å; P446-D450 VanDerWaalsContact O-N 3.08Å
447	D	87.6	Confident	88.2	Confident	126 Å²	126	45.2 Å²	45.2	67%	0.674	23%	0.23	S	C	*	.	H	α-helix	trans	-61.6	-32.4	173.7	-70.8	-45.9	0	0	0	112.5	D445 D450 Y451	D445-D447 VanDerWaalsContact C-N 3.31Å; D445-D447 PolarHBondContact O-N 3.15Å; D447-D450 PolarHBondContact O-N 2.9Å; D447-Y451 PolarHBondContact O-N 3.31Å
448	V	88.1	Confident	87.6	Confident	23 Å²	23	48.8 Å²	48.8	14%	0.139	26%	0.255	C	S	.	.	H	α-helix	trans	-72.5	-39.5	177	175.7	0	0	0	0	110.5	L40 L228 D445 P446 D450 Y451 L452	L40-V448 HydrophobicContact CD2-CG1 3.77Å; L228-V448 HydrophobicContact CD1-CG1 4.24Å; L228-V448 HydrophobicContact CD1-CG2 4.21Å; L228-V448 HydrophobicContact CD2-CG1 3.59Å; L228-V448 HydrophobicContact CD2-CG2 4.46Å; D445-V448 HydrophobicContact CB-CB 3.9Å; D445-V448 HydrophobicContact CB-CG2 3.75Å; D445-V448 WeakPolarHBondContact O-CB 3.39Å; D445-V448 PolarHBondContact O-N 3.1Å; P446-V448 PolarHBondContact O-N 3.21Å; V448-D450 VanDerWaalsContact C-N 3.29Å; V448-D450 PolarHBondContact O-N 3.02Å; V448-Y451 PolarHBondContact O-N 2.9Å; V448-L452 HydrophobicContact CG1-CD1 4.02Å; V448-L452 HydrophobicContact CG1-CG 4.23Å; V448-L452 WeakPolarHBondContact O-CB 3.42Å; V448-L452 VanDerWaalsContact O-CG 3.31Å; V448-L452 WeakPolarHBondContact O-CG 3.5Å; V448-L452 PolarHBondContact O-N 3.39Å
449	V	88.3	Confident	86.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-43.8	171.2	177.6	0	0	0	0	110.5	W19 L438 L441 L442 D445 P446 Y451 L452 L453	W19-V449 HydrophobicContact CE3-CG1 4.39Å; W19-V449 HydrophobicContact CZ3-CG1 4.04Å; L438-V449 HydrophobicContact CD2-CG1 4.43Å; L441-V449 HydrophobicContact CB-CG2 3.53Å; L442-V449 HydrophobicContact CB-CG2 4.17Å; L442-V449 HydrophobicContact CD1-CB 4.37Å; L442-V449 HydrophobicContact CD1-CG1 4.34Å; L442-V449 HydrophobicContact CD1-CG2 4.38Å; D445-V449 PolarHBondContact O-N 2.69Å; P446-V449 WeakPolarHBondContact O-CB 3.42Å; P446-V449 PolarHBondContact O-N 3.3Å; V449-Y451 PolarHBondContact O-N 3.37Å; V449-L452 PolarHBondContact O-N 2.7Å; V449-L453 HydrophobicContact CG1-CD1 3.76Å; V449-L453 HydrophobicContact CG1-CG 4.27Å; V449-L453 WeakPolarHBondContact O-CB 3.28Å; V449-L453 VanDerWaalsContact O-CG 3.31Å; V449-L453 WeakPolarHBondContact O-CG 3.45Å; V449-L453 PolarHBondContact O-N 3.05Å
450	D	87.4	Confident	85.2	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.032	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-37.6	176.7	-158.4	35.3	0	0	0	113.1	H11 S21 L22 P446 D447 V448 R454	H11-D450 WeakPolarHBondContact NE2-CA 3.46Å; H11-D450 VanDerWaalsContact NE2-CB 3.27Å; H11-D450 WeakPolarHBondContact NE2-CB 3.48Å; H11-D450 PolarHBondContact NE2-N 3.39Å; H11-D450 IonicContact NE2-OD1 2.69Å; S21-D450 WeakPolarHBondContact CA-OD1 3.44Å; S21-D450 VanDerWaalsContact CB-OD1 3.29Å; S21-D450 WeakPolarHBondContact CB-OD1 3.5Å; S21-D450 PolarHBondContact OG-OD1 2.67Å; L22-D450 WeakPolarHBondContact CB-OD2 3.04Å; L22-D450 HydrophobicContact CD1-CB 4.17Å; L22-D450 HydrophobicContact CG-CB 4.19Å; L22-D450 PolarHBondContact N-OD1 3.49Å; P446-D450 PolarHBondContact O-N 3Å; P446-D450 VanDerWaalsContact O-N 3.08Å; D447-D450 PolarHBondContact O-N 2.9Å; V448-D450 VanDerWaalsContact C-N 3.29Å; V448-D450 PolarHBondContact O-N 3.02Å; D450-R454 VanDerWaalsContact CG-CZ 3.48Å; D450-R454 WeakPolarHBondContact O-CB 3.22Å; D450-R454 VanDerWaalsContact O-CG 3.3Å; D450-R454 WeakPolarHBondContact O-CG 3.38Å; D450-R454 PolarHBondContact O-N 2.75Å; D450-R454 PolarHBondContact O-NE 3.31Å; D450-R454 IonicContact OD2-CZ 3.86Å; D450-R454 IonicContact OD2-NE 3.74Å; D450-R454 IonicContact OD2-NH1 3.08Å; D450-R454 PolarHBondContact OD2-NH1 3.04Å; D450-R454 IonicContact OD2-NH2 3.71Å; D450-R454 PolarHBondContact OD2-NH2 3.13Å; D450-R454 VanDerWaalsContact OD2-NH2 3.17Å
451	Y	89.3	Confident	83.2	Confident	87 Å²	87	58.9 Å²	58.9	34%	0.341	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-48.7	172.5	174.5	-93.4	0	0	0	111.9	L228 D447 V448 V449 R454 R455	L228-Y451 HydrophobicContact CB-CD1 4.19Å; L228-Y451 HydrophobicContact CB-CE1 3.79Å; L228-Y451 HydrophobicContact CD1-CD1 4Å; L228-Y451 HydrophobicContact CD1-CE1 4.32Å; L228-Y451 HydrophobicContact CD1-CG 4.5Å; D447-Y451 PolarHBondContact O-N 3.31Å; V448-Y451 PolarHBondContact O-N 2.9Å; V449-Y451 PolarHBondContact O-N 3.37Å; Y451-R454 PolarHBondContact O-N 2.86Å; Y451-R455 WeakPolarHBondContact O-CB 3.41Å; Y451-R455 PolarHBondContact O-N 2.79Å
452	L	88.8	Confident	80.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-41.7	-179.7	-69	175.4	0	0	0	112	E41 L438 L441 V448 V449 R455 K456	E41-L452 HydrophobicContact CG-CD1 3.78Å; E41-L452 HydrophobicContact CG-CD2 4.21Å; E41-L452 WeakPolarHBondContact OE2-CD2 3.49Å; L438-L452 HydrophobicContact CD2-CD1 4.37Å; L441-L452 HydrophobicContact CD1-CD1 3.79Å; V448-L452 HydrophobicContact CG1-CD1 4.02Å; V448-L452 HydrophobicContact CG1-CG 4.23Å; V448-L452 WeakPolarHBondContact O-CB 3.42Å; V448-L452 VanDerWaalsContact O-CG 3.31Å; V448-L452 WeakPolarHBondContact O-CG 3.5Å; V448-L452 PolarHBondContact O-N 3.39Å; V449-L452 PolarHBondContact O-N 2.7Å; L452-R455 PolarHBondContact O-N 2.94Å; L452-K456 WeakPolarHBondContact O-CG 3.11Å; L452-K456 PolarHBondContact O-N 3.5Å
453	L	88.8	Confident	78.7	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-65.4	-44.3	175.5	-71.7	171.8	0	0	0	111.9	W19 V27 L438 V449 R455 K456 A457	W19-L453 HydrophobicContact CB-CD1 4.06Å; W19-L453 HydrophobicContact CB-CD2 3.62Å; W19-L453 HydrophobicContact CD2-CD1 4.49Å; W19-L453 HydrophobicContact CE3-CD1 3.97Å; W19-L453 HydrophobicContact CG-CD2 4.11Å; V27-L453 HydrophobicContact CB-CD2 4.26Å; V27-L453 HydrophobicContact CG2-CD2 4.5Å; L438-L453 HydrophobicContact CD1-CD2 4.11Å; V449-L453 HydrophobicContact CG1-CD1 3.76Å; V449-L453 HydrophobicContact CG1-CG 4.27Å; V449-L453 WeakPolarHBondContact O-CB 3.28Å; V449-L453 VanDerWaalsContact O-CG 3.31Å; V449-L453 WeakPolarHBondContact O-CG 3.45Å; V449-L453 PolarHBondContact O-N 3.05Å; L453-R455 VanDerWaalsContact C-N 3.3Å; L453-R455 PolarHBondContact O-N 2.7Å; L453-K456 PolarHBondContact O-N 3.12Å; L453-A457 WeakPolarHBondContact O-CB 3.36Å; L453-A457 PolarHBondContact O-N 2.81Å
454	R	87.4	Confident	76.3	Confident	105 Å²	105	70.3 Å²	70.3	40%	0.396	38%	0.381	S	S	.	.	H	α-helix	trans	-59.6	-40	173	-77.2	175.8	-67.2	-145.8	4.3	112.2	D450 Y451 A457 S458	D450-R454 VanDerWaalsContact CG-CZ 3.48Å; D450-R454 WeakPolarHBondContact O-CB 3.22Å; D450-R454 VanDerWaalsContact O-CG 3.3Å; D450-R454 WeakPolarHBondContact O-CG 3.38Å; D450-R454 PolarHBondContact O-N 2.75Å; D450-R454 PolarHBondContact O-NE 3.31Å; D450-R454 IonicContact OD2-CZ 3.86Å; D450-R454 IonicContact OD2-NE 3.74Å; D450-R454 IonicContact OD2-NH1 3.08Å; D450-R454 PolarHBondContact OD2-NH1 3.04Å; D450-R454 IonicContact OD2-NH2 3.71Å; D450-R454 PolarHBondContact OD2-NH2 3.13Å; D450-R454 VanDerWaalsContact OD2-NH2 3.17Å; Y451-R454 PolarHBondContact O-N 2.86Å; R454-A457 PolarHBondContact O-N 2.88Å; R454-S458 PolarHBondContact O-N 3.19Å
455	R	87.1	Confident	73.7	Confident	26 Å²	26	75 Å²	75	10%	0.098	40%	0.398	C	S	.	.	H	α-helix	trans	-63.6	-50.1	176.1	-166.2	-172.3	73.8	-150.9	-5.3	111.1	E41 L228 Y451 L452 L453 A457 S458 Q459	E41-R455 IonicContact OE1-NH2 3.81Å; E41-R455 PolarHBondContact OE1-NH2 2.85Å; E41-R455 IonicContact OE2-CZ 3.35Å; E41-R455 IonicContact OE2-NH1 3.03Å; E41-R455 IonicContact OE2-NH2 2.73Å; E41-R455 PolarHBondContact OE2-NH2 3.43Å; L228-R455 PolarHBondContact O-NH1 3.37Å; Y451-R455 WeakPolarHBondContact O-CB 3.41Å; Y451-R455 PolarHBondContact O-N 2.79Å; L452-R455 PolarHBondContact O-N 2.94Å; L453-R455 VanDerWaalsContact C-N 3.3Å; L453-R455 PolarHBondContact O-N 2.7Å; R455-A457 VanDerWaalsContact C-N 3.34Å; R455-A457 PolarHBondContact O-N 2.94Å; R455-S458 PolarHBondContact O-N 3.3Å; R455-S458 PolarHBondContact O-OG 3.12Å; R455-Q459 WeakPolarHBondContact O-CG 3.42Å; R455-Q459 PolarHBondContact O-N 3Å; R455-Q459 VanDerWaalsContact O-N 3.17Å
456	K	86.6	Confident	71.4	Confident	24 Å²	24	77.2 Å²	77.2	10%	0.104	42%	0.417	C	S	.	.	H	α-helix	trans	-58.3	-45.1	176.3	-68.6	174.2	-160.8	-82.2	0	110.8	V27 L29 E41 L452 L453 S458 Q459 S460	V27-K456 HydrophobicContact CG1-CB 4.03Å; L29-K456 HydrophobicContact CD2-CD 4.27Å; E41-K456 WeakPolarHBondContact OE1-CE 3.3Å; E41-K456 IonicContact OE1-NZ 3.52Å; E41-K456 PolarHBondContact OE1-NZ 3.29Å; L452-K456 WeakPolarHBondContact O-CG 3.11Å; L452-K456 PolarHBondContact O-N 3.5Å; L453-K456 PolarHBondContact O-N 3.12Å; K456-S458 PolarHBondContact O-N 3.1Å; K456-Q459 PolarHBondContact O-N 3.12Å; K456-S460 PolarHBondContact O-N 2.87Å; K456-S460 PolarHBondContact O-OG 3.38Å
457	A	83.5	Confident	68.7	Low	18 Å²	18	82.1 Å²	82.1	15%	0.149	44%	0.435	C	S	.	.	H	α-helix	trans	-59.9	-28	174.8	0	0	0	0	0	114.4	V27 L453 R454 R455	V27-A457 HydrophobicContact CG2-CB 3.69Å; L453-A457 WeakPolarHBondContact O-CB 3.36Å; L453-A457 PolarHBondContact O-N 2.81Å; R454-A457 PolarHBondContact O-N 2.88Å; R455-A457 VanDerWaalsContact C-N 3.34Å; R455-A457 PolarHBondContact O-N 2.94Å
458	S	81.1	Confident	66.1	Low	83 Å²	83	84.3 Å²	84.3	58%	0.58	44%	0.441	S	S	*	.	H	α-helix	trans	-83.8	-15.3	174.9	69.8	0	0	0	0	113.8	R454 R455 K456	R454-S458 PolarHBondContact O-N 3.19Å; R455-S458 PolarHBondContact O-N 3.3Å; R455-S458 PolarHBondContact O-OG 3.12Å; K456-S458 PolarHBondContact O-N 3.1Å
459	Q	72.2	Confident	63.9	Low	118 Å²	118	88.4 Å²	88.4	55%	0.551	47%	0.468	S	S	*	.	H	α-helix	trans	-95.9	-10.9	178.3	-69.1	173.2	-34.2	0	0	112.8	R455 K456 P461	R455-Q459 WeakPolarHBondContact O-CG 3.42Å; R455-Q459 PolarHBondContact O-N 3Å; R455-Q459 VanDerWaalsContact O-N 3.17Å; K456-Q459 PolarHBondContact O-N 3.12Å; Q459-P461 VanDerWaalsContact C-CD 3.45Å; Q459-P461 WeakPolarHBondContact O-CD 3.22Å
460	S	58.5	Low	61.1	Low	67 Å²	67	98.1 Å²	98.1	47%	0.469	51%	0.511	S	S	.	.			trans	-108.2	80.4	174.5	59.8	0	0	0	0	111.4	K456 D462	K456-S460 PolarHBondContact O-N 2.87Å; K456-S460 PolarHBondContact O-OG 3.38Å; S460-D462 VanDerWaalsContact C-N 3.31Å; S460-D462 PolarHBondContact O-N 2.79Å
461	P	49	Very low	58.3	Low	124 Å²	124	102.8 Å²	102.8	81%	0.805	55%	0.55	S	S	*	.			trans	-80.7	74.4	178.6	35.1	-36.5	0	0	0	110.6	Q459	Q459-P461 VanDerWaalsContact C-CD 3.45Å; Q459-P461 WeakPolarHBondContact O-CD 3.22Å
462	D	40.6	Very low	55.5	Low	141 Å²	141	106.8 Å²	106.8	75%	0.754	58%	0.576	S	S	*	*			trans	-143.8	150	172	-149.1	12.6	0	0	0	116	S460 L464	S460-D462 VanDerWaalsContact C-N 3.31Å; S460-D462 PolarHBondContact O-N 2.79Å; D462-L464 PolarHBondContact O-N 2.56Å
463	L	41.8	Very low	52.6	Low	151 Å²	151	112.4 Å²	112.4	79%	0.791	62%	0.615	S	S	*	*			trans	-29.5	101.6	-175.1	-65.2	155.4	0	0	0	118.3
464	L	36.4	Very low	49.7	Very low	169 Å²	169	119 Å²	119	89%	0.885	65%	0.646	S	S	*	*				-150.2	103.4	130	-82	-168.6	0	0	0	110.6	D462	D462-L464 PolarHBondContact O-N 2.56Å
465	Q	33.1	Very low	46.9	Very low	169 Å²	169	123.8 Å²	123.8	79%	0.79	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-77.6	144.7	151.3	-78	-169.3	-19.5	0	0	108.7	E467	Q465-E467 PolarHBondContact O-N 3.07Å
466	P	36.6	Very low	44.2	Very low	124 Å²	124	134.2 Å²	134.2	81%	0.805	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-68.1	116.3	161.3	-14.6	30	0	0	0	109.5	E468	P466-E468 PolarHBondContact O-N 2.97Å
467	E	31.2	Very low	41.3	Very low	163 Å²	163	138.2 Å²	138.2	76%	0.762	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-71.3	116.5	170.9	-82.1	-79.3	134.5	0	0	110.3	Q465	Q465-E467 PolarHBondContact O-N 3.07Å
468	E	33.2	Very low	38.6	Very low	173 Å²	173	143 Å²	143	81%	0.808	77%	0.767	S	S	*	*			trans	-141.1	102	170.5	-98.2	-74.1	137.4	0	0	108.6	P466 F470	P466-E468 PolarHBondContact O-N 2.97Å; E468-F470 PolarHBondContact O-N 3.05Å
469	P	41	Very low	36.2	Very low	108 Å²	108	144.3 Å²	144.3	70%	0.701	78%	0.776	S	S	*	*			trans	-75.2	122.2	-173.7	-21.8	35.2	0	0	0	115.1
470	F	30.2	Very low	34	Very low	205 Å²	205	146.1 Å²	146.1	90%	0.899	79%	0.789	S	S	*	*			trans	-23.5	143.8	173.7	-62.3	-93.9	0	0	0	120.4	E468	E468-F470 PolarHBondContact O-N 3.05Å
471	A	28	Very low	32.9	Very low	103 Å²	103	148 Å²	148	85%	0.851	80%	0.802	S	S	*	*			trans	-134.1	153.3	145.3	0	0	0	0	0	111.2
472	L	30.4	Very low	32.1	Very low	171 Å²	171	149.7 Å²	149.7	90%	0.895	81%	0.805	S	S	*	*			trans	-102.2	134.8	-164.3	-71.5	161.6	0	0	0	114.7
473	S	29	Very low	31.7	Very low	118 Å²	118	152.6 Å²	152.6	83%	0.825	81%	0.811	S	S	*	*			trans	-173.1	161	140.4	60.4	0	0	0	0	110.4
474	E	27.1	Very low	31.1	Very low	139 Å²	139	152 Å²	152	65%	0.65	81%	0.813	S	S	*	*			cis	-159.1	138.4	-47.3	-161.5	-164.4	150.2	0	0	107.5
475	R	29.2	Very low	30.7	Very low	205 Å²	205	148.9 Å²	148.9	77%	0.774	81%	0.805	S	S	*	*			trans	39	115.7	161.3	-81.9	-171.1	-96.5	-139.4	-5.7	119.7
476	R	29.1	Very low	30.5	Very low	246 Å²	246	146.2 Å²	146.2	93%	0.928	81%	0.805	S	S	*	*				-166.1	165.1	94.5	-100.9	163	-157.4	-88.1	-1.3	112.6
477	S	25.7	Very low	30.1	Very low	107 Å²	107	144 Å²	144	75%	0.748	81%	0.805	S	S	*	*			trans	-122.1	148.8	-173.2	171.4	0	0	0	0	111.1
478	S	27.9	Very low	30	Very low	120 Å²	120	145.8 Å²	145.8	84%	0.839	81%	0.813	S	S	*	*			trans	-158.2	127.6	146.1	53.7	0	0	0	0	109.8
479	S	30.2	Very low	29.9	Very low	109 Å²	109	144.2 Å²	144.2	76%	0.762	82%	0.815	S	S	*	*			trans	-104.1	126.5	176.5	-55	0	0	0	0	110.6
480	D	25.9	Very low	29.4	Very low	156 Å²	156	144.3 Å²	144.3	83%	0.834	82%	0.819	S	S	*	*			trans	-174.3	148.1	157.3	-105.1	-35.2	0	0	0	108.6
481	S	35.8	Very low	29.7	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	81%	0.807	S	S	*	*			cis	-155	159.2	-13.8	-138.2	0	0	0	0	109.9
482	N	31.3	Very low	29.8	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	81%	0.807	S	S	*	*			trans	-81.2	131.9	-178.6	-88.5	-40.3	0	0	0	113
483	K	32.1	Very low	29.7	Very low	203 Å²	203	143.6 Å²	143.6	88%	0.883	80%	0.802	S	S	*	*			trans	-168.7	120.2	136.9	-110.9	163.8	-173.8	179.2	0	116.1
484	V	29.6	Very low	29.8	Very low	138 Å²	138	145 Å²	145	84%	0.836	80%	0.8	S	S	*	*			trans	-4.4	123.8	143.9	-178.9	0	0	0	0	117.3
485	S	28.3	Very low	30	Very low	103 Å²	103	144.5 Å²	144.5	72%	0.72	80%	0.802	S	S	*	*				-171.2	132.7	112.9	-136.1	0	0	0	0	113.2
486	S	29.1	Very low	30.2	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	79%	0.793	S	S	*	*			trans	33.8	122.5	136.1	-48.4	0	0	0	0	120
487	G	28.2	Very low	30.5	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	79%	0.788	S	S	*	*			trans	-95.8	-170.7	-178.5	0	0	0	0	0	115.1
488	E	28.4	Very low	30.6	Very low	201 Å²	201	134 Å²	134	94%	0.939	79%	0.789	S	S	*	*			trans	-130	158	149.7	-72.9	-142.9	129.5	0	0	109.2
489	V	31.5	Very low	30.6	Very low	141 Å²	141	136.4 Å²	136.4	86%	0.855	79%	0.791	S	S	*	*			trans	-119.9	128.8	-175.6	172.4	0	0	0	0	109.3
490	S	30.6	Very low	30.6	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	79%	0.79	S	S	*	*			trans	-60.7	125.9	177.4	-171.7	0	0	0	0	111	Y492	S490-Y492 PolarHBondContact O-N 3.22Å
491	P	36.1	Very low	30.6	Very low	102 Å²	102	137.9 Å²	137.9	66%	0.662	79%	0.793	S	S	*	*			trans	-73.1	125	167.1	30.2	-31.9	0	0	0	109.3
492	Y	29.8	Very low	30.2	Very low	213 Å²	213	144.7 Å²	144.7	84%	0.835	80%	0.802	S	S	*	*			trans	169.4	141.6	135.8	-95	-64.9	0	0	0	110.8	S490	S490-Y492 PolarHBondContact O-N 3.22Å
493	D	28.8	Very low	29.9	Very low	148 Å²	148	148.4 Å²	148.4	79%	0.791	80%	0.804	S	S	*	*			trans	37.1	89.4	164.1	-66.2	-12.8	0	0	0	119.1
494	N	30.3	Very low	29.6	Very low	147 Å²	147	142 Å²	142	79%	0.786	80%	0.796	S	S	*	*			trans	-136.6	85.4	156.4	-160.3	-3.6	0	0	0	111.5
495	N	31.8	Very low	29.5	Very low	130 Å²	130	143 Å²	143	70%	0.695	80%	0.797	S	S	*	*			trans	-113.4	77.4	176.8	-92.6	-54.5	0	0	0	110.7	Y232	Y232-N495 PolarHBondContact OH-O 3.46Å
496	S	33.6	Very low	29.9	Very low	83 Å²	83	143.5 Å²	143.5	58%	0.58	80%	0.798	S	S	*	*			trans	-133.9	131.7	164.5	-75.7	0	0	0	0	109.2
497	P	36	Very low	29.7	Very low	129 Å²	129	141.8 Å²	141.8	84%	0.838	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78.7	128.7	-174.2	30.6	-33.8	0	0	0	111.9
498	V	28.3	Very low	29.8	Very low	125 Å²	125	143.8 Å²	143.8	76%	0.758	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.2	123.2	166.4	176.5	0	0	0	0	109	S500	V498-S500 PolarHBondContact O-N 2.95Å
499	L	27.2	Very low	30	Very low	170 Å²	170	140.3 Å²	140.3	89%	0.89	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-66.1	118.8	171.2	-67.4	174.2	0	0	0	109.7
500	S	28.9	Very low	29.8	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	80%	0.797	S	S	*	*			trans	-110.2	89.4	177.5	-63	0	0	0	0	110.7	V498 R502	V498-S500 PolarHBondContact O-N 2.95Å; S500-R502 PolarHBondContact O-N 3.17Å
501	E	27.4	Very low	29.6	Very low	192 Å²	192	137.1 Å²	137.1	90%	0.897	80%	0.796	S	S	*	*			trans	-67	116.8	164.9	-72.7	-161.1	108	0	0	109.5
502	R	26.3	Very low	29.1	Very low	249 Å²	249	139.3 Å²	139.3	94%	0.94	80%	0.803	S	S	*	*			trans	-111.2	73.2	-178.9	-159	-176	-158	-153.6	6.8	111.5	S500	S500-R502 PolarHBondContact O-N 3.17Å
503	R	26.3	Very low	29	Very low	237 Å²	237	137 Å²	137	89%	0.894	80%	0.799	S	S	*	*			trans	-88.4	110.4	165.8	-167.9	177.3	-67.1	-104.1	2.7	108.5
504	G	25.6	Very low	28.8	Very low	69 Å²	69	138.1 Å²	138.1	71%	0.711	80%	0.8	S	S	*	*			trans	-86.1	153.1	177.2	0	0	0	0	0	112.3
505	D	26.3	Very low	28.4	Very low	160 Å²	160	140.9 Å²	140.9	86%	0.856	81%	0.805	S	S	*	*			trans	-128.5	128.4	176.1	-165.6	35.6	0	0	0	109
506	P	37.4	Very low	28.7	Very low	113 Å²	113	139.9 Å²	139.9	73%	0.734	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-89.9	139.4	-175.3	33.9	-33	0	0	0	112.8
507	G	25.3	Very low	28.3	Very low	77 Å²	77	142.2 Å²	142.2	79%	0.794	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-68.9	153.1	179.9	0	0	0	0	0	114.9
508	S	29.1	Very low	27.8	Very low	119 Å²	119	141.2 Å²	141.2	83%	0.832	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.3	162.2	178	-36	0	0	0	0	113.8
509	P	34.3	Very low	27.7	Very low	127 Å²	127	142.5 Å²	142.5	83%	0.825	81%	0.806	S	S	*	*			trans	-118.8	160	135.2	36.1	-30.6	0	0	0	111.8
510	A	25.6	Very low	27.6	Very low	110 Å²	110	142.1 Å²	142.1	91%	0.909	80%	0.799	S	S	*	*			trans	-97.4	157.4	177.9	0	0	0	0	0	112.5
511	G	26.7	Very low	27.4	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	80%	0.804	S	S	*	*			trans	170.8	124.7	170.8	0	0	0	0	0	112.6
512	D	26.1	Very low	27.3	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	80%	0.795	S	S	*	*			trans	-75.4	142.5	-175.9	-55.2	-80.5	0	0	0	114
513	Q	28.6	Very low	27.1	Very low	164 Å²	164	133 Å²	133	77%	0.766	78%	0.784	S	S	*	*				178.9	129.1	110.8	-96.1	155.7	83.9	0	0	115.9
514	Q	24.5	Very low	27	Very low	172 Å²	172	132.2 Å²	132.2	80%	0.804	78%	0.781	S	S	*	*			trans	72.3	135.1	143	-61.3	175.1	14.7	0	0	121.4
515	F	21.8	Very low	26.8	Very low	206 Å²	206	133.4 Å²	133.4	90%	0.904	78%	0.778	S	S	*	*			trans	-92.1	-178.5	177.1	-74.3	-83.6	0	0	0	111
516	P	37.9	Very low	26.7	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	78%	0.782	S	S	*	*			cis	-145.3	-170.2	13.7	46	-26.7	0	0	0	117.9
517	V	24.2	Very low	25.9	Very low	132 Å²	132	140.5 Å²	140.5	80%	0.8	79%	0.786	S	S	*	*			trans	74.6	129.7	151.5	157.3	0	0	0	0	116.9
518	V	25.1	Very low	26.6	Very low	109 Å²	109	141.6 Å²	141.6	66%	0.661	78%	0.779	S	S	*	*			cis	-161.6	151.7	-3.8	103.2	0	0	0	0	112.3
519	E	26.3	Very low	26.3	Very low	152 Å²	152	141.9 Å²	141.9	71%	0.71	78%	0.781	S	S	*	*			trans	52	151.6	160.3	-67.4	-177.3	104.7	0	0	121.3
520	Q	26.8	Very low	26	Very low	161 Å²	161	145.6 Å²	145.6	75%	0.752	78%	0.784	S	S	*	*			cis	-141.6	152.8	3.6	-138.5	166.9	45	0	0	112
521	V	23.6	Very low	25.9	Very low	138 Å²	138	149.9 Å²	149.9	84%	0.836	79%	0.785	S	S	*	*			trans	-105.8	145.1	175.9	178	0	0	0	0	106.4
522	A	26.1	Very low	25.9	Very low	86 Å²	86	153.8 Å²	153.8	71%	0.711	79%	0.788	S	S	*	*				-163.4	159.7	61.5	0	0	0	0	0	110.4
523	D	22	Very low	26.1	Very low	132 Å²	132	153.1 Å²	153.1	71%	0.706	78%	0.783	S	S	*	*				70.9	128.2	60.5	-146.3	72.9	0	0	0	113.4
524	W	23.3	Very low	25.8	Very low	219 Å²	219	152.1 Å²	152.1	83%	0.83	78%	0.783	S	S	*	*			cis	-165.5	175	-22.6	-120.9	35.7	0	0	0	108.1
525	S	22.2	Very low	25.8	Very low	94 Å²	94	150.1 Å²	150.1	66%	0.657	79%	0.788	S	S	*	*			trans	47.8	125.5	154.9	-55.9	0	0	0	0	122.4
526	R	23	Very low	26.1	Very low	250 Å²	250	148.3 Å²	148.3	94%	0.943	79%	0.786	S	S	*	*				-167.8	153.6	106.1	-117.9	178.2	174.2	149.8	0.6	116.4
527	E	22.1	Very low	25.6	Very low	173 Å²	173	148.8 Å²	148.8	81%	0.808	79%	0.793	S	S	*	*			trans	-74	172.3	170.7	-92.7	-71.7	97.9	0	0	112.9
528	P	40.2	Very low	25.6	Very low	100 Å²	100	150.4 Å²	150.4	65%	0.649	80%	0.796	S	S	*	*			trans	-99.1	-172.4	-142.5	39.7	-42	0	0	0	115.7
529	S	21.7	Very low	25.7	Very low	124 Å²	124	153.5 Å²	153.5	87%	0.867	81%	0.808	S	S	*	*			trans	-143.1	155.7	163.2	-75.3	0	0	0	0	111.7
530	K	27.5	Very low	25.7	Very low	205 Å²	205	151.2 Å²	151.2	89%	0.891	81%	0.808	S	S	*	*			trans	-103.1	142.5	-173.1	-56.2	169.3	-176.8	174.5	0	109.8
531	E	23.4	Very low	25.9	Very low	201 Å²	201	149.1 Å²	149.1	94%	0.939	81%	0.809	S	S	*	*			trans	-140.3	162.1	154.8	-118.3	173.6	-152.6	0	0	109.9
532	L	27.6	Very low	25.9	Very low	155 Å²	155	148.8 Å²	148.8	81%	0.812	81%	0.807	S	S	*	*			trans	-151.8	154.7	-156	-134.8	166.8	0	0	0	110.4
533	I	29.2	Very low	25.9	Very low	134 Å²	134	151 Å²	151	69%	0.687	81%	0.811	S	S	*	*			trans	92.8	124.7	162.7	-55.7	179.2	0	0	0	117.8
534	N	23.1	Very low	26	Very low	144 Å²	144	153.3 Å²	153.3	77%	0.77	82%	0.818	S	S	*	*			trans	62.9	114.9	156.7	-67.1	-12.4	0	0	0	122.3
535	S	24.5	Very low	26.1	Very low	129 Å²	129	153.6 Å²	153.6	90%	0.902	82%	0.819	S	S	*	*				-156	98.5	125.7	-82.5	0	0	0	0	111.2
536	L	28	Very low	26.3	Very low	168 Å²	168	157.9 Å²	157.9	88%	0.88	83%	0.829	S	S	*	*			trans	-103.2	116.9	166.9	-90.8	171.2	0	0	0	109.3
537	S	27.2	Very low	26.4	Very low	119 Å²	119	154.5 Å²	154.5	83%	0.832	82%	0.823	S	S	*	*			trans	-166.4	112.2	154.7	-85.8	0	0	0	0	113.3
538	L	25.4	Very low	26.8	Very low	165 Å²	165	154.3 Å²	154.3	86%	0.864	82%	0.822	S	S	*	*			trans	-3	131.3	147.9	-58.1	164.8	0	0	0	118.4
539	L	27.3	Very low	26.2	Very low	175 Å²	175	153.9 Å²	153.9	92%	0.916	83%	0.827	S	S	*	*				-162.3	155.9	123.4	-107.1	168.8	0	0	0	111.2
540	S	26	Very low	26.7	Very low	103 Å²	103	155 Å²	155	72%	0.72	82%	0.824	S	S	*	*			trans	-100.3	-174.5	-163.1	-42.7	0	0	0	0	113
541	P	30.2	Very low	27	Very low	117 Å²	117	152.7 Å²	152.7	76%	0.76	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-82.8	146.5	-134.3	34.3	-40.2	0	0	0	115.9
542	V	23.7	Very low	27.5	Very low	132 Å²	132	152.5 Å²	152.5	80%	0.8	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-92.1	117.4	158.8	175.5	0	0	0	0	108.9	Q544	V542-Q544 PolarHBondContact O-N 3.22Å
543	T	25.4	Very low	27.6	Very low	131 Å²	131	148.9 Å²	148.9	80%	0.804	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.7	120.3	170	53.3	0	0	0	0	110.4
544	Q	25.7	Very low	27.7	Very low	182 Å²	182	147.4 Å²	147.4	85%	0.85	81%	0.807	S	S	*	*			trans	-113.2	147.3	154.3	-74.2	-167.1	-16.8	0	0	110.1	V542	V542-Q544 PolarHBondContact O-N 3.22Å
545	R	25	Very low	28.2	Very low	225 Å²	225	150 Å²	150	85%	0.849	81%	0.807	S	S	*	*			trans	-125.4	106.6	-168.9	173.5	-161.8	-63	168.6	0	106.6
546	E	26.9	Very low	28.6	Very low	183 Å²	183	152.9 Å²	152.9	86%	0.855	81%	0.805	S	S	*	*			trans	-111.6	153.6	167.1	-69.6	-164.7	128.1	0	0	110.4
547	E	25.1	Very low	28.6	Very low	179 Å²	179	151 Å²	151	84%	0.836	80%	0.801	S	S	*	*			trans	-100.9	120.8	-154.1	-59.3	-174.4	135.6	0	0	111.5	A549	E547-A549 PolarHBondContact O-N 2.8Å
548	H	29.1	Very low	28.7	Very low	170 Å²	170	151.7 Å²	151.7	79%	0.787	80%	0.8	S	S	*	*			trans	-67	96.9	174.7	-77.6	-85	0	0	0	111	N550	H548-N550 PolarHBondContact O-N 3.44Å
549	A	27.4	Very low	28.9	Very low	90 Å²	90	151.8 Å²	151.8	74%	0.744	80%	0.801	S	S	*	*			trans	-66	79.5	168.1	0	0	0	0	0	110.9	E547 I551	E547-A549 PolarHBondContact O-N 2.8Å; A549-I551 PolarHBondContact O-N 2.86Å
550	N	32.2	Very low	29	Very low	149 Å²	149	153 Å²	153	80%	0.797	80%	0.799	S	S	*	*			trans	-68.4	94.7	-177.4	-87.7	-39.4	0	0	0	112.4	H548	H548-N550 PolarHBondContact O-N 3.44Å
551	I	34.3	Very low	29.1	Very low	155 Å²	155	154.1 Å²	154.1	80%	0.795	80%	0.803	S	S	*	*			trans	-119.2	57.3	174.8	-44.5	-177.6	0	0	0	111.3	A549	A549-I551 PolarHBondContact O-N 2.86Å
552	W	33.6	Very low	28.9	Very low	197 Å²	197	153.4 Å²	153.4	75%	0.746	81%	0.808	S	S	*	*			trans	-151.3	48.1	161.8	-162.2	-109.7	0	0	0	114.2	T554 W555	W552-T554 PolarHBondContact O-N 3.41Å; W552-W555 AromaticContact CE2-CD1 3.92Å; W552-W555 AromaticContact CZ2-CD1 3.77Å; W552-W555 AromaticContact CZ2-NE1 3.69Å; W552-W555 AromaticContact NE1-CD1 3.72Å
553	G	30.2	Very low	29.1	Very low	79 Å²	79	155.6 Å²	155.6	81%	0.814	81%	0.814	S	S	*	*			trans	-89.8	72.9	176.6	0	0	0	0	0	113.6
554	T	32.1	Very low	29.2	Very low	103 Å²	103	158.7 Å²	158.7	63%	0.632	82%	0.816	S	S	*	*			trans	-152.3	20.1	179.3	-22.4	0	0	0	0	117.4	W552	W552-T554 PolarHBondContact O-N 3.41Å
555	W	33	Very low	29.2	Very low	200 Å²	200	156.7 Å²	156.7	76%	0.758	81%	0.811	S	S	*	*	S	Bend	trans	-126.8	12.9	178.8	-80.3	92.2	0	0	0	116	W552	W552-W555 AromaticContact CE2-CD1 3.92Å; W552-W555 AromaticContact CZ2-CD1 3.77Å; W552-W555 AromaticContact CZ2-NE1 3.69Å; W552-W555 AromaticContact NE1-CD1 3.72Å
556	H	32.3	Very low	29.2	Very low	189 Å²	189	154.5 Å²	154.5	88%	0.875	81%	0.811	S	S	*	*			trans	-126.6	63.1	179.1	-69.7	-70.3	0	0	0	113
557	T	29.1	Very low	29	Very low	129 Å²	129	149.8 Å²	149.8	79%	0.791	80%	0.798	S	S	*	*			trans	-137.7	37.1	-177.7	-24.2	0	0	0	0	115.2
558	T	29	Very low	29	Very low	133 Å²	133	149.6 Å²	149.6	82%	0.816	80%	0.797	S	S	*	*	S	Bend	trans	-143.1	151.1	162.9	-26	0	0	0	0	110.5
559	L	28.6	Very low	28.8	Very low	166 Å²	166	148 Å²	148	87%	0.869	80%	0.799	S	S	*	*			trans	73.4	72.1	175.3	-51	179.6	0	0	0	117.6
560	K	29.1	Very low	28.7	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	80%	0.804	S	S	*	*				-143.8	136.6	126.3	-110.2	176.9	-176.2	177.3	0	109.7
561	P	29.7	Very low	28.3	Very low	126 Å²	126	147.8 Å²	147.8	82%	0.818	81%	0.805	S	S	*	*			trans	-76.6	155.5	-179.3	32	-35	0	0	0	111.5
562	A	25.5	Very low	27.7	Very low	103 Å²	103	149.8 Å²	149.8	85%	0.851	80%	0.803	S	S	*	*			trans	-78.3	137.5	-179.8	0	0	0	0	0	112.5
563	L	27.6	Very low	27.3	Very low	177 Å²	177	147.6 Å²	147.6	93%	0.927	80%	0.799	S	S	*	*			trans	-138.4	159.3	153.6	-112.1	164.1	0	0	0	108.8
564	K	27.9	Very low	27	Very low	196 Å²	196	150.9 Å²	150.9	85%	0.852	79%	0.793	S	S	*	*			trans	-107.2	153.2	-145.5	-156.7	173.8	-177.5	-179.6	0	112.6
565	N	26	Very low	26.7	Very low	141 Å²	141	152.6 Å²	152.6	75%	0.754	80%	0.797	S	S	*	*			trans	-47.5	155.6	165.2	-57.7	-19.8	0	0	0	110.6
566	Q	25.2	Very low	26.3	Very low	178 Å²	178	153.5 Å²	153.5	83%	0.832	80%	0.8	S	S	*	*			cis	-164.1	-179.7	47.6	-147.9	154	24.1	0	0	113.3
567	S	23.1	Very low	25.9	Very low	85 Å²	85	150.1 Å²	150.1	59%	0.594	79%	0.788	S	S	*	*			trans	-66.2	166.9	-178.2	53.7	0	0	0	0	115.5
568	H	24.3	Very low	25.7	Very low	174 Å²	174	149.5 Å²	149.5	81%	0.806	78%	0.78	S	S	*	*				-170.1	166	112.1	-98.5	90	0	0	0	114.2
569	T	24.4	Very low	25.6	Very low	136 Å²	136	151.9 Å²	151.9	83%	0.834	78%	0.776	S	S	*	*			trans	-73.6	153.8	-173.5	50.1	0	0	0	0	115.9
570	G	24.6	Very low	25.6	Very low	83 Å²	83	151.6 Å²	151.6	86%	0.856	77%	0.767	S	S	*	*			trans	-173.8	114.5	167.9	0	0	0	0	0	118
571	N	24.4	Very low	25.5	Very low	152 Å²	152	148.5 Å²	148.5	81%	0.813	76%	0.759	S	S	*	*			trans	-55.9	137.2	179.9	-95.9	-32.1	0	0	0	119.6
572	R	23.1	Very low	25.4	Very low	197 Å²	197	147.5 Å²	147.5	74%	0.743	75%	0.751	S	S	*	*				71.5	145.5	110.9	-151.3	-173.8	177.2	-175.4	-1.4	122.5
573	F	23.6	Very low	25.4	Very low	152 Å²	152	149.5 Å²	149.5	67%	0.667	75%	0.747	S	S	*	*			trans	72.9	155.6	171.6	-73.3	-91.5	0	0	0	118.4
574	Q	24.8	Very low	25.2	Very low	148 Å²	148	146 Å²	146	69%	0.692	74%	0.736	S	S	*	*			cis	178.6	143.1	-35.6	-176.3	134.4	-13.7	0	0	110.6
575	I	25.4	Very low	25	Very low	138 Å²	138	145.6 Å²	145.6	71%	0.708	74%	0.735	S	S	*	*			trans	59	163.4	175.4	3.4	176.7	0	0	0	114.2
576	R	24.2	Very low	24.9	Very low	220 Å²	220	144 Å²	144	83%	0.83	73%	0.734	S	S	*	*			cis	-150.4	133.9	9.9	-164.7	159.5	178.2	158.5	-2	115.2
577	N	25.1	Very low	24.9	Very low	117 Å²	117	141.6 Å²	141.6	63%	0.626	74%	0.736	S	S	*	*			trans	10	134.3	142.7	-78.1	61.3	0	0	0	122.4
578	D	24.9	Very low	24.9	Very low	117 Å²	117	141.2 Å²	141.2	63%	0.626	75%	0.746	S	S	*	*				94.1	108.3	121.2	-64.9	-5.1	0	0	0	123.6
579	Y	26.7	Very low	24.9	Very low	183 Å²	183	138.2 Å²	138.2	72%	0.718	74%	0.744	S	S	*	*				79.8	135.7	123.2	-84.1	-70.5	0	0	0	124.7
580	F	28	Very low	25	Very low	159 Å²	159	140.5 Å²	140.5	70%	0.697	75%	0.745	S	S	*	*			trans	81.6	98.5	141.5	-74.1	-46.7	0	0	0	123.7
581	I	26.8	Very low	25	Very low	137 Å²	137	140.2 Å²	140.2	70%	0.703	74%	0.742	S	S	*	*				97.7	149.5	104.6	-130.4	173.8	0	0	0	121.8
582	T	27.4	Very low	25.3	Very low	105 Å²	105	139.9 Å²	139.9	64%	0.644	74%	0.74	S	S	*	*			trans	70.9	104.5	163.7	42.4	0	0	0	0	122.6
583	N	25.6	Very low	25.5	Very low	144 Å²	144	138.3 Å²	138.3	77%	0.77	74%	0.743	S	S	*	*				67.7	125.9	114.9	-71.4	-3.9	0	0	0	124.3
584	C	23.7	Very low	25.7	Very low	103 Å²	103	135 Å²	135	70%	0.696	74%	0.739	S	S	*	*				81.9	105.9	128.9	-73.9	0	0	0	0	122.5
585	K	24	Very low	25.8	Very low	189 Å²	189	136 Å²	136	82%	0.822	74%	0.744	S	S	*	*				72.2	132.8	118.1	-79.7	-173.7	174.4	-178.7	0	122.1
586	C	23.1	Very low	25.8	Very low	108 Å²	108	136.6 Å²	136.6	73%	0.73	74%	0.743	S	S	*	*			trans	82.3	102.7	141.8	-67.1	0	0	0	0	121.1
587	S	25.7	Very low	26	Very low	127 Å²	127	129.9 Å²	129.9	89%	0.888	73%	0.73	S	S	*	*				61.3	114.1	120.7	-53.8	0	0	0	0	121.8
588	G	23	Very low	26.3	Very low	77 Å²	77	129 Å²	129	79%	0.794	73%	0.733	S	S	*	*			trans	146.6	151.6	156.7	0	0	0	0	0	110.7
589	S	23.6	Very low	26.5	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	74%	0.743	S	S	*	*			cis	-179.3	159.1	-18.3	-173.4	0	0	0	0	105.3
590	H	27.4	Very low	26.6	Very low	184 Å²	184	130.5 Å²	130.5	85%	0.852	75%	0.745	S	S	*	*			trans	-19.4	139.4	178	-67.2	-93.4	0	0	0	120.8
591	G	25.5	Very low	26.8	Very low	76 Å²	76	127.3 Å²	127.3	78%	0.784	74%	0.742	S	S	*	*			trans	-137.9	152.4	155.4	0	0	0	0	0	109.6
592	N	29.2	Very low	27.1	Very low	145 Å²	145	128.4 Å²	128.4	78%	0.775	74%	0.744	S	S	*	*			trans	-137.2	176.7	-158.7	-135.9	22.1	0	0	0	113.7
593	M	26.9	Very low	27.3	Very low	164 Å²	164	131.8 Å²	131.8	81%	0.808	75%	0.753	S	S	*	*			trans	76.4	136	175.3	-47.1	-49.9	-171.4	0	0	115.4
594	S	28.1	Very low	27.4	Very low	82 Å²	82	128.2 Å²	128.2	57%	0.573	75%	0.75	S	S	*	*			cis	-153.2	-146.9	-11.6	-76.5	0	0	0	0	107.5
595	E	28.2	Very low	27.8	Very low	171 Å²	171	130.8 Å²	130.8	80%	0.799	76%	0.756	S	S	*	*			cis	-166.5	169.7	-4.9	-134.9	118.9	-111.7	0	0	105
596	E	24.7	Very low	28	Very low	150 Å²	150	128.9 Å²	128.9	70%	0.701	76%	0.755	S	S	*	*			cis	-161.3	164.1	-3.6	-147.8	-68	96.5	0	0	107.7
597	S	28.4	Very low	28.2	Very low	78 Å²	78	127 Å²	127	55%	0.545	75%	0.753	S	S	.	*			trans	68.8	122.3	161.4	-96.9	0	0	0	0	119.8
598	S	31.5	Very low	28.3	Very low	98 Å²	98	128.7 Å²	128.7	69%	0.685	75%	0.752	S	S	*	*				81.3	127.6	75.1	-63.7	0	0	0	0	113
599	R	29.2	Very low	28.7	Very low	226 Å²	226	134.1 Å²	134.1	85%	0.853	76%	0.756	S	S	*	*			cis	-139.6	144.5	7.9	-64.3	-171.2	165	157.2	-5	109.5
600	S	28.8	Very low	29	Very low	106 Å²	106	132 Å²	132	74%	0.741	75%	0.752	S	S	*	*				60.8	137.2	81.7	127.4	0	0	0	0	114.2
601	S	32.6	Very low	29.1	Very low	92 Å²	92	130.4 Å²	130.4	64%	0.643	75%	0.749	S	S	*	*			cis	-140.9	154.8	8.3	-77.5	0	0	0	0	110.6
602	Q	32.3	Very low	29.5	Very low	161 Å²	161	132.2 Å²	132.2	75%	0.752	75%	0.745	S	S	*	*				62.4	132.7	65.7	-120.3	-175.7	-70.1	0	0	111.1
603	E	31.1	Very low	29.6	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	75%	0.745	S	S	*	*			cis	-143.4	176.2	20	-72.1	161.2	157.4	0	0	110.2
604	G	29.5	Very low	29.8	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	74%	0.743	S	S	*	*			cis	173	153.5	-7.2	0	0	0	0	0	113.3
605	L	30.8	Very low	29.9	Very low	158 Å²	158	136.3 Å²	136.3	83%	0.827	75%	0.749	S	S	*	*			trans	53	142.1	147.1	-61.9	176.9	0	0	0	124.9
606	D	28.6	Very low	29.9	Very low	149 Å²	149	133.1 Å²	133.1	80%	0.797	74%	0.741	S	S	*	*			trans	63.7	136.4	148.4	-57	-19.8	0	0	0	123.5
607	G	27.2	Very low	30.4	Very low	68 Å²	68	133.1 Å²	133.1	70%	0.701	75%	0.746	S	S	*	*			trans	144.5	51.6	131.5	0	0	0	0	0	124.3
608	L	28.8	Very low	30.5	Very low	163 Å²	163	133.4 Å²	133.4	85%	0.853	75%	0.754	S	S	*	*			trans	66.8	163.7	146.9	-56.7	169	0	0	0	121.2
609	H	31.2	Very low	30.6	Very low	191 Å²	191	138.1 Å²	138.1	88%	0.884	76%	0.762	S	S	*	*			trans	63.5	148.5	176	-70.5	78.8	0	0	0	117.1
610	G	30	Very low	30.9	Very low	67 Å²	67	138.2 Å²	138.2	69%	0.691	76%	0.762	S	S	*	*			cis	-173.4	179.3	-1.7	0	0	0	0	0	111.8
611	D	29.5	Very low	31.1	Very low	149 Å²	149	137.9 Å²	137.9	80%	0.797	76%	0.756	S	S	*	*			trans	-16.1	130.1	-177.3	-71.8	-64.9	0	0	0	119.6
612	V	32.3	Very low	31.2	Very low	114 Å²	114	141.5 Å²	141.5	69%	0.691	76%	0.762	S	S	*	*				74.3	124.3	60.1	175.6	0	0	0	0	114.9
613	K	32	Very low	30.9	Very low	177 Å²	177	140.5 Å²	140.5	77%	0.77	77%	0.767	S	S	*	*			trans	83.6	122.4	159.3	-83.3	172.6	178.4	172.4	0	122.6
614	L	30.6	Very low	30.7	Very low	146 Å²	146	138.6 Å²	138.6	76%	0.764	77%	0.767	S	S	*	*			trans	69.3	165.2	133.6	-60.5	168.4	0	0	0	119.7
615	H	29.9	Very low	32.1	Very low	155 Å²	155	140.9 Å²	140.9	72%	0.718	77%	0.77	S	S	*	*			cis	-177.1	155.5	-42.5	-152.9	-89.8	0	0	0	108.6
616	T	30	Very low	31.9	Very low	103 Å²	103	142 Å²	142	63%	0.632	77%	0.771	S	S	*	*			trans	68.5	117	158.8	17.8	0	0	0	0	122.4
617	D	33.5	Very low	31.8	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	77%	0.767	S	S	*	*				42.1	135.6	129.4	-60.4	-21.8	0	0	0	124.7
618	A	31.4	Very low	31.8	Very low	84 Å²	84	147.9 Å²	147.9	69%	0.694	78%	0.776	S	S	*	*				172.5	127.3	100.3	0	0	0	0	0	118.7
619	K	33.8	Very low	31.7	Very low	196 Å²	196	145.1 Å²	145.1	85%	0.852	77%	0.77	S	S	*	*			trans	62	149.5	130.2	-63.9	173.6	-179.8	165.9	0	125.1
620	R	34.3	Very low	31.8	Very low	229 Å²	229	144.7 Å²	144.7	86%	0.864	77%	0.768	S	S	*	*			trans	79.3	148.7	146.7	-87.6	-169.3	163.7	167.2	-4.9	120.4
621	T	33.8	Very low	32.5	Very low	99 Å²	99	147.4 Å²	147.4	61%	0.607	77%	0.774	S	S	*	*			cis	-169	156.6	-25.5	11	0	0	0	0	114.2
622	H	33.9	Very low	33.6	Very low	167 Å²	167	145.6 Å²	145.6	77%	0.773	77%	0.77	S	S	*	*			trans	52.6	131	149.8	-67.5	-65.9	0	0	0	124.1
623	T	26.1	Very low	33.7	Very low	140 Å²	140	147.2 Å²	147.2	86%	0.859	78%	0.78	S	S	*	*				169.7	162.1	113.6	34.3	0	0	0	0	114.3
624	T	27.7	Very low	33.7	Very low	136 Å²	136	144 Å²	144	83%	0.834	78%	0.776	S	S	*	*			trans	-156.5	178.5	176.3	52.1	0	0	0	0	108.5
625	P	58.4	Low	33.9	Very low	116 Å²	116	148.1 Å²	148.1	75%	0.753	78%	0.781	S	S	*	*			cis	-146.9	-161.3	16.7	39.8	-14.2	0	0	0	118.3
626	E	28.1	Very low	33.8	Very low	181 Å²	181	147.3 Å²	147.3	85%	0.846	78%	0.781	S	S	*	*			trans	112.6	107.5	150.2	-83.8	-171.9	172	0	0	125.6
627	C	26.5	Very low	33.7	Very low	106 Å²	106	147.8 Å²	147.8	72%	0.716	79%	0.787	S	S	*	*				86	116.7	121.2	-143.8	0	0	0	0	126.8
628	R	27	Very low	33.5	Very low	236 Å²	236	147.3 Å²	147.3	89%	0.891	79%	0.79	S	S	*	*			trans	63.4	158.1	149.6	-82.1	-177.7	177.2	-168.2	-0.4	120.8
629	S	26.7	Very low	33.6	Very low	105 Å²	105	147.6 Å²	147.6	73%	0.734	79%	0.793	S	S	*	*			cis	-162.4	168.8	-8.8	40.8	0	0	0	0	113.3
630	H	33.1	Very low	34.2	Very low	181 Å²	181	143.4 Å²	143.4	84%	0.838	79%	0.785	S	S	*	*			trans	-77.8	178.5	-178.1	-46.3	-84.7	0	0	0	115.7
631	P	43.9	Very low	34	Very low	124 Å²	124	140.7 Å²	140.7	81%	0.805	78%	0.782	S	S	*	*				-151.5	-146.9	86.4	50.1	-29.7	0	0	0	114.7
632	P	52.9	Low	33.8	Very low	111 Å²	111	141 Å²	141	72%	0.721	79%	0.788	S	S	*	*				-137.7	-165.3	-129.7	37.9	-10.9	0	0	0	117.9
633	V	33.2	Very low	33.5	Very low	149 Å²	149	141.1 Å²	141.1	90%	0.903	79%	0.789	S	S	*	*			trans	-136.7	155.1	168.5	178.5	0	0	0	0	110.8
634	T	33.5	Very low	33.7	Very low	110 Å²	110	140.7 Å²	140.7	68%	0.675	79%	0.787	S	S	*	*			trans	-135.6	143.8	-156	-40.6	0	0	0	0	115.4
635	R	33.1	Very low	33.6	Very low	231 Å²	231	138 Å²	138	87%	0.872	79%	0.786	S	S	*	*			trans	178.6	111.1	138.1	-96.8	157.4	-171.2	-154.9	1.2	110.1
636	L	28.5	Very low	32.5	Very low	139 Å²	139	144.3 Å²	144.3	73%	0.728	79%	0.794	S	S	*	*				65.7	102.8	92.3	-66.1	176.3	0	0	0	113.1
637	C	28.4	Very low	33.3	Very low	113 Å²	113	141 Å²	141	76%	0.764	79%	0.788	S	S	*	*				80.5	142.1	81.6	-69.6	0	0	0	0	112.8
638	T	29.1	Very low	33.5	Very low	141 Å²	141	147.1 Å²	147.1	87%	0.865	80%	0.797	S	S	*	*			cis	-139.1	173.7	23.1	47.7	0	0	0	0	114.3
639	A	32.7	Very low	33.6	Very low	90 Å²	90	143 Å²	143	74%	0.744	79%	0.791	S	S	*	*			trans	-126.3	168.6	157.6	0	0	0	0	0	109.1
640	P	48	Very low	33.6	Very low	108 Å²	108	145.8 Å²	145.8	70%	0.701	79%	0.793	S	S	*	*				-148.1	152.8	121.8	27.4	-6.9	0	0	0	117.4
641	H	29.5	Very low	33.4	Very low	172 Å²	172	144.3 Å²	144.3	80%	0.796	79%	0.79	S	S	*	*			trans	41.8	116.9	142.4	-55	-55.5	0	0	0	121.4
642	S	29.7	Very low	32.7	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	79%	0.786	S	S	*	*				90.1	157.2	99.7	77	0	0	0	0	112.7
643	E	27.3	Very low	31.7	Very low	169 Å²	169	147 Å²	147	79%	0.79	79%	0.79	S	S	*	*			cis	-153.5	-176.2	9.6	-149.4	163.2	-160.7	0	0	111.4
644	T	30.6	Very low	31.5	Very low	132 Å²	132	147.1 Å²	147.1	81%	0.81	79%	0.785	S	S	*	*			trans	-11	142.2	169.7	49.8	0	0	0	0	121.7
645	G	26.4	Very low	33.1	Very low	79 Å²	79	147 Å²	147	81%	0.814	79%	0.786	S	S	*	*			trans	162.6	123.4	150	0	0	0	0	0	120.6
646	R	34.1	Very low	34.1	Very low	248 Å²	248	141.6 Å²	141.6	94%	0.936	78%	0.781	S	S	*	*			trans	-138.9	159.9	149.3	-85.5	-171.1	173.6	-167	-0.6	105.6
647	P	45.2	Very low	34.3	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	78%	0.779	S	S	*	*			cis	-147.3	174.1	23.6	43.6	-24.3	0	0	0	119.1
648	R	30.3	Very low	34.5	Very low	235 Å²	235	141.4 Å²	141.4	89%	0.887	78%	0.782	S	S	*	*			trans	70.7	159.8	140.4	-97.9	-175.5	170.2	171.7	-2.7	123.3
649	L	29.4	Very low	34.6	Very low	149 Å²	149	138.2 Å²	138.2	78%	0.78	77%	0.771	S	S	*	*			trans	79.4	152.8	167.7	-54	-171.2	0	0	0	118
650	H	27.8	Very low	34.5	Very low	165 Å²	165	142 Å²	142	76%	0.764	77%	0.773	S	S	*	*			cis	-168.4	174.3	-43.1	-137.8	-105.4	0	0	0	110
651	L	28.9	Very low	33.6	Very low	149 Å²	149	143.3 Å²	143.3	78%	0.78	77%	0.773	S	S	*	*			trans	74.5	135.1	174	-53.2	162	0	0	0	115.4
652	N	28.8	Very low	33.6	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	77%	0.771	S	S	*	*			cis	95.1	123.6	15.7	-169.2	33.7	0	0	0	116.4
653	I	30.6	Very low	33.6	Very low	157 Å²	157	142.6 Å²	142.6	81%	0.805	78%	0.776	S	S	*	*			trans	173.7	147.5	142.4	-91.2	154.4	0	0	0	112.2
654	N	30.7	Very low	33.9	Very low	151 Å²	151	143 Å²	143	81%	0.807	78%	0.78	S	S	*	*			trans	-149	175.9	176.3	-91.8	-28.2	0	0	0	108.2
655	P	66.7	Low	34.9	Very low	107 Å²	107	142.7 Å²	142.7	70%	0.695	78%	0.78	S	S	*	*			cis	-107.1	-115.6	-22.2	37.9	-19.7	0	0	0	109.3	V657	P655-V657 HydrophobicContact CB-CG2 4.34Å
656	P	54.3	Low	35	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	78%	0.776	S	S	*	*			cis	-100.9	-179.2	-11.8	13.4	11.7	0	0	0	113.1
657	V	32.5	Very low	36	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.685	77%	0.767	S	S	*	*			cis	108.9	126.4	4	178.3	0	0	0	0	117.5	P655	P655-V657 HydrophobicContact CB-CG2 4.34Å
658	T	31.9	Very low	35.3	Very low	135 Å²	135	137.6 Å²	137.6	83%	0.828	77%	0.769	S	S	*	*			trans	64.7	149.1	171.3	50.1	0	0	0	0	120.5
659	A	31.5	Very low	35.3	Very low	75 Å²	75	137.2 Å²	137.2	62%	0.62	77%	0.768	S	S	*	*			cis	-172	172.2	-20	0	0	0	0	0	113.7
660	H	29.7	Very low	35.4	Very low	169 Å²	169	134.9 Å²	134.9	78%	0.782	76%	0.764	S	S	*	*			trans	84.1	130.3	149.5	-80	-65.5	0	0	0	125.7
661	L	29.3	Very low	36.4	Very low	135 Å²	135	132.2 Å²	132.2	71%	0.707	76%	0.761	S	S	*	*			trans	85.4	109.8	135.8	-69.9	166.8	0	0	0	124.9
662	N	29.8	Very low	36.6	Very low	142 Å²	142	129.6 Å²	129.6	76%	0.759	76%	0.755	S	S	*	*				65.3	136.7	123.4	-72	11.1	0	0	0	126.5
663	S	29.5	Very low	36.8	Very low	121 Å²	121	131 Å²	131	85%	0.846	76%	0.763	S	S	*	*			trans	104.2	145.7	133.6	-78.1	0	0	0	0	122.8
664	M	34.8	Very low	36.7	Very low	177 Å²	177	127 Å²	127	87%	0.872	76%	0.759	S	S	*	*			trans	-105.3	163.2	-178.8	-73.2	-88.6	-163.5	0	0	112.8
665	P	50	Low	36.6	Very low	125 Å²	125	132 Å²	132	81%	0.812	77%	0.767	S	S	*	*				-124.3	159	126.1	35.9	-28	0	0	0	110.8
666	G	29	Very low	34.9	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	77%	0.771	S	S	*	*			cis	113.8	163.2	27.8	0	0	0	0	0	109.9
667	P	55.7	Low	34.8	Very low	115 Å²	115	132.3 Å²	132.3	75%	0.747	77%	0.772	S	S	*	*			cis	-147.6	175.2	-11.3	45.5	-27.6	0	0	0	117.4
668	L	31	Very low	35.7	Very low	148 Å²	148	132.6 Å²	132.6	78%	0.775	78%	0.776	S	S	*	*			trans	65.6	157	150.2	-67.6	159	0	0	0	121.3
669	R	29.8	Very low	36.9	Very low	227 Å²	227	131.2 Å²	131.2	86%	0.857	77%	0.77	S	S	*	*			cis	-162.5	173.6	-27.8	-143	-175.6	-168.9	166.5	0.1	111.7
670	S	31.9	Very low	36.8	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	78%	0.78	S	S	*	*			trans	-76.7	-169	-174.4	58.6	0	0	0	0	117.1
671	P	48.6	Very low	36.7	Very low	109 Å²	109	136 Å²	136	71%	0.708	78%	0.776	S	S	*	*			cis	-149	177	6.8	44.8	-23.3	0	0	0	121.5
672	S	32.8	Very low	36.8	Very low	93 Å²	93	133.5 Å²	133.5	65%	0.65	78%	0.775	S	S	*	*			trans	55.9	143.3	140.2	62	0	0	0	0	128
673	D	32.7	Very low	36.7	Very low	166 Å²	166	134.2 Å²	134.2	89%	0.888	77%	0.773	S	S	*	*			trans	63.8	149.2	153.8	-57	-15.5	0	0	0	122.2
674	G	28.2	Very low	36.7	Very low	71 Å²	71	135.9 Å²	135.9	73%	0.732	77%	0.767	S	S	*	*			cis	150.3	128.1	-13.9	0	0	0	0	0	115.9
675	R	29.2	Very low	36.3	Very low	256 Å²	256	137.9 Å²	137.9	97%	0.966	77%	0.765	S	S	*	*			trans	-177.3	156.7	157.7	-110.9	173.8	-171.7	-146.8	0.1	117.2
676	S	30.5	Very low	35.3	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	76%	0.764	S	S	*	*			trans	-130.3	-156.2	176.2	-27.8	0	0	0	0	109.9
677	P	52.1	Low	35.2	Very low	122 Å²	122	139.7 Å²	139.7	79%	0.792	77%	0.77	S	S	*	*			cis	-112.2	-126	-6.4	40.2	-19.1	0	0	0	110
678	P	52.9	Low	33.8	Very low	118 Å²	118	138 Å²	138	77%	0.766	77%	0.774	S	S	*	*			cis	-122	-169.4	-5.3	41	-21.1	0	0	0	114.8
679	P	55.9	Low	33.6	Very low	107 Å²	107	136.1 Å²	136.1	70%	0.695	77%	0.773	S	S	*	*			trans	-126.7	-175.9	-161.7	44	-31.5	0	0	0	117.4
680	Y	28.6	Very low	33.6	Very low	212 Å²	212	132.9 Å²	132.9	83%	0.831	77%	0.772	S	S	*	*				-174.1	116.8	123.5	-118.8	-98.7	0	0	0	116.6
681	N	29.5	Very low	33.3	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	77%	0.772	S	S	*	*			trans	22.9	126.6	141	-70.2	-5.6	0	0	0	126.1
682	A	29.6	Very low	32.4	Very low	82 Å²	82	134.6 Å²	134.6	68%	0.678	77%	0.774	S	S	*	*				98.9	119.4	108.6	0	0	0	0	0	125.7
683	H	29	Very low	33	Very low	157 Å²	157	135.6 Å²	135.6	73%	0.727	78%	0.778	S	S	*	*				72.2	130.7	125.4	-79.4	-104.3	0	0	0	125.8
684	H	29.3	Very low	32.9	Very low	157 Å²	157	135 Å²	135	73%	0.727	77%	0.77	S	S	*	*			trans	68.4	170.8	147.5	-65	-43.9	0	0	0	121
685	R	27	Very low	32.9	Very low	218 Å²	218	139.5 Å²	139.5	82%	0.823	78%	0.777	S	S	*	*			cis	178.2	157.7	-47.4	-160.8	-172	-168.2	-173.2	4.6	108.3
686	V	27.7	Very low	32.8	Very low	132 Å²	132	131.5 Å²	131.5	80%	0.8	77%	0.765	S	S	*	*			trans	90	142.4	160.7	-170.7	0	0	0	0	118.2
687	A	27.2	Very low	32.9	Very low	101 Å²	101	132.4 Å²	132.4	84%	0.835	77%	0.766	S	S	*	*			trans	-70.4	176.4	-168.7	0	0	0	0	0	118.4
688	G	26.3	Very low	32.4	Very low	80 Å²	80	132.2 Å²	132.2	83%	0.825	77%	0.765	S	S	*	*			trans	-170.8	135	163.8	0	0	0	0	0	112
689	S	26.8	Very low	32.1	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	77%	0.766	S	S	*	*			trans	-122.9	155.9	179.3	52.5	0	0	0	0	111.1
690	L	29.5	Very low	31	Very low	159 Å²	159	137.4 Å²	137.4	83%	0.832	77%	0.771	S	S	*	*			trans	162.2	143	130.7	-87.4	161.7	0	0	0	116.6
691	S	26.5	Very low	31.6	Very low	100 Å²	100	133 Å²	133	70%	0.699	77%	0.769	S	S	*	*			trans	49.6	119.2	144.1	62.9	0	0	0	0	125.2
692	L	29.6	Very low	31.5	Very low	145 Å²	145	130.5 Å²	130.5	76%	0.759	77%	0.766	S	S	*	*				7.1	152.5	118.4	-104.9	76	0	0	0	120.7	Q694	L692-Q694 HydrophobicContact CD2-CG 4.07Å
693	P	44.4	Very low	31.4	Very low	113 Å²	113	134.9 Å²	134.9	73%	0.734	77%	0.773	S	S	*	*				-140.3	142.7	74.9	29.7	-8.9	0	0	0	116.5
694	Q	30.7	Very low	32.1	Very low	154 Å²	154	133.3 Å²	133.3	72%	0.72	78%	0.777	S	S	*	*				72.2	125.4	84.4	-58.3	-175.4	-67	0	0	118.4	L692	L692-Q694 HydrophobicContact CD2-CG 4.07Å
695	L	28.1	Very low	31.9	Very low	166 Å²	166	129.2 Å²	129.2	87%	0.869	78%	0.777	S	S	*	*				172.6	147.4	116.7	-109.4	81.5	0	0	0	108.1
696	A	27.1	Very low	32.2	Very low	87 Å²	87	130.6 Å²	130.6	72%	0.719	78%	0.782	S	S	*	*			cis	-153.3	162.3	-12.9	0	0	0	0	0	109.9
697	T	32.3	Very low	32.6	Very low	130 Å²	130	129.2 Å²	129.2	80%	0.798	78%	0.776	S	S	*	*			trans	-108.1	174.6	170.9	58.3	0	0	0	0	110.6
698	P	42.5	Very low	32.6	Very low	118 Å²	118	131.2 Å²	131.2	77%	0.766	78%	0.778	S	S	*	*				-148.9	-154.9	89.5	47.3	-27.6	0	0	0	112.3
699	P	46	Very low	32.7	Very low	122 Å²	122	134 Å²	134	79%	0.792	78%	0.779	S	S	*	*				-138.1	-176.6	-113.2	37.7	-12.8	0	0	0	119.3
700	R	33.7	Very low	33.3	Very low	212 Å²	212	133.8 Å²	133.8	80%	0.8	78%	0.775	S	S	*	*			trans	-50.8	162.4	171.9	-119.3	-178.1	-178.1	171.9	3	116.3
701	P	41.4	Very low	33.3	Very low	121 Å²	121	134.4 Å²	134.4	79%	0.786	77%	0.774	S	S	*	*				-123	-163.5	72.5	41.1	-32.1	0	0	0	112.9
702	A	26.2	Very low	33.3	Very low	79 Å²	79	136.8 Å²	136.8	65%	0.653	78%	0.784	S	S	*	*			cis	-152.4	-158.9	10.4	0	0	0	0	0	113.2
703	Q	28.7	Very low	33.2	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	79%	0.788	S	S	*	*			trans	-153.5	-171.7	171.8	-69.2	-160.1	0.3	0	0	108.4
704	P	42.3	Very low	32.5	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	79%	0.792	S	S	*	*			cis	-139.4	-179.6	-2.2	43.4	-25.5	0	0	0	117.1
705	G	26.6	Very low	32.4	Very low	71 Å²	71	133.9 Å²	133.9	73%	0.732	80%	0.796	S	S	*	*			trans	146.1	82.1	156	0	0	0	0	0	116.1
706	R	31.8	Very low	32.5	Very low	247 Å²	247	135 Å²	135	93%	0.932	80%	0.796	S	S	*	*				95.3	164.9	97.1	-112.2	-157.3	170.8	-166.2	-1.2	113
707	P	36	Very low	32.7	Very low	103 Å²	103	139.2 Å²	139.2	67%	0.669	80%	0.803	S	S	*	*				-133	152.4	-116.4	40.2	-22.7	0	0	0	117.6
708	T	27.4	Very low	32.7	Very low	143 Å²	143	139 Å²	139	88%	0.877	80%	0.802	S	S	*	*			trans	-158.6	139.8	155.8	33.4	0	0	0	0	112.1
709	T	28.8	Very low	32.6	Very low	138 Å²	138	139.2 Å²	139.2	85%	0.847	80%	0.803	S	S	*	*			trans	-157	160.8	170	39.6	0	0	0	0	108.9
710	P	39.7	Very low	32.3	Very low	104 Å²	104	139.8 Å²	139.8	68%	0.675	80%	0.795	S	S	*	*			cis	-133.7	170.6	-25.2	37.6	-21.1	0	0	0	114.5
711	Q	28.4	Very low	33	Very low	172 Å²	172	132.8 Å²	132.8	80%	0.804	78%	0.779	S	S	*	*			trans	51.7	121.6	146.1	-72.1	172.7	-7.1	0	0	121.8
712	T	27.1	Very low	33.3	Very low	150 Å²	150	130.6 Å²	130.6	92%	0.92	77%	0.766	S	S	*	*				-147.1	148.9	96.7	3.1	0	0	0	0	108.7
713	N	28.6	Very low	34.2	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	77%	0.769	S	S	*	*			trans	-141.9	120.7	-165.6	-161.5	31.7	0	0	0	111.8
714	S	29.5	Very low	35.1	Very low	115 Å²	115	132.1 Å²	132.1	80%	0.804	75%	0.754	S	S	*	*			trans	-91.3	107.5	177.4	51.4	0	0	0	0	110.5	Q716	S714-Q716 PolarHBondContact O-N 3.09Å
715	G	27.3	Very low	35.6	Very low	78 Å²	78	130.5 Å²	130.5	80%	0.804	74%	0.736	S	S	*	*			trans	-87	101.6	-173	0	0	0	0	0	114.7
716	Q	31.5	Very low	36.9	Very low	189 Å²	189	130.1 Å²	130.1	88%	0.883	72%	0.717	S	S	*	*			trans	-123.3	135.6	150.2	-88.6	-171.7	-23.2	0	0	108.6	S714	S714-Q716 PolarHBondContact O-N 3.09Å
717	M	30.2	Very low	38.7	Very low	176 Å²	176	124.1 Å²	124.1	87%	0.867	70%	0.695	S	S	*	*			trans	170.7	132.8	139.3	-86.2	-131.9	78	0	0	109.6
718	V	33.2	Very low	39.8	Very low	127 Å²	127	122.6 Å²	122.6	77%	0.77	68%	0.678	S	S	*	*			trans	-108.3	136.2	159.8	176.4	0	0	0	0	106.2	Q720	V718-Q720 PolarHBondContact O-N 3.5Å
719	P	40.5	Very low	41.3	Very low	121 Å²	121	122.2 Å²	122.2	79%	0.786	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-76.9	125.9	-173	29.5	-34.4	0	0	0	112.3
720	Q	40.2	Very low	42.6	Very low	135 Å²	135	121.8 Å²	121.8	63%	0.631	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-81.1	142.3	159	-70.3	-179.1	-19.4	0	0	109.5	V718	V718-Q720 PolarHBondContact O-N 3.5Å
721	S	47.9	Very low	43.5	Very low	65 Å²	65	124 Å²	124	46%	0.455	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-78.9	148.1	176.2	56.4	0	0	0	0	111.9	E723 W724	S721-E723 PolarHBondContact O-N 3.06Å; S721-W724 PolarHBondContact O-N 3.32Å
722	S	47.9	Very low	44.6	Very low	75 Å²	75	123.3 Å²	123.3	52%	0.524	63%	0.634	S	S	.	*	H	α-helix	trans	-57	-38.3	178.2	-167.8	0	0	0	0	112.1	W724 Q725 D726	S722-W724 PolarHBondContact O-N 3.16Å; S722-W724 VanDerWaalsContact O-N 3.09Å; S722-Q725 WeakPolarHBondContact O-CA 3.24Å; S722-Q725 WeakPolarHBondContact O-CB 3.4Å; S722-Q725 PolarHBondContact O-N 3.28Å; S722-D726 PolarHBondContact O-N 3.38Å; S722-D726 VanDerWaalsContact O-OD2 3.09Å; S722-D726 PolarHBondContact OG-OD2 2.98Å
723	E	44.5	Very low	45.5	Very low	153 Å²	153	122 Å²	122	72%	0.715	62%	0.618	S	S	*	*	H	α-helix	trans	-52.7	-34.1	-178.8	-60.5	170.7	139	0	0	112.7	S721 D726 W727	S721-E723 PolarHBondContact O-N 3.06Å; E723-D726 PolarHBondContact O-N 2.89Å; E723-W727 WeakPolarHBondContact O-CB 3.49Å; E723-W727 PolarHBondContact O-N 3.35Å
724	W	48.8	Very low	46.7	Very low	131 Å²	131	119.2 Å²	119.2	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-71.7	-35.1	177.6	-163.6	90.3	0	0	0	112.6	S721 S722 Q728	S721-W724 PolarHBondContact O-N 3.32Å; S722-W724 PolarHBondContact O-N 3.16Å; S722-W724 VanDerWaalsContact O-N 3.09Å; W724-Q728 HydrophobicContact CD2-CG 4.44Å; W724-Q728 HydrophobicContact CE3-CG 3.91Å; W724-Q728 HydrophobicContact CH2-CG 4.08Å; W724-Q728 VanDerWaalsContact CH2-NE2 3.31Å; W724-Q728 HydrophobicContact CZ3-CG 3.71Å; W724-Q728 WeakPolarHBondContact O-CG 3.34Å; W724-Q728 PolarHBondContact O-N 3.32Å; W724-Q728 VanDerWaalsContact O-N 3.11Å
725	Q	50.8	Low	47.6	Very low	91 Å²	91	121.6 Å²	121.6	43%	0.425	59%	0.593	S	S	.	*	H	α-helix	trans	-74.8	-31	176	-59.2	-174	2.6	0	0	111.8	S722 R729	S722-Q725 WeakPolarHBondContact O-CA 3.24Å; S722-Q725 WeakPolarHBondContact O-CB 3.4Å; S722-Q725 PolarHBondContact O-N 3.28Å; Q725-R729 PolarHBondContact O-N 3.45Å; Q725-R729 VanDerWaalsContact O-N 3.14Å
726	D	55.3	Low	48.4	Very low	62 Å²	62	123.5 Å²	123.5	33%	0.332	58%	0.581	S	S	.	*	H	α-helix	trans	-73.6	-40.9	174.5	-66	-48.7	0	0	0	111.6	S722 E723 Q728 R729 E730	S722-D726 PolarHBondContact O-N 3.38Å; S722-D726 VanDerWaalsContact O-OD2 3.09Å; S722-D726 PolarHBondContact OG-OD2 2.98Å; E723-D726 PolarHBondContact O-N 2.89Å; D726-Q728 VanDerWaalsContact C-N 3.33Å; D726-Q728 PolarHBondContact O-N 2.95Å; D726-R729 WeakPolarHBondContact O-CB 3.33Å; D726-R729 PolarHBondContact O-N 3.28Å; D726-R729 VanDerWaalsContact O-N 3.09Å; D726-R729 IonicContact OD1-CZ 2.65Å; D726-R729 VanDerWaalsContact OD1-CZ 3.3Å; D726-R729 IonicContact OD1-NE 3.55Å; D726-R729 PolarHBondContact OD1-NE 3Å; D726-R729 VanDerWaalsContact OD1-NE 3.09Å; D726-R729 IonicContact OD1-NH2 3.66Å; D726-R729 PolarHBondContact OD1-NH2 2.99Å; D726-E730 PolarHBondContact O-N 3.27Å
727	W	69.8	Low	49.2	Very low	122 Å²	122	120.9 Å²	120.9	46%	0.462	57%	0.573	S	S	.	*	H	α-helix	trans	-59.2	-40	170.3	-177.7	92.6	0	0	0	113	E723 R731	E723-W727 WeakPolarHBondContact O-CB 3.49Å; E723-W727 PolarHBondContact O-N 3.35Å; W727-R731 PolarHBondContact O-N 3.43Å
728	Q	58.8	Low	50	Low	71 Å²	71	118.4 Å²	118.4	33%	0.332	56%	0.562	S	S	.	*	H	α-helix	trans	-60.1	-44.6	171.9	-79.1	-77.2	-17.5	0	0	111.7	W724 D726 W732	W724-Q728 HydrophobicContact CD2-CG 4.44Å; W724-Q728 HydrophobicContact CE3-CG 3.91Å; W724-Q728 HydrophobicContact CH2-CG 4.08Å; W724-Q728 VanDerWaalsContact CH2-NE2 3.31Å; W724-Q728 HydrophobicContact CZ3-CG 3.71Å; W724-Q728 WeakPolarHBondContact O-CG 3.34Å; W724-Q728 PolarHBondContact O-N 3.32Å; W724-Q728 VanDerWaalsContact O-N 3.11Å; D726-Q728 VanDerWaalsContact C-N 3.33Å; D726-Q728 PolarHBondContact O-N 2.95Å; Q728-W732 PolarHBondContact O-N 3.24Å; Q728-W732 VanDerWaalsContact O-N 3.08Å
729	R	58.5	Low	50.5	Low	135 Å²	135	116 Å²	116	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-62.4	-47.2	178.4	-80.6	-173.3	-88.7	-104.5	2.5	112.6	Q725 D726 R731 W732 Q733	Q725-R729 PolarHBondContact O-N 3.45Å; Q725-R729 VanDerWaalsContact O-N 3.14Å; D726-R729 WeakPolarHBondContact O-CB 3.33Å; D726-R729 PolarHBondContact O-N 3.28Å; D726-R729 VanDerWaalsContact O-N 3.09Å; D726-R729 IonicContact OD1-CZ 2.65Å; D726-R729 VanDerWaalsContact OD1-CZ 3.3Å; D726-R729 IonicContact OD1-NE 3.55Å; D726-R729 PolarHBondContact OD1-NE 3Å; D726-R729 VanDerWaalsContact OD1-NE 3.09Å; D726-R729 IonicContact OD1-NH2 3.66Å; D726-R729 PolarHBondContact OD1-NH2 2.99Å; R729-R731 PolarHBondContact O-N 3.08Å; R729-W732 PolarHBondContact O-N 3.21Å; R729-Q733 PolarHBondContact O-N 3.11Å
730	E	55.6	Low	50.5	Low	129 Å²	129	114.3 Å²	114.3	60%	0.603	54%	0.542	S	S	*	.	H	α-helix	trans	-60.6	-44.8	179.8	-70.5	-172.4	154.6	0	0	111.7	D726 W732 Q733 I734	D726-E730 PolarHBondContact O-N 3.27Å; E730-W732 VanDerWaalsContact C-N 3.34Å; E730-W732 PolarHBondContact O-N 3Å; E730-Q733 PolarHBondContact O-N 3.4Å; E730-I734 WeakPolarHBondContact O-CG1 3.44Å; E730-I734 PolarHBondContact O-N 2.99Å
731	R	59.2	Low	50.8	Low	149 Å²	149	115.6 Å²	115.6	56%	0.562	55%	0.553	S	S	*	*	H	α-helix	trans	-65.6	-34.9	177.4	-68.7	-168.5	69.9	167.1	2.2	112.9	W727 R729 W735	W727-R731 PolarHBondContact O-N 3.43Å; R729-R731 PolarHBondContact O-N 3.08Å; R731-W735 WeakPolarHBondContact O-CB 3.36Å; R731-W735 PolarHBondContact O-N 3.09Å
732	W	52.5	Low	50.3	Low	158 Å²	158	119.3 Å²	119.3	60%	0.598	57%	0.568	S	S	*	*	H	α-helix	trans	-66.8	-39.4	174.1	-114	96	0	0	0	112.6	Q728 R729 E730 W735 Q736	Q728-W732 PolarHBondContact O-N 3.24Å; Q728-W732 VanDerWaalsContact O-N 3.08Å; R729-W732 PolarHBondContact O-N 3.21Å; E730-W732 VanDerWaalsContact C-N 3.34Å; E730-W732 PolarHBondContact O-N 3Å; W732-W735 PolarHBondContact O-N 3.46Å; W732-Q736 HydrophobicContact CE3-CG 4.15Å; W732-Q736 HydrophobicContact CZ3-CG 4.31Å; W732-Q736 PolarHBondContact O-N 3.09Å
733	Q	44.5	Very low	50.2	Low	122 Å²	122	120.5 Å²	120.5	57%	0.57	58%	0.583	S	S	*	*	H	α-helix	trans	-66.8	-40.6	175.5	-73.2	-178.9	-29.3	0	0	112.1	R729 E730 W735 Q736 L737	R729-Q733 PolarHBondContact O-N 3.11Å; E730-Q733 PolarHBondContact O-N 3.4Å; Q733-W735 VanDerWaalsContact C-N 3.3Å; Q733-W735 PolarHBondContact O-N 3.4Å; Q733-Q736 PolarHBondContact O-N 3.14Å; Q733-L737 PolarHBondContact O-N 2.94Å
734	I	53.5	Low	50.3	Low	99 Å²	99	120.8 Å²	120.8	51%	0.508	59%	0.589	S	S	.	*	H	α-helix	trans	-60.7	-40.8	172.3	-67.5	164.1	0	0	0	110.6	E730 L737 L738	E730-I734 WeakPolarHBondContact O-CG1 3.44Å; E730-I734 PolarHBondContact O-N 2.99Å; I734-L737 PolarHBondContact O-N 3Å; I734-L738 HydrophobicContact CG2-CD1 4.04Å; I734-L738 WeakPolarHBondContact O-CG 3.46Å; I734-L738 PolarHBondContact O-N 3.49Å; I734-L738 VanDerWaalsContact O-N 3.16Å
735	W	49.5	Very low	50.4	Low	165 Å²	165	119.8 Å²	119.8	63%	0.625	60%	0.598	S	S	*	*	H	α-helix	trans	-68	-37.3	178	-155.6	81.6	0	0	0	112.6	R731 W732 Q733 L738 S739	R731-W735 WeakPolarHBondContact O-CB 3.36Å; R731-W735 PolarHBondContact O-N 3.09Å; W732-W735 PolarHBondContact O-N 3.46Å; Q733-W735 VanDerWaalsContact C-N 3.3Å; Q733-W735 PolarHBondContact O-N 3.4Å; W735-L738 PolarHBondContact O-N 2.89Å; W735-S739 VanDerWaalsContact O-CB 3.24Å; W735-S739 WeakPolarHBondContact O-CB 3.47Å; W735-S739 PolarHBondContact O-N 3.27Å
736	Q	44.4	Very low	50	Low	118 Å²	118	122.7 Å²	122.7	55%	0.551	62%	0.615	S	S	*	*	H	α-helix	trans	-63.8	-42.7	171.3	-75.5	-172.2	-63.2	0	0	112.5	W732 Q733 L738 S739	W732-Q736 HydrophobicContact CE3-CG 4.15Å; W732-Q736 HydrophobicContact CZ3-CG 4.31Å; W732-Q736 PolarHBondContact O-N 3.09Å; Q733-Q736 PolarHBondContact O-N 3.14Å; Q736-L738 PolarHBondContact O-N 3.09Å; Q736-S739 PolarHBondContact O-N 3.24Å
737	L	46.7	Very low	49.2	Very low	135 Å²	135	124.6 Å²	124.6	71%	0.707	63%	0.631	S	S	*	*	H	α-helix	trans	-62.3	-26.7	177.3	-83.8	161.3	0	0	0	113.6	Q733 I734	Q733-L737 PolarHBondContact O-N 2.94Å; I734-L737 PolarHBondContact O-N 3Å
738	L	48	Very low	47.8	Very low	123 Å²	123	128.1 Å²	128.1	64%	0.644	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-0.5	176.1	-67.5	169.3	0	0	0	113.8	I734 W735 Q736 L746	I734-L738 HydrophobicContact CG2-CD1 4.04Å; I734-L738 WeakPolarHBondContact O-CG 3.46Å; I734-L738 PolarHBondContact O-N 3.49Å; I734-L738 VanDerWaalsContact O-N 3.16Å; W735-L738 PolarHBondContact O-N 2.89Å; Q736-L738 PolarHBondContact O-N 3.09Å; L738-L746 HydrophobicContact CD2-CD1 4.49Å
739	S	43.8	Very low	47.1	Very low	78 Å²	78	130.4 Å²	130.4	55%	0.545	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.5	-14.4	-170.6	-169	0	0	0	0	113.8	W735 Q736	W735-S739 VanDerWaalsContact O-CB 3.24Å; W735-S739 WeakPolarHBondContact O-CB 3.47Å; W735-S739 PolarHBondContact O-N 3.27Å; Q736-S739 PolarHBondContact O-N 3.24Å
740	S	40	Very low	46.4	Very low	85 Å²	85	132 Å²	132	59%	0.594	69%	0.689	S	S	*	*	S	Bend	trans	-93	134.8	176	57.2	0	0	0	0	112.8	N742	S740-N742 PolarHBondContact O-N 3.48Å; S740-N742 VanDerWaalsContact O-N 3.09Å
741	D	47.2	Very low	45.5	Very low	161 Å²	161	136 Å²	136	86%	0.861	72%	0.722	S	S	*	*	S	Bend	trans	-53.9	107	-175.7	-63.2	-71.7	0	0	0	114.8
742	N	37.2	Very low	44.8	Very low	144 Å²	144	135.3 Å²	135.3	77%	0.77	73%	0.73	S	S	*	*			trans	-167.7	98.1	152.3	-94.8	-49.2	0	0	0	109.8	S740 D744	S740-N742 PolarHBondContact O-N 3.48Å; S740-N742 VanDerWaalsContact O-N 3.09Å; N742-D744 PolarHBondContact O-N 2.68Å
743	A	45.9	Very low	44.4	Very low	100 Å²	100	134.1 Å²	134.1	83%	0.826	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-14.7	-171.7	0	0	0	0	0	115.2
744	D	46.5	Very low	44.4	Very low	159 Å²	159	134.8 Å²	134.8	85%	0.85	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	11.1	-164.7	-66.8	-50.5	0	0	0	115.1	N742	N742-D744 PolarHBondContact O-N 2.68Å
745	T	49.6	Very low	43.9	Very low	110 Å²	110	136.9 Å²	136.9	68%	0.675	76%	0.76	S	S	*	*			trans	-137.3	77.2	-179.2	59.2	0	0	0	0	114.6
746	L	42.7	Very low	43.6	Very low	151 Å²	151	135.1 Å²	135.1	79%	0.791	77%	0.768	S	S	*	*			trans	-132	135.5	158.2	-75.7	175.5	0	0	0	110.1	L738	L738-L746 HydrophobicContact CD2-CD1 4.49Å
747	P	39.5	Very low	43.5	Very low	102 Å²	102	136.3 Å²	136.3	66%	0.662	78%	0.783	S	S	*	*			trans	-80.4	150.4	-172.9	31.8	-35.3	0	0	0	113.7	T749	P747-T749 PolarHBondContact O-N 3Å
748	E	40.9	Very low	43.3	Very low	196 Å²	196	136.4 Å²	136.4	92%	0.916	79%	0.788	S	S	*	*	S	Bend	trans	-73.9	25.5	-168.4	-154.8	171.7	-151.8	0	0	115.3
749	T	43.9	Very low	42.9	Very low	119 Å²	119	137.4 Å²	137.4	73%	0.73	80%	0.799	S	S	*	*			trans	-116.2	21.7	-169.1	63.2	0	0	0	0	114.8	P747	P747-T749 PolarHBondContact O-N 3Å
750	L	42.3	Very low	42.8	Very low	169 Å²	169	142.3 Å²	142.3	89%	0.885	82%	0.82	S	S	*	*			trans	-137.8	77.4	172.7	-75.5	175.4	0	0	0	110.9
751	V	38.2	Very low	43.1	Very low	212 Å²	212	147.5 Å²	147.5	100%	1.285	84%	0.841	S	S	*	*			trans	-135.8	0	167.7	179.3	0	0	0	0	108.1

Retrieved 751 of 751 residues in 122.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).