A0A3B3UF78_9TELE Loading...

Beta-1,4-galactosyltransferase

Responsible for the synthesis of complex-type N-linked oligosaccharides in many glycoproteins as well as the carbohydrate moieties of glycolipids.

AlphaFold DB , UniProt , Accession A0A3B3UF78, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 382 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	56.4	Low	249 Å²	249	181.5 Å²	181.5	100%	1.227	83%	0.827	S	S	*	*				0	99.7	0	-82.9	171.6	161.3	0	0	108
2	M	40.1	Very low	58	Low	185 Å²	185	171.8 Å²	171.8	91%	0.911	80%	0.796	S	S	*	*			trans	-92.8	141	171.5	-95	-172.1	150.1	0	0	109
3	P	52.7	Low	59.8	Low	106 Å²	106	167.6 Å²	167.6	69%	0.688	77%	0.774	S	S	*	*			trans	-72.1	136.6	-173.3	25.5	-24.7	0	0	0	110.4	H5	P3-H5 PolarHBondContact O-N 3.36Å
4	T	52.8	Low	61.4	Low	138 Å²	138	163.8 Å²	163.8	85%	0.847	76%	0.762	S	S	*	*			trans	-60.4	98.2	170.8	32.7	0	0	0	0	109.1	L6	T4-L6 PolarHBondContact O-N 3.35Å; T4-L6 VanDerWaalsContact O-N 3.15Å
5	H	58.7	Low	63	Low	175 Å²	175	155 Å²	155	81%	0.81	73%	0.733	S	S	*	*			trans	-53.9	122.6	168.6	-81.8	-86.8	0	0	0	108.7	P3 R7	P3-H5 PolarHBondContact O-N 3.36Å; H5-R7 VanDerWaalsContact C-N 3.3Å; H5-R7 PolarHBondContact O-N 3.17Å
6	L	56.6	Low	64.4	Low	154 Å²	154	151.8 Å²	151.8	81%	0.806	72%	0.721	S	S	*	*			trans	-51.9	93.6	170.4	-91.2	130.7	0	0	0	109.2	T4 F8	T4-L6 PolarHBondContact O-N 3.35Å; T4-L6 VanDerWaalsContact O-N 3.15Å; L6-F8 HydrophobicContact CD2-CE2 4.31Å; L6-F8 PolarHBondContact O-N 3.1Å
7	R	55.7	Low	65.6	Low	245 Å²	245	148.2 Å²	148.2	93%	0.925	71%	0.706	S	S	*	*			trans	-79.5	77.8	179.1	-148.3	176.8	-170.7	-180	2.6	107.4	H5 R9	H5-R7 VanDerWaalsContact C-N 3.3Å; H5-R7 PolarHBondContact O-N 3.17Å; R7-R9 PolarHBondContact O-N 3.11Å; R7-R9 VanDerWaalsContact O-N 3.14Å
8	F	56.5	Low	66.8	Low	121 Å²	121	147.6 Å²	147.6	53%	0.531	70%	0.701	S	S	.	*			trans	-56.1	120.6	172.5	-107.4	-92	0	0	0	108.4	L6 R10 L16	L6-F8 HydrophobicContact CD2-CE2 4.31Å; L6-F8 PolarHBondContact O-N 3.1Å; F8-R10 PolarHBondContact O-N 3.06Å; F8-L16 HydrophobicContact CE1-CD1 4.44Å
9	R	70.5	Confident	67.9	Low	195 Å²	195	145.8 Å²	145.8	74%	0.736	70%	0.695	S	S	*	*			trans	-56.3	125.8	179.2	-156.7	174.8	-176.1	-175	2	107.3	R7 R11 S12 F13	R7-R9 PolarHBondContact O-N 3.11Å; R7-R9 VanDerWaalsContact O-N 3.14Å; R9-R11 PolarHBondContact O-N 3.45Å; R9-S12 WeakPolarHBondContact O-CA 3.25Å; R9-S12 WeakPolarHBondContact O-CB 3.45Å; R9-S12 PolarHBondContact O-N 3.38Å; R9-F13 PolarHBondContact O-N 3.06Å
10	R	67.8	Low	68.9	Low	221 Å²	221	145.5 Å²	145.5	83%	0.834	69%	0.691	S	S	*	*	H	α-helix	trans	-43.2	-39.9	-175.1	-101.8	-178.1	175.5	-176.8	-1.4	113.4	F8 F13 L14	F8-R10 PolarHBondContact O-N 3.06Å; R10-F13 PolarHBondContact O-N 3.49Å; R10-L14 WeakPolarHBondContact O-CD1 3.37Å; R10-L14 PolarHBondContact O-N 2.82Å
11	R	69.4	Low	69.8	Low	208 Å²	208	141.6 Å²	141.6	79%	0.785	68%	0.68	S	S	*	*	H	α-helix	trans	-63.3	-39.8	176.4	-65.9	-174.6	179.6	-178.5	-0.4	113.9	R9 G15	R9-R11 PolarHBondContact O-N 3.45Å; R11-G15 PolarHBondContact O-N 3.44Å
12	S	75.4	Confident	72	Confident	65 Å²	65	134 Å²	134	46%	0.455	64%	0.643	S	S	.	*	H	α-helix	trans	-70.1	-35.6	175.4	-63.8	0	0	0	0	111.9	R9 G15 L16	R9-S12 WeakPolarHBondContact O-CA 3.25Å; R9-S12 WeakPolarHBondContact O-CB 3.45Å; R9-S12 PolarHBondContact O-N 3.38Å; S12-G15 PolarHBondContact O-N 3.38Å; S12-L16 WeakPolarHBondContact O-CB 3.42Å; S12-L16 PolarHBondContact O-N 3.37Å
13	F	81.3	Confident	74.1	Confident	117 Å²	117	128.1 Å²	128.1	51%	0.513	62%	0.62	S	S	.	*	H	α-helix	trans	-67.2	-43.2	174.4	-176.2	-106.1	0	0	0	112.2	R9 R10 L16 L17	R9-F13 PolarHBondContact O-N 3.06Å; R10-F13 PolarHBondContact O-N 3.49Å; F13-L16 PolarHBondContact O-N 2.73Å; F13-L17 HydrophobicContact CD1-CD1 3.81Å; F13-L17 HydrophobicContact CD1-CG 4.46Å; F13-L17 HydrophobicContact CE1-CD1 3.4Å; F13-L17 VanDerWaalsContact CE1-CD1 3.4Å; F13-L17 HydrophobicContact CE1-CG 4.14Å; F13-L17 HydrophobicContact CZ-CD1 3.92Å; F13-L17 HydrophobicContact CZ-CD2 4.5Å; F13-L17 HydrophobicContact CZ-CG 4.24Å; F13-L17 PolarHBondContact O-N 3.11Å
14	L	82.3	Confident	75.5	Confident	114 Å²	114	125.8 Å²	125.8	60%	0.597	60%	0.604	S	S	*	*	H	α-helix	trans	-60.5	-42.5	172.1	-91	139.5	0	0	0	112.2	R10 L16 L17 F18	R10-L14 WeakPolarHBondContact O-CD1 3.37Å; R10-L14 PolarHBondContact O-N 2.82Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 2.85Å; L14-L17 PolarHBondContact O-N 3.13Å; L14-F18 WeakPolarHBondContact O-CB 3.18Å; L14-F18 PolarHBondContact O-N 3.07Å
15	G	85.2	Confident	76.8	Confident	32 Å²	32	121.7 Å²	121.7	33%	0.33	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-39.2	174.2	0	0	0	0	0	112.9	R11 S12 F18 L19	R11-G15 PolarHBondContact O-N 3.44Å; S12-G15 PolarHBondContact O-N 3.38Å; G15-F18 PolarHBondContact O-N 3.15Å; G15-L19 WeakPolarHBondContact O-CG 3.35Å; G15-L19 PolarHBondContact O-N 3.38Å
16	L	85.5	Confident	77.7	Confident	104 Å²	104	116.7 Å²	116.7	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-71	-39.3	179.2	-144.9	138.2	0	0	0	112	F8 S12 F13 L14 L19 F20	F8-L16 HydrophobicContact CE1-CD1 4.44Å; S12-L16 WeakPolarHBondContact O-CB 3.42Å; S12-L16 PolarHBondContact O-N 3.37Å; F13-L16 PolarHBondContact O-N 2.73Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 2.85Å; L16-L19 PolarHBondContact O-N 2.86Å; L16-F20 VanDerWaalsContact O-CB 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.39Å; L16-F20 PolarHBondContact O-N 3.3Å
17	L	85.6	Confident	78.7	Confident	90 Å²	90	113.4 Å²	113.4	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-63.2	-40.7	171.1	-76.8	173.4	0	0	0	112.1	F13 L14 F20 S21	F13-L17 HydrophobicContact CD1-CD1 3.81Å; F13-L17 HydrophobicContact CD1-CG 4.46Å; F13-L17 HydrophobicContact CE1-CD1 3.4Å; F13-L17 VanDerWaalsContact CE1-CD1 3.4Å; F13-L17 HydrophobicContact CE1-CG 4.14Å; F13-L17 HydrophobicContact CZ-CD1 3.92Å; F13-L17 HydrophobicContact CZ-CD2 4.5Å; F13-L17 HydrophobicContact CZ-CG 4.24Å; F13-L17 PolarHBondContact O-N 3.11Å; L14-L17 PolarHBondContact O-N 3.13Å; L17-F20 PolarHBondContact O-N 2.91Å; L17-S21 VanDerWaalsContact O-CB 3.29Å; L17-S21 WeakPolarHBondContact O-CB 3.32Å; L17-S21 PolarHBondContact O-N 3.32Å
18	F	87.8	Confident	79.6	Confident	138 Å²	138	107.9 Å²	107.9	61%	0.605	53%	0.526	S	S	*	.	H	α-helix	trans	-63.6	-46.9	175.7	178.5	-97.8	0	0	0	111.5	L14 G15 F20 S21 L22	L14-F18 WeakPolarHBondContact O-CB 3.18Å; L14-F18 PolarHBondContact O-N 3.07Å; G15-F18 PolarHBondContact O-N 3.15Å; F18-F20 PolarHBondContact O-N 3.37Å; F18-S21 PolarHBondContact O-N 2.93Å; F18-L22 HydrophobicContact CE1-CD2 4.4Å; F18-L22 VanDerWaalsContact O-CB 3.31Å; F18-L22 WeakPolarHBondContact O-CB 3.29Å; F18-L22 PolarHBondContact O-N 2.85Å
19	L	87.2	Confident	80.2	Confident	113 Å²	113	106 Å²	106	59%	0.592	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-39.7	177.1	-72.5	170.9	0	0	0	112.2	G15 L16 L22 S23	G15-L19 WeakPolarHBondContact O-CG 3.35Å; G15-L19 PolarHBondContact O-N 3.38Å; L16-L19 PolarHBondContact O-N 2.86Å; L19-L22 PolarHBondContact O-N 3.19Å; L19-S23 VanDerWaalsContact O-CB 3.24Å; L19-S23 WeakPolarHBondContact O-CB 3.37Å; L19-S23 PolarHBondContact O-N 3.11Å
20	F	88.4	Confident	80	Confident	139 Å²	139	100.4 Å²	100.4	61%	0.61	50%	0.502	S	S	*	.	H	α-helix	trans	-63.7	-47	174.7	-177.4	-98.8	0	0	0	111.1	L16 L17 F18 L22 S23 T24	L16-F20 VanDerWaalsContact O-CB 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.39Å; L16-F20 PolarHBondContact O-N 3.3Å; L17-F20 PolarHBondContact O-N 2.91Å; F18-F20 PolarHBondContact O-N 3.37Å; F20-L22 VanDerWaalsContact C-N 3.35Å; F20-L22 PolarHBondContact O-N 3.25Å; F20-S23 PolarHBondContact O-N 2.72Å; F20-T24 HydrophobicContact CD1-CG2 4.15Å; F20-T24 HydrophobicContact CE1-CG2 3.72Å; F20-T24 HydrophobicContact CE2-CG2 4.14Å; F20-T24 HydrophobicContact CZ-CG2 3.72Å; F20-T24 WeakPolarHBondContact O-CG2 3.3Å; F20-T24 PolarHBondContact O-N 2.86Å; F20-T24 PolarHBondContact O-OG1 2.86Å
21	S	87	Confident	80	Confident	65 Å²	65	97.7 Å²	97.7	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-61.3	-42.4	176.2	-173.6	0	0	0	0	111.9	L17 F18 S23 T24 S25	L17-S21 VanDerWaalsContact O-CB 3.29Å; L17-S21 WeakPolarHBondContact O-CB 3.32Å; L17-S21 PolarHBondContact O-N 3.32Å; F18-S21 PolarHBondContact O-N 2.93Å; S21-S23 VanDerWaalsContact C-N 3.34Å; S21-T24 WeakPolarHBondContact CA-OG1 3.44Å; S21-T24 PolarHBondContact O-N 3.24Å; S21-T24 PolarHBondContact O-OG1 3.48Å; S21-T24 VanDerWaalsContact O-OG1 3.04Å; S21-S25 WeakPolarHBondContact O-CB 3.37Å; S21-S25 PolarHBondContact O-N 3.37Å; S21-S25 PolarHBondContact O-OG 2.85Å
22	L	85.6	Confident	79.7	Confident	88 Å²	88	91.1 Å²	91.1	46%	0.461	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-44	177	-175.1	67	0	0	0	110.4	F18 L19 F20 S25 V26	F18-L22 HydrophobicContact CE1-CD2 4.4Å; F18-L22 VanDerWaalsContact O-CB 3.31Å; F18-L22 WeakPolarHBondContact O-CB 3.29Å; F18-L22 PolarHBondContact O-N 2.85Å; L19-L22 PolarHBondContact O-N 3.19Å; F20-L22 VanDerWaalsContact C-N 3.35Å; F20-L22 PolarHBondContact O-N 3.25Å; L22-S25 PolarHBondContact O-N 3.2Å; L22-V26 WeakPolarHBondContact O-CB 3.47Å; L22-V26 WeakPolarHBondContact O-CG2 3.34Å; L22-V26 PolarHBondContact O-N 2.89Å
23	S	84.6	Confident	79.2	Confident	62 Å²	62	88.5 Å²	88.5	43%	0.434	46%	0.46	S	S	.	.	H	α-helix	trans	-62.3	-46.8	177.4	-177.1	0	0	0	0	112.1	L19 F20 S21 S25 V26 L27	L19-S23 VanDerWaalsContact O-CB 3.24Å; L19-S23 WeakPolarHBondContact O-CB 3.37Å; L19-S23 PolarHBondContact O-N 3.11Å; F20-S23 PolarHBondContact O-N 2.72Å; S21-S23 VanDerWaalsContact C-N 3.34Å; S23-S25 PolarHBondContact O-N 3.4Å; S23-V26 PolarHBondContact O-N 3.35Å; S23-L27 WeakPolarHBondContact O-CB 3.23Å; S23-L27 VanDerWaalsContact O-CG 3.3Å; S23-L27 WeakPolarHBondContact O-CG 3.41Å; S23-L27 PolarHBondContact O-N 2.85Å
24	T	82.6	Confident	78.4	Confident	57 Å²	57	83.1 Å²	83.1	35%	0.35	44%	0.437	S	S	.	.	H	α-helix	trans	-66.9	-37.1	178.2	55.1	0	0	0	0	112.1	F20 S21 L27 Y28	F20-T24 HydrophobicContact CD1-CG2 4.15Å; F20-T24 HydrophobicContact CE1-CG2 3.72Å; F20-T24 HydrophobicContact CE2-CG2 4.14Å; F20-T24 HydrophobicContact CZ-CG2 3.72Å; F20-T24 WeakPolarHBondContact O-CG2 3.3Å; F20-T24 PolarHBondContact O-N 2.86Å; F20-T24 PolarHBondContact O-OG1 2.86Å; S21-T24 WeakPolarHBondContact CA-OG1 3.44Å; S21-T24 PolarHBondContact O-N 3.24Å; S21-T24 PolarHBondContact O-OG1 3.48Å; S21-T24 VanDerWaalsContact O-OG1 3.04Å; T24-L27 PolarHBondContact O-N 3.28Å; T24-Y28 WeakPolarHBondContact O-CB 3.23Å; T24-Y28 PolarHBondContact O-N 3.03Å
25	S	80	Confident	77.5	Confident	52 Å²	52	78.2 Å²	78.2	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-62.5	-45.4	171.3	-65.1	0	0	0	0	111.8	S21 L22 S23 L27 Y28 F29	S21-S25 WeakPolarHBondContact O-CB 3.37Å; S21-S25 PolarHBondContact O-N 3.37Å; S21-S25 PolarHBondContact O-OG 2.85Å; L22-S25 PolarHBondContact O-N 3.2Å; S23-S25 PolarHBondContact O-N 3.4Å; S25-L27 VanDerWaalsContact C-N 3.35Å; S25-L27 PolarHBondContact O-N 2.82Å; S25-Y28 WeakPolarHBondContact O-CB 3.41Å; S25-Y28 PolarHBondContact O-N 2.81Å; S25-F29 WeakPolarHBondContact O-CD2 3.05Å; S25-F29 PolarHBondContact O-N 2.88Å
26	V	77.6	Confident	76.6	Confident	71 Å²	71	81.6 Å²	81.6	43%	0.43	42%	0.424	S	S	.	.	H	α-helix	trans	-60.5	-44.9	176.3	168	0	0	0	0	110.9	L22 S23 F29 I30	L22-V26 WeakPolarHBondContact O-CB 3.47Å; L22-V26 WeakPolarHBondContact O-CG2 3.34Å; L22-V26 PolarHBondContact O-N 2.89Å; S23-V26 PolarHBondContact O-N 3.35Å; V26-F29 PolarHBondContact O-N 3.42Å; V26-I30 HydrophobicContact CG1-CD1 3.64Å; V26-I30 HydrophobicContact CG1-CG1 4.38Å; V26-I30 VanDerWaalsContact O-CG1 3.29Å; V26-I30 WeakPolarHBondContact O-CG1 3.36Å; V26-I30 PolarHBondContact O-N 2.64Å
27	L	76.5	Confident	75.9	Confident	84 Å²	84	79.3 Å²	79.3	44%	0.44	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-41.7	176.7	-70.2	170.9	0	0	0	112.1	S23 T24 S25 F29 I30 Y31	S23-L27 WeakPolarHBondContact O-CB 3.23Å; S23-L27 VanDerWaalsContact O-CG 3.3Å; S23-L27 WeakPolarHBondContact O-CG 3.41Å; S23-L27 PolarHBondContact O-N 2.85Å; T24-L27 PolarHBondContact O-N 3.28Å; S25-L27 VanDerWaalsContact C-N 3.35Å; S25-L27 PolarHBondContact O-N 2.82Å; L27-F29 VanDerWaalsContact C-N 3.28Å; L27-F29 PolarHBondContact O-N 3.36Å; L27-I30 PolarHBondContact O-N 3.37Å; L27-Y31 HydrophobicContact CB-CD2 4.5Å; L27-Y31 HydrophobicContact CD2-CD2 4.13Å; L27-Y31 HydrophobicContact CD2-CE2 3.74Å; L27-Y31 WeakPolarHBondContact O-CB 3.44Å; L27-Y31 WeakPolarHBondContact O-CD2 3.3Å; L27-Y31 PolarHBondContact O-N 3.43Å
28	Y	75.3	Confident	75.2	Confident	130 Å²	130	75.7 Å²	75.7	51%	0.51	40%	0.395	S	S	.	.	H	α-helix	trans	-57.4	-44	174.2	172.6	-94.9	0	0	0	111.4	T24 S25 S32 A33	T24-Y28 WeakPolarHBondContact O-CB 3.23Å; T24-Y28 PolarHBondContact O-N 3.03Å; S25-Y28 WeakPolarHBondContact O-CB 3.41Å; S25-Y28 PolarHBondContact O-N 2.81Å; Y28-S32 CarbonylContact O-C 3.54Å; Y28-S32 VanDerWaalsContact O-CA 3.29Å; Y28-S32 WeakPolarHBondContact O-CA 3.23Å; Y28-S32 VanDerWaalsContact O-CB 3.23Å; Y28-S32 WeakPolarHBondContact O-CB 3.38Å; Y28-S32 PolarHBondContact O-N 2.83Å; Y28-A33 HydrophobicContact CD1-CB 4.36Å; Y28-A33 HydrophobicContact CE1-CB 3.73Å; Y28-A33 PolarHBondContact O-N 3.2Å
29	F	68.7	Low	74.6	Confident	81 Å²	81	72.6 Å²	72.6	36%	0.355	38%	0.382	S	S	.	.	H	α-helix	trans	-72.1	-32.5	180	-81.4	-55.7	0	0	0	113.8	S25 V26 L27 A33 P34 I36 V37	S25-F29 WeakPolarHBondContact O-CD2 3.05Å; S25-F29 PolarHBondContact O-N 2.88Å; V26-F29 PolarHBondContact O-N 3.42Å; L27-F29 VanDerWaalsContact C-N 3.28Å; L27-F29 PolarHBondContact O-N 3.36Å; F29-A33 HydrophobicContact CD1-CB 4.26Å; F29-A33 CarbonylContact O-C 3.57Å; F29-A33 VanDerWaalsContact O-C 3.29Å; F29-P34 WeakPolarHBondContact O-CA 3.34Å; F29-P34 VanDerWaalsContact O-N 3.16Å; F29-I36 HydrophobicContact CE1-CG2 4.43Å; F29-V37 HydrophobicContact CB-CG2 3.5Å; F29-V37 HydrophobicContact CD1-CG2 3.57Å; F29-V37 HydrophobicContact CG-CG2 3.7Å
30	I	67.3	Low	74	Confident	78 Å²	78	74.3 Å²	74.3	40%	0.4	38%	0.382	S	S	.	.	H	α-helix	trans	-71.4	-43.9	175.5	-69.5	168.5	0	0	0	111.1	V26 L27	V26-I30 HydrophobicContact CG1-CD1 3.64Å; V26-I30 HydrophobicContact CG1-CG1 4.38Å; V26-I30 VanDerWaalsContact O-CG1 3.29Å; V26-I30 WeakPolarHBondContact O-CG1 3.36Å; V26-I30 PolarHBondContact O-N 2.64Å; L27-I30 PolarHBondContact O-N 3.37Å
31	Y	66.5	Low	73.5	Confident	164 Å²	164	70.5 Å²	70.5	64%	0.643	37%	0.37	S	S	*	.	H	α-helix	trans	-103.7	-34.5	-168.1	-68.9	-73.3	0	0	0	114.5	L27	L27-Y31 HydrophobicContact CB-CD2 4.5Å; L27-Y31 HydrophobicContact CD2-CD2 4.13Å; L27-Y31 HydrophobicContact CD2-CE2 3.74Å; L27-Y31 WeakPolarHBondContact O-CB 3.44Å; L27-Y31 WeakPolarHBondContact O-CD2 3.3Å; L27-Y31 PolarHBondContact O-N 3.43Å
32	S	62.7	Low	73	Confident	69 Å²	69	68.6 Å²	68.6	48%	0.483	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-28.9	-171.1	-52.5	0	0	0	0	113.5	Y28	Y28-S32 CarbonylContact O-C 3.54Å; Y28-S32 VanDerWaalsContact O-CA 3.29Å; Y28-S32 WeakPolarHBondContact O-CA 3.23Å; Y28-S32 VanDerWaalsContact O-CB 3.23Å; Y28-S32 WeakPolarHBondContact O-CB 3.38Å; Y28-S32 PolarHBondContact O-N 2.83Å
33	A	64.8	Low	72.6	Confident	10 Å²	10	65.9 Å²	65.9	8%	0.083	34%	0.339	C	S	.	.			trans	-137.1	48.8	-179.3	0	0	0	0	0	114.1	Y28 F29 G35 I36	Y28-A33 HydrophobicContact CD1-CB 4.36Å; Y28-A33 HydrophobicContact CE1-CB 3.73Å; Y28-A33 PolarHBondContact O-N 3.2Å; F29-A33 HydrophobicContact CD1-CB 4.26Å; F29-A33 CarbonylContact O-C 3.57Å; F29-A33 VanDerWaalsContact O-C 3.29Å; A33-G35 PolarHBondContact O-N 3.17Å; A33-I36 HydrophobicContact CB-CD1 4.05Å; A33-I36 HydrophobicContact CB-CG1 4.37Å; A33-I36 PolarHBondContact O-N 2.91Å
34	P	64.6	Low	72.1	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.032	34%	0.339	C	S	.	.	H	α-helix	trans	-62	-32.8	-178.4	25.8	-34.4	0	0	0	112.5	F29 I36 V37 N38 E328 Q330	F29-P34 WeakPolarHBondContact O-CA 3.34Å; F29-P34 VanDerWaalsContact O-N 3.16Å; P34-I36 VanDerWaalsContact C-N 3.31Å; P34-I36 PolarHBondContact O-N 3.04Å; P34-V37 PolarHBondContact O-N 3.18Å; P34-N38 PolarHBondContact O-N 3.33Å; P34-N38 PolarHBondContact O-ND2 3.47Å; P34-E328 WeakPolarHBondContact CG-O 3.37Å; P34-Q330 HydrophobicContact CB-CB 3.95Å; P34-Q330 HydrophobicContact CG-CB 4.36Å
35	G	63.1	Low	71.7	Confident	11 Å²	11	67.8 Å²	67.8	11%	0.113	34%	0.342	C	S	.	.	H	α-helix	trans	-55.4	-43.1	177.6	0	0	0	0	0	113.2	A33 N38 E39	A33-G35 PolarHBondContact O-N 3.17Å; G35-N38 PolarHBondContact O-N 3.21Å; G35-E39 WeakPolarHBondContact O-CB 3.32Å; G35-E39 PolarHBondContact O-N 3.3Å
36	I	68.2	Low	71.2	Confident	103 Å²	103	65.4 Å²	65.4	53%	0.528	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-43.9	-179.7	-59.9	-179.2	0	0	0	110.9	F29 A33 P34 E39 Y40	F29-I36 HydrophobicContact CE1-CG2 4.43Å; A33-I36 HydrophobicContact CB-CD1 4.05Å; A33-I36 HydrophobicContact CB-CG1 4.37Å; A33-I36 PolarHBondContact O-N 2.91Å; P34-I36 VanDerWaalsContact C-N 3.31Å; P34-I36 PolarHBondContact O-N 3.04Å; I36-E39 PolarHBondContact O-N 2.84Å; I36-Y40 PolarHBondContact O-N 3.31Å
37	V	70.4	Confident	71	Confident	55 Å²	55	68 Å²	68	33%	0.333	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-45.5	177.8	175.4	0	0	0	0	111	F29 P34 E39 Y40 V41	F29-V37 HydrophobicContact CB-CG2 3.5Å; F29-V37 HydrophobicContact CD1-CG2 3.57Å; F29-V37 HydrophobicContact CG-CG2 3.7Å; P34-V37 PolarHBondContact O-N 3.18Å; V37-E39 VanDerWaalsContact C-N 3.29Å; V37-E39 PolarHBondContact O-N 2.86Å; V37-Y40 PolarHBondContact O-N 2.8Å; V37-V41 HydrophobicContact CG1-CG2 4.1Å; V37-V41 WeakPolarHBondContact O-CB 3.47Å; V37-V41 VanDerWaalsContact O-CG2 3.27Å; V37-V41 WeakPolarHBondContact O-CG2 3.5Å; V37-V41 PolarHBondContact O-N 3.33Å
38	N	71.3	Confident	70.7	Confident	14 Å²	14	65.8 Å²	65.8	8%	0.075	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-40.4	179.6	-70.3	-56.3	0	0	0	111.4	P34 G35 Y40 V41 F42 W290 Q330	P34-N38 PolarHBondContact O-N 3.33Å; P34-N38 PolarHBondContact O-ND2 3.47Å; G35-N38 PolarHBondContact O-N 3.21Å; N38-Y40 VanDerWaalsContact C-N 3.35Å; N38-Y40 PolarHBondContact O-N 2.84Å; N38-V41 PolarHBondContact O-N 3.4Å; N38-F42 HydrophobicContact CB-CE2 4.27Å; N38-F42 WeakPolarHBondContact O-CB 3.44Å; N38-F42 WeakPolarHBondContact O-CD2 3.14Å; N38-F42 WeakPolarHBondContact O-CG 3.2Å; N38-F42 PolarHBondContact O-N 3.35Å; N38-W290 HydrophobicContact CB-CH2 3.29Å; N38-W290 HydrophobicContact CB-CZ2 4.04Å; N38-W290 HydrophobicContact CB-CZ3 3.65Å; N38-W290 VanDerWaalsContact CG-CH2 3.41Å; N38-W290 WeakPolarHBondContact ND2-CZ3 3.42Å; N38-Q330 PolarHBondContact ND2-NE2 2.86Å; N38-Q330 PolarHBondContact OD1-NE2 3.32Å; N38-Q330 VanDerWaalsContact OD1-NE2 3.1Å
39	E	74.9	Confident	70.4	Confident	73 Å²	73	62.2 Å²	62.2	34%	0.341	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-44.8	174.5	-178.3	178.6	159	0	0	112.1	G35 I36 V37 F42 M43 K255 Y256	G35-E39 WeakPolarHBondContact O-CB 3.32Å; G35-E39 PolarHBondContact O-N 3.3Å; I36-E39 PolarHBondContact O-N 2.84Å; V37-E39 VanDerWaalsContact C-N 3.29Å; V37-E39 PolarHBondContact O-N 2.86Å; E39-F42 PolarHBondContact O-N 3.03Å; E39-M43 WeakPolarHBondContact O-CB 3.38Å; E39-M43 PolarHBondContact O-N 3.26Å; E39-K255 HydrophobicContact CG-CB 4.31Å; E39-K255 WeakPolarHBondContact OE1-CB 3.37Å; E39-Y256 HydrophobicContact CB-CE1 4.25Å; E39-Y256 HydrophobicContact CG-CD1 4.17Å; E39-Y256 HydrophobicContact CG-CE1 3.86Å
40	Y	74.5	Confident	70.5	Confident	150 Å²	150	62.7 Å²	62.7	59%	0.588	32%	0.318	S	S	*	.	H	α-helix	trans	-63.2	-43.9	175.2	-171.5	-94.1	0	0	0	112.4	I36 V37 N38 F42 M43 V44	I36-Y40 PolarHBondContact O-N 3.31Å; V37-Y40 PolarHBondContact O-N 2.8Å; N38-Y40 VanDerWaalsContact C-N 3.35Å; N38-Y40 PolarHBondContact O-N 2.84Å; Y40-F42 PolarHBondContact O-N 2.86Å; Y40-M43 HydrophobicContact CD2-CE 3.51Å; Y40-M43 HydrophobicContact CE2-CE 3.52Å; Y40-M43 HydrophobicContact CG-CE 4.33Å; Y40-M43 PolarHBondContact O-N 2.83Å; Y40-V44 HydrophobicContact CD1-CG2 3.97Å; Y40-V44 HydrophobicContact CE1-CG2 3.6Å; Y40-V44 WeakPolarHBondContact O-CG2 3.33Å; Y40-V44 PolarHBondContact O-N 3.4Å
41	V	77	Confident	70.7	Confident	59 Å²	59	64.1 Å²	64.1	36%	0.358	33%	0.325	S	S	.	.	H	α-helix	trans	-60.3	-46.4	176.9	169.2	0	0	0	0	110.5	V37 N38 M43 V44 Q45	V37-V41 HydrophobicContact CG1-CG2 4.1Å; V37-V41 WeakPolarHBondContact O-CB 3.47Å; V37-V41 VanDerWaalsContact O-CG2 3.27Å; V37-V41 WeakPolarHBondContact O-CG2 3.5Å; V37-V41 PolarHBondContact O-N 3.33Å; N38-V41 PolarHBondContact O-N 3.4Å; V41-M43 PolarHBondContact O-N 3.17Å; V41-V44 PolarHBondContact O-N 3.44Å; V41-Q45 HydrophobicContact CG1-CG 4.47Å; V41-Q45 WeakPolarHBondContact O-CG 3.44Å; V41-Q45 PolarHBondContact O-N 2.95Å
42	F	77.8	Confident	70.8	Confident	24 Å²	24	66 Å²	66	11%	0.105	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-42	176.5	-68.5	-33.5	0	0	0	112	N38 E39 Y40 V44 Q45 A46 Y256 P261 Y262 W290	N38-F42 HydrophobicContact CB-CE2 4.27Å; N38-F42 WeakPolarHBondContact O-CB 3.44Å; N38-F42 WeakPolarHBondContact O-CD2 3.14Å; N38-F42 WeakPolarHBondContact O-CG 3.2Å; N38-F42 PolarHBondContact O-N 3.35Å; E39-F42 PolarHBondContact O-N 3.03Å; Y40-F42 PolarHBondContact O-N 2.86Å; F42-V44 VanDerWaalsContact C-N 3.34Å; F42-V44 PolarHBondContact O-N 2.03Å; F42-Q45 PolarHBondContact O-N 3.24Å; F42-A46 VanDerWaalsContact O-CB 3.29Å; F42-A46 WeakPolarHBondContact O-CB 3.43Å; F42-A46 PolarHBondContact O-N 3.18Å; F42-Y256 HydrophobicContact CB-CD1 3.88Å; F42-Y256 HydrophobicContact CB-CE1 3.76Å; F42-Y256 AromaticContact CD2-CE1 3.83Å; F42-Y256 HydrophobicContact CD2-CE1 3.83Å; F42-Y256 AromaticContact CD2-CZ 3.77Å; F42-Y256 HydrophobicContact CG-CE1 4.29Å; F42-P261 HydrophobicContact CB-CB 3.94Å; F42-P261 HydrophobicContact CB-CG 4.14Å; F42-P261 HydrophobicContact CD1-CB 4.16Å; F42-P261 HydrophobicContact CG-CB 4.18Å; F42-Y262 HydrophobicContact CD1-CD1 4.35Å; F42-Y262 AromaticContact CD1-CE1 3.86Å; F42-Y262 HydrophobicContact CD1-CE1 3.86Å; F42-Y262 HydrophobicContact CE1-CD1 4.42Å; F42-Y262 AromaticContact CE1-CE1 3.58Å; F42-Y262 HydrophobicContact CE1-CE1 3.58Å; F42-Y262 HydrophobicContact CZ-CE1 4.35Å; F42-W290 AromaticContact CE2-CH2 3.62Å; F42-W290 HydrophobicContact CE2-CH2 3.62Å; F42-W290 HydrophobicContact CE2-CZ2 4.01Å; F42-W290 AromaticContact CZ-CH2 3.92Å; F42-W290 HydrophobicContact CZ-CH2 3.92Å
43	M	75.4	Confident	71.1	Confident	31 Å²	31	67.8 Å²	67.8	15%	0.153	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-43	174.1	-178.3	-168.5	62.2	0	0	111.7	E39 Y40 V41 A46 R47	E39-M43 WeakPolarHBondContact O-CB 3.38Å; E39-M43 PolarHBondContact O-N 3.26Å; Y40-M43 HydrophobicContact CD2-CE 3.51Å; Y40-M43 HydrophobicContact CE2-CE 3.52Å; Y40-M43 HydrophobicContact CG-CE 4.33Å; Y40-M43 PolarHBondContact O-N 2.83Å; V41-M43 PolarHBondContact O-N 3.17Å; M43-A46 PolarHBondContact O-N 2.99Å; M43-R47 WeakPolarHBondContact O-CG 3.34Å; M43-R47 PolarHBondContact O-N 3.05Å
44	V	75.9	Confident	71.4	Confident	71 Å²	71	71 Å²	71	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-43	177.8	170.7	0	0	0	0	111.3	Y40 V41 F42 R47 G48	Y40-V44 HydrophobicContact CD1-CG2 3.97Å; Y40-V44 HydrophobicContact CE1-CG2 3.6Å; Y40-V44 WeakPolarHBondContact O-CG2 3.33Å; Y40-V44 PolarHBondContact O-N 3.4Å; V41-V44 PolarHBondContact O-N 3.44Å; F42-V44 VanDerWaalsContact C-N 3.34Å; F42-V44 PolarHBondContact O-N 2.03Å; V44-R47 PolarHBondContact O-N 3.17Å; V44-G48 PolarHBondContact O-N 2.95Å
45	Q	73.9	Confident	71.7	Confident	88 Å²	88	75.3 Å²	75.3	41%	0.411	37%	0.373	S	S	.	.	H	α-helix	trans	-59.9	-47.2	174.8	-74.7	177.6	-32.2	0	0	111.3	V41 F42 R47 G48 I49	V41-Q45 HydrophobicContact CG1-CG 4.47Å; V41-Q45 WeakPolarHBondContact O-CG 3.44Å; V41-Q45 PolarHBondContact O-N 2.95Å; F42-Q45 PolarHBondContact O-N 3.24Å; Q45-R47 PolarHBondContact O-N 3.3Å; Q45-G48 PolarHBondContact O-N 2.88Å; Q45-G48 VanDerWaalsContact O-N 3.1Å; Q45-I49 WeakPolarHBondContact O-CG1 3.36Å; Q45-I49 PolarHBondContact O-N 3.23Å
46	A	69.4	Low	71.8	Confident	2 Å²	2	84.1 Å²	84.1	2%	0.017	40%	0.403	C	S	.	.	H	α-helix	trans	-59.7	-45	178.9	0	0	0	0	0	111.7	F42 M43 G48 I49 Q50 M259 L260	F42-A46 VanDerWaalsContact O-CB 3.29Å; F42-A46 WeakPolarHBondContact O-CB 3.43Å; F42-A46 PolarHBondContact O-N 3.18Å; M43-A46 PolarHBondContact O-N 2.99Å; A46-G48 PolarHBondContact O-N 3.31Å; A46-I49 PolarHBondContact O-N 3.32Å; A46-Q50 PolarHBondContact O-N 2.79Å; A46-M259 HydrophobicContact CB-CB 3.41Å; A46-M259 VanDerWaalsContact CB-CB 3.41Å; A46-M259 HydrophobicContact CB-CE 4.46Å; A46-M259 HydrophobicContact CB-CG 4.43Å; A46-M259 HydrophobicContact CB-SD 4.22Å; A46-L260 WeakPolarHBondContact CB-O 3.42Å
47	R	73	Confident	71.7	Confident	125 Å²	125	83.6 Å²	83.6	47%	0.472	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-41.4	173.6	-74.6	-178	-176.2	-168.4	2	112.4	M43 V44 Q45 I49 Q50 I51 M259	M43-R47 WeakPolarHBondContact O-CG 3.34Å; M43-R47 PolarHBondContact O-N 3.05Å; V44-R47 PolarHBondContact O-N 3.17Å; Q45-R47 PolarHBondContact O-N 3.3Å; R47-I49 VanDerWaalsContact C-N 3.33Å; R47-I49 PolarHBondContact O-N 3.3Å; R47-Q50 PolarHBondContact O-N 3.1Å; R47-I51 VanDerWaalsContact O-CG1 3.28Å; R47-I51 WeakPolarHBondContact O-CG1 3.5Å; R47-I51 PolarHBondContact O-N 3.4Å; R47-M259 HydrophobicContact CG-CE 3.49Å; R47-M259 VanDerWaalsContact CG-CE 3.49Å; R47-M259 HydrophobicContact CG-SD 3.91Å
48	G	69.9	Low	71.8	Confident	39 Å²	39	85.7 Å²	85.7	40%	0.402	41%	0.41	S	S	.	.	H	α-helix	trans	-61	-42.1	177.5	0	0	0	0	0	112.4	V44 Q45 A46 I51 R52	V44-G48 PolarHBondContact O-N 2.95Å; Q45-G48 PolarHBondContact O-N 2.88Å; Q45-G48 VanDerWaalsContact O-N 3.1Å; A46-G48 PolarHBondContact O-N 3.31Å; G48-I51 PolarHBondContact O-N 3.17Å; G48-R52 WeakPolarHBondContact O-CB 3.47Å; G48-R52 PolarHBondContact O-N 2.91Å
49	I	68.7	Low	71.3	Confident	55 Å²	55	86.9 Å²	86.9	28%	0.282	43%	0.426	S	S	.	.	H	α-helix	trans	-63	-47.7	174.6	-66	169	0	0	0	110.3	Q45 A46 R47 I51 R52 E53 P261	Q45-I49 WeakPolarHBondContact O-CG1 3.36Å; Q45-I49 PolarHBondContact O-N 3.23Å; A46-I49 PolarHBondContact O-N 3.32Å; R47-I49 VanDerWaalsContact C-N 3.33Å; R47-I49 PolarHBondContact O-N 3.3Å; I49-I51 VanDerWaalsContact C-N 3.34Å; I49-I51 PolarHBondContact O-N 3.08Å; I49-R52 WeakPolarHBondContact O-CB 3.41Å; I49-R52 PolarHBondContact O-N 2.92Å; I49-R52 VanDerWaalsContact O-N 3.1Å; I49-E53 HydrophobicContact CG2-CG 4.4Å; I49-E53 PolarHBondContact O-N 3.14Å; I49-P261 WeakPolarHBondContact CD1-O 3.47Å
50	Q	70.8	Confident	70.8	Confident	90 Å²	90	86 Å²	86	42%	0.421	43%	0.431	S	S	.	.	H	α-helix	trans	-59.4	-43.6	178.6	-169.7	-175.1	14	0	0	112.3	A46 R47 R52 E53 N54 M259	A46-Q50 PolarHBondContact O-N 2.79Å; R47-Q50 PolarHBondContact O-N 3.1Å; Q50-R52 VanDerWaalsContact C-N 3.32Å; Q50-R52 PolarHBondContact O-N 3.45Å; Q50-E53 PolarHBondContact O-N 2.92Å; Q50-N54 WeakPolarHBondContact O-CB 3.38Å; Q50-N54 PolarHBondContact O-N 3.45Å; Q50-N54 PolarHBondContact O-OD1 2.86Å; Q50-M259 HydrophobicContact CB-SD 4.2Å; Q50-M259 PolarHBondContact OE1-SD 2.91Å
51	I	71.6	Confident	70.5	Confident	109 Å²	109	84.3 Å²	84.3	56%	0.559	43%	0.428	S	S	*	.	H	α-helix	trans	-60	-45.1	175.6	-69.1	164.9	0	0	0	110.1	R47 G48 I49 E53 N54 V55	R47-I51 VanDerWaalsContact O-CG1 3.28Å; R47-I51 WeakPolarHBondContact O-CG1 3.5Å; R47-I51 PolarHBondContact O-N 3.4Å; G48-I51 PolarHBondContact O-N 3.17Å; I49-I51 VanDerWaalsContact C-N 3.34Å; I49-I51 PolarHBondContact O-N 3.08Å; I51-E53 PolarHBondContact O-N 3.42Å; I51-N54 PolarHBondContact O-N 3.38Å; I51-V55 HydrophobicContact CG2-CG2 4.44Å; I51-V55 WeakPolarHBondContact O-CB 3.46Å; I51-V55 VanDerWaalsContact O-CG2 3.26Å; I51-V55 WeakPolarHBondContact O-CG2 3.09Å; I51-V55 PolarHBondContact O-N 3.35Å
52	R	68.6	Low	70.1	Confident	202 Å²	202	85 Å²	85	76%	0.762	43%	0.433	S	S	*	.	H	α-helix	trans	-62.7	-41.4	178.4	-176.4	-178.6	177.3	-173	-0.7	112.2	G48 I49 Q50 R56	G48-R52 WeakPolarHBondContact O-CB 3.47Å; G48-R52 PolarHBondContact O-N 2.91Å; I49-R52 WeakPolarHBondContact O-CB 3.41Å; I49-R52 PolarHBondContact O-N 2.92Å; I49-R52 VanDerWaalsContact O-N 3.1Å; Q50-R52 VanDerWaalsContact C-N 3.32Å; Q50-R52 PolarHBondContact O-N 3.45Å; R52-R56 WeakPolarHBondContact O-CB 3.34Å; R52-R56 PolarHBondContact O-N 2.8Å
53	E	70.2	Confident	69.5	Low	107 Å²	107	89.3 Å²	89.3	50%	0.5	46%	0.456	S	S	.	.	H	α-helix	trans	-66.2	-44.7	176.2	-73.3	-174.5	164.7	0	0	111.8	I49 Q50 I51 V55 R56 N57	I49-E53 HydrophobicContact CG2-CG 4.4Å; I49-E53 PolarHBondContact O-N 3.14Å; Q50-E53 PolarHBondContact O-N 2.92Å; I51-E53 PolarHBondContact O-N 3.42Å; E53-V55 VanDerWaalsContact C-N 3.34Å; E53-V55 PolarHBondContact O-N 2.71Å; E53-R56 WeakPolarHBondContact O-CB 3.49Å; E53-R56 PolarHBondContact O-N 2.76Å; E53-R56 VanDerWaalsContact O-N 3.14Å; E53-N57 WeakPolarHBondContact O-CB 3.34Å; E53-N57 VanDerWaalsContact O-CG 3.23Å; E53-N57 PolarHBondContact O-N 2.99Å
54	N	70.6	Confident	69	Low	79 Å²	79	92.7 Å²	92.7	42%	0.422	47%	0.471	S	S	.	.	H	α-helix	trans	-59.1	-45.4	175	-71.3	-5.8	0	0	0	111.1	Q50 I51 R56 N57 I58	Q50-N54 WeakPolarHBondContact O-CB 3.38Å; Q50-N54 PolarHBondContact O-N 3.45Å; Q50-N54 PolarHBondContact O-OD1 2.86Å; I51-N54 PolarHBondContact O-N 3.38Å; N54-R56 VanDerWaalsContact C-N 3.33Å; N54-R56 PolarHBondContact O-N 3.07Å; N54-N57 PolarHBondContact O-N 3.13Å; N54-I58 WeakPolarHBondContact O-CB 3.42Å; N54-I58 WeakPolarHBondContact O-CD1 3.09Å; N54-I58 WeakPolarHBondContact O-CG1 3.2Å; N54-I58 PolarHBondContact O-N 2.03Å
55	V	70.5	Confident	68.5	Low	94 Å²	94	96 Å²	96	57%	0.57	48%	0.482	S	S	*	.	H	α-helix	trans	-63.1	-39.5	176	171.4	0	0	0	0	111.4	I51 E53 G59	I51-V55 HydrophobicContact CG2-CG2 4.44Å; I51-V55 WeakPolarHBondContact O-CB 3.46Å; I51-V55 VanDerWaalsContact O-CG2 3.26Å; I51-V55 WeakPolarHBondContact O-CG2 3.09Å; I51-V55 PolarHBondContact O-N 3.35Å; E53-V55 VanDerWaalsContact C-N 3.34Å; E53-V55 PolarHBondContact O-N 2.71Å; V55-G59 PolarHBondContact O-N 3.44Å
56	R	64.6	Low	68.2	Low	197 Å²	197	96.3 Å²	96.3	74%	0.743	49%	0.49	S	S	*	.	H	α-helix	trans	-65.4	-42.9	176.1	-175	-177.9	177.6	-175.2	-0.9	111.6	R52 E53 N54 G59 A60	R52-R56 WeakPolarHBondContact O-CB 3.34Å; R52-R56 PolarHBondContact O-N 2.8Å; E53-R56 WeakPolarHBondContact O-CB 3.49Å; E53-R56 PolarHBondContact O-N 2.76Å; E53-R56 VanDerWaalsContact O-N 3.14Å; N54-R56 VanDerWaalsContact C-N 3.33Å; N54-R56 PolarHBondContact O-N 3.07Å; R56-G59 PolarHBondContact O-N 3.17Å; R56-A60 WeakPolarHBondContact O-CB 3.2Å; R56-A60 PolarHBondContact O-N 2.56Å
57	N	67.6	Low	67.8	Low	92 Å²	92	99.5 Å²	99.5	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-66.8	-43.7	178.6	-69.3	-12.8	0	0	0	110.9	E53 N54 G59 A60 Q61	E53-N57 WeakPolarHBondContact O-CB 3.34Å; E53-N57 VanDerWaalsContact O-CG 3.23Å; E53-N57 PolarHBondContact O-N 2.99Å; N54-N57 PolarHBondContact O-N 3.13Å; N57-G59 VanDerWaalsContact C-N 3.33Å; N57-G59 PolarHBondContact O-N 3.1Å; N57-A60 PolarHBondContact O-N 2.88Å; N57-Q61 WeakPolarHBondContact O-CB 3.42Å; N57-Q61 WeakPolarHBondContact O-CG 3.48Å; N57-Q61 PolarHBondContact O-N 3.32Å
58	I	71.7	Confident	67	Low	98 Å²	98	101 Å²	101	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-58.8	-46.2	171.4	-68.5	163.6	0	0	0	110	N54 A60 Q61 V62	N54-I58 WeakPolarHBondContact O-CB 3.42Å; N54-I58 WeakPolarHBondContact O-CD1 3.09Å; N54-I58 WeakPolarHBondContact O-CG1 3.2Å; N54-I58 PolarHBondContact O-N 2.03Å; I58-A60 VanDerWaalsContact C-N 3.32Å; I58-A60 PolarHBondContact O-N 2.9Å; I58-Q61 PolarHBondContact O-N 3.4Å; I58-V62 HydrophobicContact CG2-CG2 4.25Å; I58-V62 WeakPolarHBondContact O-CB 3.44Å; I58-V62 VanDerWaalsContact O-CG2 3.23Å; I58-V62 WeakPolarHBondContact O-CG2 3.47Å; I58-V62 PolarHBondContact O-N 3.32Å
59	G	61.1	Low	66.3	Low	40 Å²	40	101.6 Å²	101.6	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-39.3	176.5	0	0	0	0	0	113.1	V55 R56 N57 L63	V55-G59 PolarHBondContact O-N 3.44Å; R56-G59 PolarHBondContact O-N 3.17Å; N57-G59 VanDerWaalsContact C-N 3.33Å; N57-G59 PolarHBondContact O-N 3.1Å; G59-L63 VanDerWaalsContact O-CB 3.3Å; G59-L63 WeakPolarHBondContact O-CB 3.2Å; G59-L63 PolarHBondContact O-N 3.29Å
60	A	63.9	Low	65.7	Low	54 Å²	54	102 Å²	102	45%	0.446	53%	0.533	S	S	.	.	H	α-helix	trans	-67.7	-42.9	175.4	0	0	0	0	0	111.9	R56 N57 I58 L63 E64	R56-A60 WeakPolarHBondContact O-CB 3.2Å; R56-A60 PolarHBondContact O-N 2.56Å; N57-A60 PolarHBondContact O-N 2.88Å; I58-A60 VanDerWaalsContact C-N 3.32Å; I58-A60 PolarHBondContact O-N 2.9Å; A60-L63 PolarHBondContact O-N 2.96Å; A60-E64 WeakPolarHBondContact O-CB 3.32Å; A60-E64 PolarHBondContact O-N 3.04Å
61	Q	68	Low	64.7	Low	114 Å²	114	107.1 Å²	107.1	53%	0.533	55%	0.55	S	S	.	.	H	α-helix	trans	-62.9	-43.1	174.5	-74.4	174.5	-17.5	0	0	111.8	N57 I58 E64 Q65	N57-Q61 WeakPolarHBondContact O-CB 3.42Å; N57-Q61 WeakPolarHBondContact O-CG 3.48Å; N57-Q61 PolarHBondContact O-N 3.32Å; I58-Q61 PolarHBondContact O-N 3.4Å; Q61-E64 PolarHBondContact O-N 3.08Å; Q61-Q65 WeakPolarHBondContact O-CB 3.26Å; Q61-Q65 WeakPolarHBondContact O-CG 3.38Å; Q61-Q65 PolarHBondContact O-N 3.31Å
62	V	69	Low	63.6	Low	74 Å²	74	106.2 Å²	106.2	45%	0.448	55%	0.553	S	S	.	*	H	α-helix	trans	-64.3	-44.4	175.6	170.6	0	0	0	0	110.5	I58 E64 Q65 V66	I58-V62 HydrophobicContact CG2-CG2 4.25Å; I58-V62 WeakPolarHBondContact O-CB 3.44Å; I58-V62 VanDerWaalsContact O-CG2 3.23Å; I58-V62 WeakPolarHBondContact O-CG2 3.47Å; I58-V62 PolarHBondContact O-N 3.32Å; V62-E64 VanDerWaalsContact C-N 3.34Å; V62-E64 PolarHBondContact O-N 3.34Å; V62-Q65 PolarHBondContact O-N 2.98Å; V62-V66 HydrophobicContact CG1-CG2 4.32Å; V62-V66 WeakPolarHBondContact O-CB 3.48Å; V62-V66 VanDerWaalsContact O-CG2 3.23Å; V62-V66 WeakPolarHBondContact O-CG2 3.43Å; V62-V66 PolarHBondContact O-N 2.95Å
63	L	65.4	Low	62.7	Low	114 Å²	114	103.3 Å²	103.3	60%	0.597	55%	0.551	S	S	*	*	H	α-helix	trans	-61.8	-43.1	176.3	-172.1	71.7	0	0	0	111.1	G59 A60 V66 V67	G59-L63 VanDerWaalsContact O-CB 3.3Å; G59-L63 WeakPolarHBondContact O-CB 3.2Å; G59-L63 PolarHBondContact O-N 3.29Å; A60-L63 PolarHBondContact O-N 2.96Å; L63-V66 PolarHBondContact O-N 3.16Å; L63-V67 WeakPolarHBondContact O-CB 3.18Å; L63-V67 WeakPolarHBondContact O-CG2 3.4Å; L63-V67 PolarHBondContact O-N 3.33Å
64	E	64.2	Low	61.4	Low	102 Å²	102	105.4 Å²	105.4	48%	0.477	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-43.6	175.9	-168.2	-177.3	167.7	0	0	111.7	A60 Q61 V62 V67 R68	A60-E64 WeakPolarHBondContact O-CB 3.32Å; A60-E64 PolarHBondContact O-N 3.04Å; Q61-E64 PolarHBondContact O-N 3.08Å; V62-E64 VanDerWaalsContact C-N 3.34Å; V62-E64 PolarHBondContact O-N 3.34Å; E64-V67 PolarHBondContact O-N 3.17Å; E64-R68 WeakPolarHBondContact O-CB 3.4Å; E64-R68 WeakPolarHBondContact O-CG 3.21Å; E64-R68 PolarHBondContact O-N 3.06Å; E64-R68 IonicContact OE1-CZ 3.38Å; E64-R68 IonicContact OE1-NE 3.37Å; E64-R68 PolarHBondContact OE1-NE 3.18Å; E64-R68 IonicContact OE1-NH2 2.73Å; E64-R68 PolarHBondContact OE1-NH2 2.89Å
65	Q	66.4	Low	60.3	Low	141 Å²	141	105.2 Å²	105.2	66%	0.659	58%	0.582	S	S	*	*	H	α-helix	trans	-62.5	-41.7	174.8	-78.9	-178.3	-14.5	0	0	112.4	Q61 V62 R68 G69	Q61-Q65 WeakPolarHBondContact O-CB 3.26Å; Q61-Q65 WeakPolarHBondContact O-CG 3.38Å; Q61-Q65 PolarHBondContact O-N 3.31Å; V62-Q65 PolarHBondContact O-N 2.98Å; Q65-R68 PolarHBondContact O-N 3.33Å; Q65-G69 PolarHBondContact O-N 3.39Å
66	V	67.1	Low	58.8	Low	94 Å²	94	106.1 Å²	106.1	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-66.8	-41.9	176.7	170.7	0	0	0	0	111	V62 L63 G69 A70	V62-V66 HydrophobicContact CG1-CG2 4.32Å; V62-V66 WeakPolarHBondContact O-CB 3.48Å; V62-V66 VanDerWaalsContact O-CG2 3.23Å; V62-V66 WeakPolarHBondContact O-CG2 3.43Å; V62-V66 PolarHBondContact O-N 2.95Å; L63-V66 PolarHBondContact O-N 3.16Å; V66-G69 PolarHBondContact O-N 3.31Å; V66-A70 WeakPolarHBondContact O-CB 3.32Å; V66-A70 PolarHBondContact O-N 3.03Å
67	V	60.1	Low	57.6	Low	69 Å²	69	104.1 Å²	104.1	42%	0.418	59%	0.592	S	S	.	*	H	α-helix	trans	-62.9	-47	174.6	169.7	0	0	0	0	110.4	L63 E64 G69 A70 Y71	L63-V67 WeakPolarHBondContact O-CB 3.18Å; L63-V67 WeakPolarHBondContact O-CG2 3.4Å; L63-V67 PolarHBondContact O-N 3.33Å; E64-V67 PolarHBondContact O-N 3.17Å; V67-G69 VanDerWaalsContact C-N 3.31Å; V67-G69 PolarHBondContact O-N 3.33Å; V67-A70 PolarHBondContact O-N 2.98Å; V67-A70 VanDerWaalsContact O-N 3.15Å; V67-Y71 HydrophobicContact CG1-CD2 3.8Å; V67-Y71 HydrophobicContact CG1-CE2 3.92Å; V67-Y71 VanDerWaalsContact O-CD2 3.25Å; V67-Y71 WeakPolarHBondContact O-CD2 3.3Å; V67-Y71 PolarHBondContact O-N 2.9Å
68	R	58	Low	56.1	Low	156 Å²	156	109.1 Å²	109.1	59%	0.589	61%	0.606	S	S	*	*	H	α-helix	trans	-59	-40.4	173.7	-75.2	-176.3	-172.4	-166.8	4.9	112.1	E64 Q65 A70 Y71 S72	E64-R68 WeakPolarHBondContact O-CB 3.4Å; E64-R68 WeakPolarHBondContact O-CG 3.21Å; E64-R68 PolarHBondContact O-N 3.06Å; E64-R68 IonicContact OE1-CZ 3.38Å; E64-R68 IonicContact OE1-NE 3.37Å; E64-R68 PolarHBondContact OE1-NE 3.18Å; E64-R68 IonicContact OE1-NH2 2.73Å; E64-R68 PolarHBondContact OE1-NH2 2.89Å; Q65-R68 PolarHBondContact O-N 3.33Å; R68-A70 VanDerWaalsContact C-N 3.35Å; R68-A70 PolarHBondContact O-N 3.3Å; R68-Y71 PolarHBondContact O-N 3Å; R68-S72 PolarHBondContact O-N 2.78Å; R68-S72 VanDerWaalsContact O-N 3.17Å
69	G	54.6	Low	54.4	Low	52 Å²	52	109.1 Å²	109.1	54%	0.536	61%	0.614	S	S	.	*	H	α-helix	trans	-64.1	-35.9	175.2	0	0	0	0	0	113.5	Q65 V66 V67	Q65-G69 PolarHBondContact O-N 3.39Å; V66-G69 PolarHBondContact O-N 3.31Å; V67-G69 VanDerWaalsContact C-N 3.31Å; V67-G69 PolarHBondContact O-N 3.33Å
70	A	55.7	Low	53.2	Low	65 Å²	65	116.9 Å²	116.9	54%	0.537	63%	0.632	S	S	.	*	H	α-helix	trans	-74.5	-28.6	177.5	0	0	0	0	0	113.4	V66 V67 R68	V66-A70 WeakPolarHBondContact O-CB 3.32Å; V66-A70 PolarHBondContact O-N 3.03Å; V67-A70 PolarHBondContact O-N 2.98Å; V67-A70 VanDerWaalsContact O-N 3.15Å; R68-A70 VanDerWaalsContact C-N 3.35Å; R68-A70 PolarHBondContact O-N 3.3Å
71	Y	49.9	Very low	51.6	Low	197 Å²	197	121 Å²	121	77%	0.773	65%	0.647	S	S	*	*	H	α-helix	trans	-94.2	2.1	177.9	-75.2	-77	0	0	0	114.2	V67 R68 I73	V67-Y71 HydrophobicContact CG1-CD2 3.8Å; V67-Y71 HydrophobicContact CG1-CE2 3.92Å; V67-Y71 VanDerWaalsContact O-CD2 3.25Å; V67-Y71 WeakPolarHBondContact O-CD2 3.3Å; V67-Y71 PolarHBondContact O-N 2.9Å; R68-Y71 PolarHBondContact O-N 3Å; Y71-I73 PolarHBondContact O-N 3.07Å; Y71-I73 VanDerWaalsContact O-N 3.11Å
72	S	49.3	Very low	49.9	Very low	89 Å²	89	123.9 Å²	123.9	62%	0.622	66%	0.658	S	S	*	*			trans	-77.5	18.5	177.8	-169.5	0	0	0	0	114.4	R68 N74	R68-S72 PolarHBondContact O-N 2.78Å; R68-S72 VanDerWaalsContact O-N 3.17Å; S72-N74 PolarHBondContact O-N 3.05Å; S72-N74 VanDerWaalsContact O-N 3.1Å
73	I	48.3	Very low	48	Very low	142 Å²	142	126.6 Å²	126.6	73%	0.728	67%	0.67	S	S	*	*	S	Bend	trans	-87.9	66.5	171.9	-51.6	175.3	0	0	0	108.4	Y71	Y71-I73 PolarHBondContact O-N 3.07Å; Y71-I73 VanDerWaalsContact O-N 3.11Å
74	N	42.8	Very low	46.7	Very low	151 Å²	151	130.2 Å²	130.2	81%	0.807	68%	0.684	S	S	*	*	S	Bend	trans	163.9	103.3	151.3	-85.3	-19.1	0	0	0	108.3	S72 T76	S72-N74 PolarHBondContact O-N 3.05Å; S72-N74 VanDerWaalsContact O-N 3.1Å; N74-T76 PolarHBondContact O-N 3.44Å
75	G	47.8	Very low	45.6	Very low	74 Å²	74	129 Å²	129	76%	0.763	69%	0.687	S	S	*	*			trans	-54.7	124.7	-170.2	0	0	0	0	0	114.8
76	T	39.2	Very low	44.1	Very low	114 Å²	114	130.5 Å²	130.5	70%	0.699	69%	0.694	S	S	*	*			trans	-151.6	108.4	133.6	42.9	0	0	0	0	106.2	N74 Y78	N74-T76 PolarHBondContact O-N 3.44Å; T76-Y78 PolarHBondContact O-N 3.1Å
77	D	39.6	Very low	43.1	Very low	155 Å²	155	130.9 Å²	130.9	83%	0.829	70%	0.701	S	S	*	*			trans	-76.6	108.6	-179.3	-166.6	13.4	0	0	0	109.1
78	Y	36.5	Very low	42	Very low	197 Å²	197	135.5 Å²	135.5	77%	0.773	72%	0.723	S	S	*	*			trans	-107.7	97.5	164.5	-75.4	-78.2	0	0	0	107.2	T76 Y80	T76-Y78 PolarHBondContact O-N 3.1Å; Y78-Y80 PolarHBondContact O-N 3.48Å
79	S	35.1	Very low	41	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	72%	0.723	S	S	*	*			trans	-68.1	99.7	170.1	61.2	0	0	0	0	109.2	D81	S79-D81 PolarHBondContact O-N 3.31Å
80	Y	35.8	Very low	40.1	Very low	202 Å²	202	134.1 Å²	134.1	79%	0.792	73%	0.731	S	S	*	*			trans	-86.5	98.5	162.6	-121.9	-90.9	0	0	0	107.5	Y78 F82	Y78-Y80 PolarHBondContact O-N 3.48Å; Y80-F82 PolarHBondContact O-N 2.87Å; Y80-F82 VanDerWaalsContact O-N 3.13Å
81	D	30.5	Very low	39.3	Very low	142 Å²	142	137 Å²	137	76%	0.759	74%	0.744	S	S	*	*			trans	-63.1	108.3	167.6	-86	-25.3	0	0	0	108.5	S79 N83	S79-D81 PolarHBondContact O-N 3.31Å; D81-N83 VanDerWaalsContact C-N 3.26Å; D81-N83 PolarHBondContact O-N 3.39Å; D81-N83 VanDerWaalsContact O-N 3.11Å
82	F	33.1	Very low	39.1	Very low	173 Å²	173	131.4 Å²	131.4	76%	0.759	73%	0.73	S	S	*	*			trans	-79.4	82.9	162.2	-106.5	-90.6	0	0	0	107.9	Y80 E84	Y80-F82 PolarHBondContact O-N 2.87Å; Y80-F82 VanDerWaalsContact O-N 3.13Å; F82-E84 PolarHBondContact O-N 3.49Å
83	N	29	Very low	39.6	Very low	132 Å²	132	132.2 Å²	132.2	71%	0.706	73%	0.732	S	S	*	*			trans	-70	101.3	155.7	-104.6	-7.1	0	0	0	107.1	D81 S85	D81-N83 VanDerWaalsContact C-N 3.26Å; D81-N83 PolarHBondContact O-N 3.39Å; D81-N83 VanDerWaalsContact O-N 3.11Å; N83-S85 PolarHBondContact O-N 2.92Å
84	E	38.7	Very low	40.6	Very low	189 Å²	189	127.8 Å²	127.8	88%	0.883	71%	0.706	S	S	*	*			trans	-78.5	51	169.1	-134.4	-177.1	-161.8	0	0	110.2	F82	F82-E84 PolarHBondContact O-N 3.49Å
85	S	41	Very low	42	Very low	77 Å²	77	123 Å²	123	54%	0.538	68%	0.68	S	S	.	*			trans	-134.1	125.1	167.2	64.9	0	0	0	0	107.8	N83	N83-S85 PolarHBondContact O-N 2.92Å
86	E	34.9	Very low	43.2	Very low	173 Å²	173	123.6 Å²	123.6	81%	0.808	67%	0.671	S	S	*	*	S	Bend	trans	96.4	98.5	-179.9	-64.9	-168.9	151.5	0	0	116.7	D88	E86-D88 PolarHBondContact O-N 3.3Å
87	S	45.2	Very low	44.8	Very low	101 Å²	101	127 Å²	127	71%	0.706	68%	0.679	S	S	*	*				40	69.3	119	65.5	0	0	0	0	118.3
88	D	36.1	Very low	46.1	Very low	166 Å²	166	123.1 Å²	123.1	89%	0.888	68%	0.675	S	S	*	*			trans	-110.7	61	153.5	-84.1	-32.3	0	0	0	110.1	E86	E86-D88 PolarHBondContact O-N 3.3Å
89	A	38.4	Very low	47.8	Very low	71 Å²	71	118.4 Å²	118.4	59%	0.587	66%	0.659	S	S	*	*	S	Bend	trans	-75.3	132.1	147.8	0	0	0	0	0	106.1
90	P	35.2	Very low	49.6	Very low	108 Å²	108	119.7 Å²	119.7	70%	0.701	66%	0.663	S	S	*	*			trans	-50.8	140.4	172.7	22.1	-31.8	0	0	0	108.4	T92	P90-T92 PolarHBondContact O-N 3.01Å
91	P	39.8	Very low	51.7	Low	125 Å²	125	112 Å²	112	81%	0.812	63%	0.633	S	S	*	*			trans	-51	114.7	-177.2	20	-31.2	0	0	0	107.4	T93	P91-T93 PolarHBondContact O-N 3.13Å
92	T	45.5	Very low	54.3	Low	80 Å²	80	110.1 Å²	110.1	49%	0.491	62%	0.622	S	S	.	*			trans	-63.8	121.6	-169.4	48.7	0	0	0	0	107.8	P90 Y94	P90-T92 PolarHBondContact O-N 3.01Å; T92-Y94 VanDerWaalsContact CB-CE2 3.48Å; T92-Y94 HydrophobicContact CG2-CD2 4.43Å; T92-Y94 HydrophobicContact CG2-CE2 4.06Å; T92-Y94 PolarHBondContact O-N 3.02Å; T92-Y94 VanDerWaalsContact OG1-CD2 3.29Å; T92-Y94 WeakPolarHBondContact OG1-CD2 3.46Å
93	T	59.9	Low	57	Low	107 Å²	107	105.8 Å²	105.8	66%	0.656	61%	0.611	S	S	*	*			trans	-66	48.9	178.9	61.6	0	0	0	0	112.6	P91 K110	P91-T93 PolarHBondContact O-N 3.13Å; T93-K110 PolarHBondContact OG1-NZ 3.17Å
94	Y	67.8	Low	59.9	Low	49 Å²	49	103.7 Å²	103.7	19%	0.192	61%	0.607	C	S	.	*	P	Polyproline II helix	trans	-77	146.2	166.1	-71.3	-90.1	0	0	0	107.9	T92 K110 L111 M114 R237	T92-Y94 VanDerWaalsContact CB-CE2 3.48Å; T92-Y94 HydrophobicContact CG2-CD2 4.43Å; T92-Y94 HydrophobicContact CG2-CE2 4.06Å; T92-Y94 PolarHBondContact O-N 3.02Å; T92-Y94 VanDerWaalsContact OG1-CD2 3.29Å; T92-Y94 WeakPolarHBondContact OG1-CD2 3.46Å; Y94-K110 HydrophobicContact CD1-CB 3.63Å; Y94-K110 HydrophobicContact CD1-CG 4.46Å; Y94-K110 HydrophobicContact CE1-CB 3.69Å; Y94-K110 HydrophobicContact CE1-CD 4.48Å; Y94-K110 HydrophobicContact CE1-CG 4.08Å; Y94-K110 HydrophobicContact CG-CB 4.25Å; Y94-L111 WeakPolarHBondContact CD1-O 3.46Å; Y94-M114 HydrophobicContact CE1-CB 4.34Å; Y94-M114 HydrophobicContact CE1-SD 4.49Å; Y94-R237 HydrophobicContact CE1-CG 4.23Å; Y94-R237 WeakPolarHBondContact OH-CB 2.89Å; Y94-R237 WeakPolarHBondContact OH-CD 3.49Å; Y94-R237 WeakPolarHBondContact OH-CG 3.46Å
95	L	73.4	Confident	62.5	Low	49 Å²	49	98.9 Å²	98.9	26%	0.257	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-61.2	151.4	174.1	-66.9	165.2	0	0	0	109.9	F99 P108 P112	L95-F99 HydrophobicContact CB-CB 3.94Å; L95-F99 HydrophobicContact CB-CD1 4.31Å; L95-F99 HydrophobicContact CB-CG 4.06Å; L95-F99 HydrophobicContact CD1-CD1 3.55Å; L95-F99 HydrophobicContact CD1-CE1 3.79Å; L95-F99 HydrophobicContact CD1-CG 4.13Å; L95-F99 HydrophobicContact CD2-CD1 4.11Å; L95-F99 HydrophobicContact CD2-CD2 4.04Å; L95-F99 HydrophobicContact CD2-CE1 4.11Å; L95-F99 HydrophobicContact CD2-CE2 4.05Å; L95-F99 HydrophobicContact CD2-CG 4.06Å; L95-F99 HydrophobicContact CD2-CZ 4.08Å; L95-F99 HydrophobicContact CG-CD1 4.21Å; L95-F99 HydrophobicContact CG-CG 4.31Å; L95-P108 HydrophobicContact CD1-CB 3.41Å; L95-P108 VanDerWaalsContact CD1-CB 3.41Å; L95-P108 HydrophobicContact CD1-CG 3.37Å; L95-P112 HydrophobicContact CB-CG 4.22Å; L95-P112 WeakPolarHBondContact O-CG 3.08Å
96	P	72.9	Confident	65	Low	87 Å²	87	98.9 Å²	98.9	57%	0.565	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-63	153.2	175.7	25	-31.9	0	0	0	110.9	G98 F99	P96-G98 PolarHBondContact O-N 2.96Å; P96-F99 HydrophobicContact CG-CB 4.26Å; P96-F99 HydrophobicContact CG-CD2 4.45Å; P96-F99 WeakPolarHBondContact O-CB 3.26Å; P96-F99 PolarHBondContact O-N 2.9Å; P96-F99 VanDerWaalsContact O-N 3.11Å
97	E	71.9	Confident	67.8	Low	186 Å²	186	90.7 Å²	90.7	87%	0.869	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	134.8	172.2	-68.2	-169.1	168.6	0	0	110.2	F99 P112	E97-F99 VanDerWaalsContact C-N 3.34Å; E97-P112 HydrophobicContact CG-CB 4.47Å
98	G	67.8	Low	69.9	Low	73 Å²	73	86.9 Å²	86.9	75%	0.753	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	3.5	-176.1	0	0	0	0	0	115.3	P96 T100	P96-G98 PolarHBondContact O-N 2.96Å; G98-T100 PolarHBondContact O-N 3.4Å
99	F	72.3	Confident	72.4	Confident	98 Å²	98	81.8 Å²	81.8	43%	0.43	49%	0.487	S	S	.	.			trans	-59.7	121.4	169.9	-174.1	-89.1	0	0	0	110.6	L95 P96 E97 Y101	L95-F99 HydrophobicContact CB-CB 3.94Å; L95-F99 HydrophobicContact CB-CD1 4.31Å; L95-F99 HydrophobicContact CB-CG 4.06Å; L95-F99 HydrophobicContact CD1-CD1 3.55Å; L95-F99 HydrophobicContact CD1-CE1 3.79Å; L95-F99 HydrophobicContact CD1-CG 4.13Å; L95-F99 HydrophobicContact CD2-CD1 4.11Å; L95-F99 HydrophobicContact CD2-CD2 4.04Å; L95-F99 HydrophobicContact CD2-CE1 4.11Å; L95-F99 HydrophobicContact CD2-CE2 4.05Å; L95-F99 HydrophobicContact CD2-CG 4.06Å; L95-F99 HydrophobicContact CD2-CZ 4.08Å; L95-F99 HydrophobicContact CG-CD1 4.21Å; L95-F99 HydrophobicContact CG-CG 4.31Å; P96-F99 HydrophobicContact CG-CB 4.26Å; P96-F99 HydrophobicContact CG-CD2 4.45Å; P96-F99 WeakPolarHBondContact O-CB 3.26Å; P96-F99 PolarHBondContact O-N 2.9Å; P96-F99 VanDerWaalsContact O-N 3.11Å; E97-F99 VanDerWaalsContact C-N 3.34Å; F99-Y101 HydrophobicContact CD1-CD1 4.2Å; F99-Y101 HydrophobicContact CE1-CD1 4.3Å
100	T	71.9	Confident	74.7	Confident	125 Å²	125	82.7 Å²	82.7	77%	0.767	48%	0.477	S	S	*	.			trans	-106.1	140	177	55.1	0	0	0	0	110.1	G98	G98-T100 PolarHBondContact O-N 3.4Å
101	Y	80	Confident	77.2	Confident	40 Å²	40	77.8 Å²	77.8	16%	0.157	45%	0.445	C	S	.	.			trans	-123.1	154.7	172.5	46	-100.2	0	0	0	108.9	F99 P108 L111 D151 C152 R186	F99-Y101 HydrophobicContact CD1-CD1 4.2Å; F99-Y101 HydrophobicContact CE1-CD1 4.3Å; Y101-P108 HydrophobicContact CD1-CG 3.8Å; Y101-P108 HydrophobicContact CE1-CG 4.08Å; Y101-L111 HydrophobicContact CE1-CD2 3.67Å; Y101-D151 WeakPolarHBondContact CD2-O 3.43Å; Y101-D151 HydrophobicContact CE2-CB 4.18Å; Y101-D151 WeakPolarHBondContact CE2-O 3.26Å; Y101-D151 WeakPolarHBondContact CE2-OD2 3.31Å; Y101-D151 PolarHBondContact OH-OD2 3.26Å; Y101-C152 HydrophobicContact CD2-CB 3.55Å; Y101-C152 HydrophobicContact CE2-CB 3.44Å; Y101-C152 VanDerWaalsContact CE2-CB 3.44Å; Y101-C152 WeakPolarHBondContact CE2-SG 3.44Å; Y101-R186 PolarHBondContact OH-NE 3.21Å
102	L	86.6	Confident	79.3	Confident	104 Å²	104	74 Å²	74	55%	0.545	42%	0.42	S	S	.	.			trans	-82.8	151.6	-179.7	-62.6	173.2	0	0	0	110.8	S104 Q105 D151	L102-S104 PolarHBondContact O-N 3.45Å; L102-Q105 HydrophobicContact CB-CG 4.13Å; L102-Q105 WeakPolarHBondContact O-CB 2.97Å; L102-Q105 PolarHBondContact O-N 2.92Å; L102-D151 CarbonylContact C-O 3.54Å
103	P	88.9	Confident	81.2	Confident	81 Å²	81	72.6 Å²	72.6	53%	0.526	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.4	173.7	-28.4	36.2	0	0	0	115	D151 C152 L153	P103-D151 VanDerWaalsContact CA-O 3.3Å; P103-D151 WeakPolarHBondContact CA-O 3.42Å; P103-C152 CarbonylContact O-C 3.54Å; P103-L153 PolarHBondContact O-N 3.25Å
104	S	90.3	Very high	82.7	Confident	88 Å²	88	67.6 Å²	67.6	62%	0.615	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.8	176.4	55.9	0	0	0	0	114.5	L102 L153	L102-S104 PolarHBondContact O-N 3.45Å; S104-L153 VanDerWaalsContact O-CD1 3.23Å; S104-L153 WeakPolarHBondContact O-CD1 3.44Å
105	Q	92.8	Very high	83.7	Confident	89 Å²	89	73.5 Å²	73.5	42%	0.416	41%	0.41	S	S	.	.	S	Bend	trans	-92.6	149.8	-179.3	-69.4	174.8	-33.3	0	0	111	L102 C152 L153	L102-Q105 HydrophobicContact CB-CG 4.13Å; L102-Q105 WeakPolarHBondContact O-CB 2.97Å; L102-Q105 PolarHBondContact O-N 2.92Å; Q105-C152 WeakPolarHBondContact O-CB 3.14Å; Q105-L153 PolarHBondContact O-N 3.46Å
106	V	93.8	Very high	84.6	Confident	77 Å²	77	71.4 Å²	71.4	47%	0.467	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-66.6	133.6	175.2	-179.5	0	0	0	0	109.7	L153 R155	V106-L153 CarbonylContact C-O 3.47Å; V106-L153 WeakPolarHBondContact CA-O 3.05Å; V106-R155 HydrophobicContact CG1-CB 3.81Å; V106-R155 HydrophobicContact CG1-CG 4.21Å
107	C	92.6	Very high	85.6	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-56.3	134.5	178.7	-56.6	0	0	0	0	111	C152 L153 R155 R186	C107-C152 HydrophobicContact CB-CB 3.98Å; C107-C152 WeakPolarHBondContact CB-SG 3.44Å; C107-C152 WeakPolarHBondContact SG-CB 3.49Å; C107-C152 CovalentContact SG-SG 2.03Å; C107-C152 PolarHBondContact SG-SG 2.89Å; C107-L153 PolarHBondContact N-O 3.05Å; C107-L153 VanDerWaalsContact SG-C 3.5Å; C107-L153 PolarHBondContact SG-O 2.77Å; C107-R155 PolarHBondContact O-NE 3.21Å; C107-R186 HydrophobicContact CB-CB 3.94Å
108	P	90.4	Very high	86.7	Confident	21 Å²	21	69.3 Å²	69.3	14%	0.136	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-60.8	142.1	170	-21.7	32.4	0	0	0	111.5	L95 Y101 L111	L95-P108 HydrophobicContact CD1-CB 3.41Å; L95-P108 VanDerWaalsContact CD1-CB 3.41Å; L95-P108 HydrophobicContact CD1-CG 3.37Å; Y101-P108 HydrophobicContact CD1-CG 3.8Å; Y101-P108 HydrophobicContact CE1-CG 4.08Å; P108-L111 HydrophobicContact CB-CD2 4Å; P108-L111 HydrophobicContact CB-CG 4.38Å; P108-L111 HydrophobicContact CG-CD2 4Å
109	E	87.8	Confident	87.9	Confident	60 Å²	60	74.7 Å²	74.7	28%	0.28	38%	0.38	S	S	.	.	S	Bend	trans	-74.7	-28.9	176.6	178.1	164.9	-178.8	0	0	112.5	Y239 T243	E109-Y239 HydrophobicContact CG-CD1 3.73Å; E109-Y239 HydrophobicContact CG-CE1 3.62Å; E109-Y239 HydrophobicContact CG-CG 4.29Å; E109-T243 WeakPolarHBondContact OE1-CB 3.39Å; E109-T243 PolarHBondContact OE1-OG1 3.23Å
110	K	88	Confident	89	Confident	89 Å²	89	71.1 Å²	71.1	39%	0.387	37%	0.366	S	S	.	.	S	Bend	trans	-118.9	103.4	-179.2	-67.4	-176.5	-172.4	176.5	0	109.5	T93 Y94	T93-K110 PolarHBondContact OG1-NZ 3.17Å; Y94-K110 HydrophobicContact CD1-CB 3.63Å; Y94-K110 HydrophobicContact CD1-CG 4.46Å; Y94-K110 HydrophobicContact CE1-CB 3.69Å; Y94-K110 HydrophobicContact CE1-CD 4.48Å; Y94-K110 HydrophobicContact CE1-CG 4.08Å; Y94-K110 HydrophobicContact CG-CB 4.25Å
111	L	86.8	Confident	90	Very high	5 Å²	5	68.7 Å²	68.7	3%	0.026	35%	0.349	C	S	.	.			trans	-102.8	145.3	-177.5	-70.9	158.9	0	0	0	111.7	Y94 Y101 P108 S113 M114 K184 R186	Y94-L111 WeakPolarHBondContact CD1-O 3.46Å; Y101-L111 HydrophobicContact CE1-CD2 3.67Å; P108-L111 HydrophobicContact CB-CD2 4Å; P108-L111 HydrophobicContact CB-CG 4.38Å; P108-L111 HydrophobicContact CG-CD2 4Å; L111-S113 WeakPolarHBondContact CB-OG 3.34Å; L111-S113 PolarHBondContact O-N 2.92Å; L111-M114 HydrophobicContact CB-CG 4.21Å; L111-M114 HydrophobicContact CB-SD 4.08Å; L111-M114 PolarHBondContact N-SD 3.46Å; L111-M114 VanDerWaalsContact N-SD 3.43Å; L111-M114 WeakPolarHBondContact O-CB 3.14Å; L111-M114 PolarHBondContact O-N 2.99Å; L111-K184 WeakPolarHBondContact CD1-O 3.43Å; L111-R186 HydrophobicContact CD1-CB 4.11Å; L111-R186 HydrophobicContact CD1-CG 3.28Å
112	P	83.9	Confident	90.7	Very high	45 Å²	45	69 Å²	69	29%	0.292	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.8	175.9	-8	16.5	0	0	0	112.5	L95 E97 M114	L95-P112 HydrophobicContact CB-CG 4.22Å; L95-P112 WeakPolarHBondContact O-CG 3.08Å; E97-P112 HydrophobicContact CG-CB 4.47Å; P112-M114 PolarHBondContact O-N 3.08Å
113	S	86.4	Confident	91.1	Very high	51 Å²	51	67.7 Å²	67.7	36%	0.357	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-14	176.1	54.5	0	0	0	0	114.2	L111 K115	L111-S113 WeakPolarHBondContact CB-OG 3.34Å; L111-S113 PolarHBondContact O-N 2.92Å; S113-K115 PolarHBondContact O-N 3Å
114	M	90.6	Very high	91.2	Very high	2 Å²	2	70.8 Å²	70.8	1%	0.01	36%	0.359	C	S	.	.			trans	-85	93.9	176.5	-59	166	71.9	0	0	109.2	Y94 L111 P112 G116 Q185 D236 R237 Y239	Y94-M114 HydrophobicContact CE1-CB 4.34Å; Y94-M114 HydrophobicContact CE1-SD 4.49Å; L111-M114 HydrophobicContact CB-CG 4.21Å; L111-M114 HydrophobicContact CB-SD 4.08Å; L111-M114 PolarHBondContact N-SD 3.46Å; L111-M114 VanDerWaalsContact N-SD 3.43Å; L111-M114 WeakPolarHBondContact O-CB 3.14Å; L111-M114 PolarHBondContact O-N 2.99Å; P112-M114 PolarHBondContact O-N 3.08Å; M114-G116 PolarHBondContact O-N 3.42Å; M114-Q185 HydrophobicContact CE-CG 4.15Å; M114-D236 WeakPolarHBondContact CA-OD1 3.36Å; M114-D236 WeakPolarHBondContact CE-O 3.4Å; M114-R237 HydrophobicContact CB-CG 3.99Å; M114-R237 HydrophobicContact CE-CB 4.45Å; M114-R237 HydrophobicContact CE-CG 4.42Å; M114-R237 PolarHBondContact O-NE 2.64Å; M114-R237 PolarHBondContact O-NH2 3.31Å; M114-R237 VanDerWaalsContact O-NH2 3.17Å; M114-Y239 HydrophobicContact CE-CD2 4.48Å
115	K	89.6	Confident	91.4	Very high	174 Å²	174	68 Å²	68	76%	0.757	34%	0.337	S	S	*	.			trans	-77.7	-8.5	-170.9	-66.6	-171.6	175.6	-172.2	0	113.4	S113 D236	S113-K115 PolarHBondContact O-N 3Å; K115-D236 PolarHBondContact N-OD1 3.32Å; K115-D236 VanDerWaalsContact N-OD1 3.1Å; K115-D236 PolarHBondContact N-OD2 3.29Å; K115-D236 VanDerWaalsContact N-OD2 3.17Å
116	G	91.8	Very high	91.6	Very high	4 Å²	4	66.3 Å²	66.3	4%	0.041	34%	0.335	C	S	.	.	S	Bend	trans	91.4	-115.5	-175.3	0	0	0	0	0	110.6	M114 L118 N235 D236	M114-G116 PolarHBondContact O-N 3.42Å; G116-L118 PolarHBondContact O-N 3.42Å; G116-N235 VanDerWaalsContact C-OD1 3.31Å; G116-N235 WeakPolarHBondContact CA-OD1 3.36Å; G116-N235 CarbonylContact O-C 3.56Å; G116-N235 VanDerWaalsContact O-CA 3.26Å; G116-N235 WeakPolarHBondContact O-CA 3.38Å; G116-N235 PolarHBondContact O-OD1 3.48Å; G116-D236 WeakPolarHBondContact CA-OD1 3.2Å; G116-D236 PolarHBondContact N-OD1 2.87Å; G116-D236 PolarHBondContact O-N 2.86Å
117	R	94	Very high	91.7	Very high	203 Å²	203	64.9 Å²	64.9	77%	0.766	32%	0.324	S	S	*	.	B	Isolated β-bridge	trans	-57.8	131.8	-173.3	-168.9	174.6	-176.6	-176.4	-0.5	111.7	E234	R117-E234 CarbonylContact C-O 3.58Å; R117-E234 WeakPolarHBondContact CA-O 3.48Å
118	L	94.8	Very high	91.8	Very high	26 Å²	26	71.2 Å²	71.2	14%	0.136	35%	0.354	C	S	.	.			trans	-105.8	144.8	177.6	-63.3	173.7	0	0	0	110.1	G116 V181 M233 E234 D236	G116-L118 PolarHBondContact O-N 3.42Å; L118-V181 HydrophobicContact CD1-CG2 3.59Å; L118-M233 HydrophobicContact CD1-CG 4.05Å; L118-E234 PolarHBondContact N-O 2.85Å; L118-D236 HydrophobicContact CD1-CB 4.04Å; L118-D236 HydrophobicContact CD2-CB 3.99Å; L118-D236 HydrophobicContact CG-CB 4.18Å
119	E	93.3	Very high	92	Very high	186 Å²	186	74.5 Å²	74.5	87%	0.869	37%	0.367	S	S	*	.			trans	-81	123.2	163.9	-172.5	-179.2	175.4	0	0	108.6
120	V	94.1	Very high	92.4	Very high	24 Å²	24	71.6 Å²	71.6	15%	0.145	35%	0.354	C	S	.	.			trans	-96.3	107.8	-178.1	-177.9	0	0	0	0	109.2	M122 L232 E234 M319	V120-M122 HydrophobicContact CG1-CE 4.04Å; V120-M122 HydrophobicContact CG1-CG 4.08Å; V120-L232 HydrophobicContact CG1-CB 3.73Å; V120-L232 HydrophobicContact CG1-CD1 3.41Å; V120-L232 VanDerWaalsContact CG1-CD1 3.41Å; V120-L232 HydrophobicContact CG1-CG 4.21Å; V120-E234 HydrophobicContact CG2-CG 4.16Å; V120-M319 HydrophobicContact CB-SD 3.74Å; V120-M319 HydrophobicContact CG1-CB 4.36Å; V120-M319 HydrophobicContact CG1-SD 4.16Å; V120-M319 HydrophobicContact CG2-CG 4.37Å; V120-M319 HydrophobicContact CG2-SD 3.94Å
121	N	94.4	Very high	92.7	Very high	74 Å²	74	70 Å²	70	40%	0.396	35%	0.348	S	S	.	.			trans	-91.7	110.3	175.3	-176.6	-13.1	0	0	0	110.4	S123 R176	N121-S123 VanDerWaalsContact OD1-CB 3.25Å; N121-S123 WeakPolarHBondContact OD1-CB 3.22Å; N121-S123 PolarHBondContact OD1-N 2.82Å; N121-S123 PolarHBondContact OD1-OG 2.79Å; N121-R176 PolarHBondContact O-NH2 3.45Å; N121-R176 PolarHBondContact OD1-NH2 2.92Å; N121-R176 VanDerWaalsContact OD1-NH2 3.14Å
122	M	94.3	Very high	93.1	Very high	46 Å²	46	76.3 Å²	76.3	23%	0.227	37%	0.371	C	S	.	.			trans	-97.4	5.9	178.6	-64.2	-175.2	170.2	0	0	114.1	V120 E124 I173 L232 M319	V120-M122 HydrophobicContact CG1-CE 4.04Å; V120-M122 HydrophobicContact CG1-CG 4.08Å; M122-E124 PolarHBondContact O-N 3.12Å; M122-I173 WeakPolarHBondContact O-CD1 3.43Å; M122-L232 HydrophobicContact CE-CD1 4.24Å; M122-L232 HydrophobicContact CG-CD1 4.1Å; M122-M319 HydrophobicContact CE-CB 3.31Å; M122-M319 HydrophobicContact CE-CE 3.83Å; M122-M319 HydrophobicContact CE-CG 4.37Å; M122-M319 HydrophobicContact CE-SD 4.31Å; M122-M319 HydrophobicContact SD-CE 4.45Å
123	S	94	Very high	93.6	Very high	76 Å²	76	76.4 Å²	76.4	53%	0.531	37%	0.373	S	S	.	.			trans	-63.8	130.9	178.9	-59	0	0	0	0	110.5	N121 R176	N121-S123 VanDerWaalsContact OD1-CB 3.25Å; N121-S123 WeakPolarHBondContact OD1-CB 3.22Å; N121-S123 PolarHBondContact OD1-N 2.82Å; N121-S123 PolarHBondContact OD1-OG 2.79Å; S123-R176 PolarHBondContact O-NH1 3.4Å; S123-R176 PolarHBondContact O-NH2 2.94Å
124	E	92.3	Very high	93.9	Very high	146 Å²	146	74.4 Å²	74.4	68%	0.682	36%	0.358	S	S	*	.			trans	-53.9	141.4	175.6	-70.9	175.3	-152.9	0	0	111.1	M122	M122-E124 PolarHBondContact O-N 3.12Å
125	I	94.6	Very high	93.9	Very high	31 Å²	31	76.2 Å²	76.2	16%	0.159	37%	0.368	C	S	.	.			trans	-154.1	145	-177.6	-172.4	166.5	0	0	0	108.5	E129 V130 P172	I125-E129 HydrophobicContact CD1-CB 4.19Å; I125-E129 HydrophobicContact CD1-CG 3.9Å; I125-E129 HydrophobicContact CG1-CB 3.93Å; I125-E129 HydrophobicContact CG1-CG 4.1Å; I125-V130 HydrophobicContact CB-CG2 4.27Å; I125-V130 HydrophobicContact CD1-CG2 3.87Å; I125-V130 HydrophobicContact CG1-CG2 3.92Å; I125-V130 HydrophobicContact CG2-CG2 3.42Å; I125-V130 VanDerWaalsContact CG2-CG2 3.42Å; I125-P172 HydrophobicContact CG2-CB 3.93Å; I125-P172 WeakPolarHBondContact O-CB 3.26Å; I125-P172 WeakPolarHBondContact O-CG 3.42Å
126	S	96.1	Very high	94	Very high	52 Å²	52	75 Å²	75	36%	0.364	37%	0.365	S	S	.	.			trans	-71.8	152.7	177.2	67.4	0	0	0	0	111.2	E128 E129 V130	S126-E128 WeakPolarHBondContact CB-OE2 3.32Å; S126-E128 PolarHBondContact O-N 3.06Å; S126-E129 PolarHBondContact O-N 2.96Å; S126-E129 WeakPolarHBondContact OG-CB 3.43Å; S126-E129 PolarHBondContact OG-N 2.91Å; S126-V130 WeakPolarHBondContact O-CG2 3.48Å; S126-V130 PolarHBondContact O-N 3.27Å; S126-V130 VanDerWaalsContact O-N 3.14Å
127	L	95	Very high	93.7	Very high	48 Å²	48	83 Å²	83	25%	0.251	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-36.2	178.5	-175.3	61.5	0	0	0	111.3	E129 V130 E131 P172 L175 L364 F365	L127-E129 PolarHBondContact O-N 2.91Å; L127-V130 PolarHBondContact O-N 2.89Å; L127-E131 WeakPolarHBondContact O-CB 3.29Å; L127-E131 PolarHBondContact O-N 3.19Å; L127-P172 HydrophobicContact CB-CG 4.16Å; L127-P172 HydrophobicContact CD1-CG 4.39Å; L127-L175 HydrophobicContact CD1-CD1 3.64Å; L127-L364 HydrophobicContact CD1-CD1 4.35Å; L127-F365 HydrophobicContact CD1-CE1 4.16Å; L127-F365 HydrophobicContact CD2-CE1 3.98Å; L127-F365 HydrophobicContact CD2-CZ 4.16Å
128	E	95.1	Very high	93	Very high	133 Å²	133	76.1 Å²	76.1	62%	0.621	37%	0.37	S	S	*	.	H	α-helix	trans	-65.2	-37.5	179.5	-61.9	74.9	-163.5	0	0	112.1	S126 R132	S126-E128 WeakPolarHBondContact CB-OE2 3.32Å; S126-E128 PolarHBondContact O-N 3.06Å; E128-R132 WeakPolarHBondContact O-CB 3.25Å; E128-R132 PolarHBondContact O-N 2.99Å
129	E	95.8	Very high	92.4	Very high	89 Å²	89	79.6 Å²	79.6	42%	0.416	39%	0.394	S	S	.	.	H	α-helix	trans	-72.9	-37.8	176.6	-170.5	174.1	172.5	0	0	112	I125 S126 L127 S133	I125-E129 HydrophobicContact CD1-CB 4.19Å; I125-E129 HydrophobicContact CD1-CG 3.9Å; I125-E129 HydrophobicContact CG1-CB 3.93Å; I125-E129 HydrophobicContact CG1-CG 4.1Å; S126-E129 PolarHBondContact O-N 2.96Å; S126-E129 WeakPolarHBondContact OG-CB 3.43Å; S126-E129 PolarHBondContact OG-N 2.91Å; L127-E129 PolarHBondContact O-N 2.91Å; E129-S133 WeakPolarHBondContact O-CB 3.34Å; E129-S133 PolarHBondContact O-N 2.82Å; E129-S133 PolarHBondContact O-OG 2.78Å
130	V	95.8	Very high	92	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-45.8	171.9	176.2	0	0	0	0	111	I125 S126 L127 S133 L134 P172 L175 R176 L364	I125-V130 HydrophobicContact CB-CG2 4.27Å; I125-V130 HydrophobicContact CD1-CG2 3.87Å; I125-V130 HydrophobicContact CG1-CG2 3.92Å; I125-V130 HydrophobicContact CG2-CG2 3.42Å; I125-V130 VanDerWaalsContact CG2-CG2 3.42Å; S126-V130 WeakPolarHBondContact O-CG2 3.48Å; S126-V130 PolarHBondContact O-N 3.27Å; S126-V130 VanDerWaalsContact O-N 3.14Å; L127-V130 PolarHBondContact O-N 2.89Å; V130-S133 WeakPolarHBondContact CA-OG 3.01Å; V130-S133 PolarHBondContact O-N 2.92Å; V130-S133 PolarHBondContact O-OG 2.96Å; V130-L134 HydrophobicContact CG1-CD1 3.71Å; V130-L134 HydrophobicContact CG1-CG 4.22Å; V130-L134 WeakPolarHBondContact O-CB 3.3Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 3.41Å; V130-L134 PolarHBondContact O-N 2.52Å; V130-P172 HydrophobicContact CG2-CB 3.91Å; V130-L175 HydrophobicContact CG1-CB 4.11Å; V130-R176 HydrophobicContact CG1-CB 3.98Å; V130-R176 HydrophobicContact CG2-CB 4.07Å; V130-L364 HydrophobicContact CG1-CD1 3.98Å
131	E	94.8	Very high	91.8	Very high	54 Å²	54	71.5 Å²	71.5	25%	0.252	36%	0.358	S	S	.	.	H	α-helix	trans	-59.7	-49.3	177.2	-177.9	168.5	157.7	0	0	111.6	L127 L134 L135 R363 L364	L127-E131 WeakPolarHBondContact O-CB 3.29Å; L127-E131 PolarHBondContact O-N 3.19Å; E131-L134 PolarHBondContact O-N 3.06Å; E131-L135 HydrophobicContact CG-CD1 3.63Å; E131-L135 HydrophobicContact CG-CG 4.3Å; E131-L135 VanDerWaalsContact O-CB 3.32Å; E131-L135 WeakPolarHBondContact O-CB 3.49Å; E131-L135 WeakPolarHBondContact O-CG 3.31Å; E131-L135 PolarHBondContact O-N 2.87Å; E131-R363 HydrophobicContact CG-CB 4.22Å; E131-R363 VanDerWaalsContact OE1-CB 3.28Å; E131-R363 WeakPolarHBondContact OE1-CB 3.47Å; E131-R363 WeakPolarHBondContact OE1-CG 3.29Å; E131-L364 HydrophobicContact CB-CD1 3.89Å; E131-L364 HydrophobicContact CB-CG 4.12Å; E131-L364 HydrophobicContact CG-CD1 4.47Å; E131-L364 HydrophobicContact CG-CG 4.15Å
132	R	94.3	Very high	91.6	Very high	138 Å²	138	70 Å²	70	52%	0.521	36%	0.355	S	S	.	.	H	α-helix	trans	-57.8	-51.9	176.8	173.6	168	34.8	116.4	2.9	112.2	E128 L134 L135 E136	E128-R132 WeakPolarHBondContact O-CB 3.25Å; E128-R132 PolarHBondContact O-N 2.99Å; R132-L134 PolarHBondContact O-N 3.28Å; R132-L135 PolarHBondContact O-N 3.26Å; R132-E136 HydrophobicContact CG-CG 4.48Å; R132-E136 VanDerWaalsContact CG-OE1 3.25Å; R132-E136 WeakPolarHBondContact CG-OE1 3.48Å; R132-E136 WeakPolarHBondContact O-CB 3.38Å; R132-E136 VanDerWaalsContact O-CG 3.32Å; R132-E136 WeakPolarHBondContact O-CG 3.42Å; R132-E136 PolarHBondContact O-N 2.79Å
133	S	94.6	Very high	91.6	Very high	48 Å²	48	73 Å²	73	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-38	-178.2	60.1	0	0	0	0	113.5	E129 V130 R137	E129-S133 WeakPolarHBondContact O-CB 3.34Å; E129-S133 PolarHBondContact O-N 2.82Å; E129-S133 PolarHBondContact O-OG 2.78Å; V130-S133 WeakPolarHBondContact CA-OG 3.01Å; V130-S133 PolarHBondContact O-N 2.92Å; V130-S133 PolarHBondContact O-OG 2.96Å; S133-R137 WeakPolarHBondContact O-CB 3.28Å; S133-R137 PolarHBondContact O-N 2.71Å
134	L	93.6	Very high	91.6	Very high	9 Å²	9	69.5 Å²	69.5	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-70.8	-39.1	176.8	-70.7	177.4	0	0	0	112.1	V130 E131 R132 R137 E138 V179 P180 L364	V130-L134 HydrophobicContact CG1-CD1 3.71Å; V130-L134 HydrophobicContact CG1-CG 4.22Å; V130-L134 WeakPolarHBondContact O-CB 3.3Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 3.41Å; V130-L134 PolarHBondContact O-N 2.52Å; E131-L134 PolarHBondContact O-N 3.06Å; R132-L134 PolarHBondContact O-N 3.28Å; L134-R137 PolarHBondContact O-N 3.13Å; L134-E138 PolarHBondContact O-N 3.13Å; L134-V179 HydrophobicContact CD1-CB 4.01Å; L134-V179 HydrophobicContact CD1-CG1 4.17Å; L134-V179 HydrophobicContact CD1-CG2 4.21Å; L134-V179 HydrophobicContact CD2-CB 4.48Å; L134-V179 HydrophobicContact CD2-CG1 4.44Å; L134-P180 HydrophobicContact CD2-CG 3.69Å; L134-L364 HydrophobicContact CB-CD2 4.31Å; L134-L364 HydrophobicContact CD1-CD1 4.09Å; L134-L364 HydrophobicContact CD1-CD2 3.84Å
135	L	90.5	Very high	91.8	Very high	40 Å²	40	62.5 Å²	62.5	21%	0.209	32%	0.315	C	S	.	.	H	α-helix	trans	-73.8	-33.2	179.2	-69.3	176.3	0	0	0	113.1	E131 R132 R137 E138 P139 M141 R363	E131-L135 HydrophobicContact CG-CD1 3.63Å; E131-L135 HydrophobicContact CG-CG 4.3Å; E131-L135 VanDerWaalsContact O-CB 3.32Å; E131-L135 WeakPolarHBondContact O-CB 3.49Å; E131-L135 WeakPolarHBondContact O-CG 3.31Å; E131-L135 PolarHBondContact O-N 2.87Å; R132-L135 PolarHBondContact O-N 3.26Å; L135-R137 VanDerWaalsContact C-N 3.29Å; L135-E138 CarbonylContact O-C 3.49Å; L135-P139 WeakPolarHBondContact O-CA 3.49Å; L135-M141 HydrophobicContact CD2-CB 3.89Å; L135-R363 HydrophobicContact CD1-CB 4.3Å; L135-R363 HydrophobicContact CD1-CG 4.21Å
136	E	91.2	Very high	91.9	Very high	149 Å²	149	63.6 Å²	63.6	70%	0.696	32%	0.319	S	S	*	.	H	α-helix	trans	-62.8	-38.8	171.2	-78.1	172.6	-173.1	0	0	111.2	R132	R132-E136 HydrophobicContact CG-CG 4.48Å; R132-E136 VanDerWaalsContact CG-OE1 3.25Å; R132-E136 WeakPolarHBondContact CG-OE1 3.48Å; R132-E136 WeakPolarHBondContact O-CB 3.38Å; R132-E136 VanDerWaalsContact O-CG 3.32Å; R132-E136 WeakPolarHBondContact O-CG 3.42Å; R132-E136 PolarHBondContact O-N 2.79Å
137	R	84.9	Confident	92	Very high	172 Å²	172	61.5 Å²	61.5	65%	0.649	30%	0.303	S	S	*	.	H	α-helix	trans	-76.8	-41.9	179.1	-173.3	177.3	-177.6	167.5	4.9	112.9	S133 L134 L135	S133-R137 WeakPolarHBondContact O-CB 3.28Å; S133-R137 PolarHBondContact O-N 2.71Å; L134-R137 PolarHBondContact O-N 3.13Å; L135-R137 VanDerWaalsContact C-N 3.29Å
138	E	80.4	Confident	92	Very high	58 Å²	58	64.6 Å²	64.6	27%	0.271	31%	0.314	S	S	.	.			trans	-140.9	90.3	-175.9	-172.8	51.9	-118.7	0	0	110.9	L134 L135 T140	L134-E138 PolarHBondContact O-N 3.13Å; L135-E138 CarbonylContact O-C 3.49Å; E138-T140 PolarHBondContact O-N 3.23Å; E138-T140 VanDerWaalsContact OE1-CB 3.26Å; E138-T140 WeakPolarHBondContact OE1-CB 3.23Å; E138-T140 WeakPolarHBondContact OE1-CG2 3.32Å; E138-T140 PolarHBondContact OE1-OG1 3.47Å
139	P	80.9	Confident	92	Very high	98 Å²	98	58.6 Å²	58.6	64%	0.636	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	3	-174	28.8	-35	0	0	0	113.6	L135	L135-P139 WeakPolarHBondContact O-CA 3.49Å
140	T	84.6	Confident	91.8	Very high	39 Å²	39	61.6 Å²	61.6	24%	0.239	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-1	-175.4	67.7	0	0	0	0	114.9	E138 A142 W147 K150	E138-T140 PolarHBondContact O-N 3.23Å; E138-T140 VanDerWaalsContact OE1-CB 3.26Å; E138-T140 WeakPolarHBondContact OE1-CB 3.23Å; E138-T140 WeakPolarHBondContact OE1-CG2 3.32Å; E138-T140 PolarHBondContact OE1-OG1 3.47Å; T140-A142 PolarHBondContact O-N 3.27Å; T140-W147 PolarHBondContact OG1-NE1 3.18Å; T140-W147 VanDerWaalsContact OG1-NE1 3.1Å; T140-K150 HydrophobicContact CG2-CD 4.3Å
141	M	90.2	Very high	91.6	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.01	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-59.9	116.3	169.3	-72.6	-68.7	-62.8	0	0	110.4	L135 W147 V179 F189 L364	L135-M141 HydrophobicContact CD2-CB 3.89Å; M141-W147 HydrophobicContact SD-CB 3.66Å; M141-W147 HydrophobicContact SD-CG 3.99Å; M141-V179 HydrophobicContact CE-CG1 4.29Å; M141-V179 HydrophobicContact SD-CG1 4.04Å; M141-F189 HydrophobicContact SD-CZ 4.48Å; M141-L364 HydrophobicContact CE-CD2 4.44Å
142	A	91.5	Very high	91.5	Very high	41 Å²	41	61.3 Å²	61.3	34%	0.339	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-86.3	164.4	176	0	0	0	0	0	111.1	T140 G145 F146	T140-A142 PolarHBondContact O-N 3.27Å; A142-G145 PolarHBondContact O-N 3.23Å; A142-F146 HydrophobicContact CB-CB 4.26Å; A142-F146 HydrophobicContact CB-CD1 4.04Å; A142-F146 PolarHBondContact N-O 3.29Å; A142-F146 PolarHBondContact O-N 2.78Å
143	L	93.8	Very high	91.6	Very high	109 Å²	109	59 Å²	59	57%	0.571	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	145.6	175.9	-76.2	166.5	0	0	0	111.8
144	G	94.3	Very high	91.6	Very high	3 Å²	3	58.4 Å²	58.4	3%	0.031	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	14.4	-177.4	0	0	0	0	0	114.3	F146 S362 F365 T366	G144-F146 VanDerWaalsContact C-N 3.26Å; G144-F146 PolarHBondContact O-N 3.01Å; G144-S362 PolarHBondContact N-O 3.04Å; G144-F365 VanDerWaalsContact C-C 3.41Å; G144-F365 CarbonylContact O-C 3.52Å; G144-T366 WeakPolarHBondContact CA-OG1 3.41Å; G144-T366 PolarHBondContact O-N 2.96Å; G144-T366 PolarHBondContact O-OG1 3.24Å; G144-T366 VanDerWaalsContact O-OG1 3.14Å
145	G	95.3	Very high	91.7	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	23.3	-176.3	0	0	0	0	0	113.7	A142 A190 R363 L364	A142-G145 PolarHBondContact O-N 3.23Å; G145-A190 WeakPolarHBondContact O-CA 3.42Å; G145-R363 WeakPolarHBondContact CA-O 2.95Å; G145-R363 PolarHBondContact N-O 2.85Å; G145-L364 WeakPolarHBondContact CA-O 3.49Å
146	F	97.4	Very high	92	Very high	54 Å²	54	63.7 Å²	63.7	24%	0.237	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-85.3	133.8	-176.8	178.1	-87.8	0	0	0	110.9	A142 G144 K148 Q188 F189 A190 L219 W221	A142-F146 HydrophobicContact CB-CB 4.26Å; A142-F146 HydrophobicContact CB-CD1 4.04Å; A142-F146 PolarHBondContact N-O 3.29Å; A142-F146 PolarHBondContact O-N 2.78Å; G144-F146 VanDerWaalsContact C-N 3.26Å; G144-F146 PolarHBondContact O-N 3.01Å; F146-K148 HydrophobicContact CE1-CB 4.27Å; F146-K148 HydrophobicContact CE1-CD 4.22Å; F146-K148 HydrophobicContact CE1-CG 4.16Å; F146-K148 HydrophobicContact CZ-CB 4.35Å; F146-K148 HydrophobicContact CZ-CD 4.38Å; F146-Q188 HydrophobicContact CE2-CG 3.99Å; F146-Q188 HydrophobicContact CZ-CG 3.97Å; F146-F189 WeakPolarHBondContact CA-O 3.43Å; F146-A190 HydrophobicContact CD2-CB 4.36Å; F146-L219 HydrophobicContact CE2-CD2 4.39Å; F146-W221 HydrophobicContact CD2-CH2 4.1Å; F146-W221 HydrophobicContact CE2-CH2 4.12Å
147	W	97.3	Very high	92.4	Very high	8 Å²	8	58.9 Å²	58.9	3%	0.03	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-142.2	148	173.6	-172.5	85.8	0	0	0	111.5	T140 M141 P149 Q183 L187 Q188 F189	T140-W147 PolarHBondContact OG1-NE1 3.18Å; T140-W147 VanDerWaalsContact OG1-NE1 3.1Å; M141-W147 HydrophobicContact SD-CB 3.66Å; M141-W147 HydrophobicContact SD-CG 3.99Å; W147-P149 HydrophobicContact CH2-CB 3.85Å; W147-P149 HydrophobicContact CZ3-CB 4.22Å; W147-P149 HydrophobicContact CZ3-CG 4.42Å; W147-Q183 HydrophobicContact CD2-CG 3.79Å; W147-Q183 HydrophobicContact CE3-CG 4.13Å; W147-Q183 HydrophobicContact CG-CG 4.17Å; W147-Q183 HydrophobicContact CH2-CB 4.2Å; W147-Q183 HydrophobicContact CH2-CG 4.42Å; W147-Q183 HydrophobicContact CZ2-CB 4.18Å; W147-Q183 HydrophobicContact CZ2-CG 4.12Å; W147-Q183 HydrophobicContact CZ3-CB 4.41Å; W147-Q183 HydrophobicContact CZ3-CG 4.42Å; W147-L187 WeakPolarHBondContact CZ3-O 3.22Å; W147-Q188 CarbonylContact O-C 3.59Å; W147-Q188 WeakPolarHBondContact O-CA 3.25Å; W147-F189 HydrophobicContact CB-CD1 4.31Å; W147-F189 HydrophobicContact CB-CE1 3.75Å; W147-F189 HydrophobicContact CB-CE2 4.35Å; W147-F189 HydrophobicContact CB-CZ 3.77Å; W147-F189 HydrophobicContact CD2-CE1 4.13Å; W147-F189 HydrophobicContact CE3-CD1 4.07Å; W147-F189 AromaticContact CE3-CE1 3.68Å; W147-F189 HydrophobicContact CE3-CE1 3.68Å; W147-F189 HydrophobicContact CG-CE1 4.19Å; W147-F189 HydrophobicContact CG-CZ 4.42Å; W147-F189 PolarHBondContact N-O 3.32Å; W147-F189 PolarHBondContact O-N 3.3Å
148	K	95.9	Very high	93	Very high	113 Å²	113	50.7 Å²	50.7	49%	0.491	25%	0.254	S	S	.	.			trans	-144	144.2	170.7	68.4	177.9	-176.1	176.3	0	110.4	F146 Q188	F146-K148 HydrophobicContact CE1-CB 4.27Å; F146-K148 HydrophobicContact CE1-CD 4.22Å; F146-K148 HydrophobicContact CE1-CG 4.16Å; F146-K148 HydrophobicContact CZ-CB 4.35Å; F146-K148 HydrophobicContact CZ-CD 4.38Å; K148-Q188 HydrophobicContact CB-CB 4.19Å; K148-Q188 HydrophobicContact CB-CG 4.02Å
149	P	94.6	Very high	93.9	Very high	6 Å²	6	47.9 Å²	47.9	4%	0.039	24%	0.241	C	C	.	.			trans	-62.6	148	172.9	27.9	-34.1	0	0	0	110.6	W147 D151 P154 R186	W147-P149 HydrophobicContact CH2-CB 3.85Å; W147-P149 HydrophobicContact CZ3-CB 4.22Å; W147-P149 HydrophobicContact CZ3-CG 4.42Å; P149-D151 WeakPolarHBondContact CB-OD1 3.25Å; P149-P154 HydrophobicContact CG-CB 3.87Å; P149-P154 HydrophobicContact CG-CG 4.37Å; P149-R186 HydrophobicContact CB-CB 4.44Å; P149-R186 HydrophobicContact CG-CB 4.45Å
150	K	92.4	Very high	94.8	Very high	152 Å²	152	43.2 Å²	43.2	66%	0.661	21%	0.21	S	C	*	.	S	Bend	trans	-106.1	-16.8	175.8	-64.9	-176.5	178.9	-178.8	0	112.6	T140	T140-K150 HydrophobicContact CG2-CD 4.3Å
151	D	91.4	Very high	95.5	Very high	45 Å²	45	41.4 Å²	41.4	24%	0.241	20%	0.199	C	C	.	.	S	Bend	trans	-91.4	-10	-175.5	57.2	-49.3	0	0	0	113.2	Y101 L102 P103 P149 R186	Y101-D151 WeakPolarHBondContact CD2-O 3.43Å; Y101-D151 HydrophobicContact CE2-CB 4.18Å; Y101-D151 WeakPolarHBondContact CE2-O 3.26Å; Y101-D151 WeakPolarHBondContact CE2-OD2 3.31Å; Y101-D151 PolarHBondContact OH-OD2 3.26Å; L102-D151 CarbonylContact C-O 3.54Å; P103-D151 VanDerWaalsContact CA-O 3.3Å; P103-D151 WeakPolarHBondContact CA-O 3.42Å; P149-D151 WeakPolarHBondContact CB-OD1 3.25Å; D151-R186 VanDerWaalsContact CG-NH1 3.31Å; D151-R186 IonicContact OD1-CZ 3.89Å; D151-R186 IonicContact OD1-NE 3.62Å; D151-R186 IonicContact OD1-NH1 2.73Å; D151-R186 PolarHBondContact OD1-NH1 2.77Å; D151-R186 IonicContact OD2-CZ 3.45Å; D151-R186 IonicContact OD2-NE 2.74Å; D151-R186 PolarHBondContact OD2-NE 3.41Å; D151-R186 IonicContact OD2-NH1 3.93Å; D151-R186 PolarHBondContact OD2-NH1 3.28Å; D151-R186 IonicContact OD2-NH2 3.31Å; D151-R186 PolarHBondContact OD2-NH2 3.36Å
152	C	93.3	Very high	95.9	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.02	20%	0.199	C	C	.	.	S	Bend	trans	-158.4	166.6	174.5	49.5	0	0	0	0	111.4	Y101 P103 Q105 C107	Y101-C152 HydrophobicContact CD2-CB 3.55Å; Y101-C152 HydrophobicContact CE2-CB 3.44Å; Y101-C152 VanDerWaalsContact CE2-CB 3.44Å; Y101-C152 WeakPolarHBondContact CE2-SG 3.44Å; P103-C152 CarbonylContact O-C 3.54Å; Q105-C152 WeakPolarHBondContact O-CB 3.14Å; C107-C152 HydrophobicContact CB-CB 3.98Å; C107-C152 WeakPolarHBondContact CB-SG 3.44Å; C107-C152 WeakPolarHBondContact SG-CB 3.49Å; C107-C152 CovalentContact SG-SG 2.03Å; C107-C152 PolarHBondContact SG-SG 2.89Å
153	L	94.9	Very high	96.2	Very high	90 Å²	90	39.7 Å²	39.7	47%	0.471	19%	0.185	S	C	.	.	B	Isolated β-bridge	trans	-76.4	120.6	169.3	-62	-178.8	0	0	0	109.7	P103 S104 Q105 V106 C107 R155	P103-L153 PolarHBondContact O-N 3.25Å; S104-L153 VanDerWaalsContact O-CD1 3.23Å; S104-L153 WeakPolarHBondContact O-CD1 3.44Å; Q105-L153 PolarHBondContact O-N 3.46Å; V106-L153 CarbonylContact C-O 3.47Å; V106-L153 WeakPolarHBondContact CA-O 3.05Å; C107-L153 PolarHBondContact N-O 3.05Å; C107-L153 VanDerWaalsContact SG-C 3.5Å; C107-L153 PolarHBondContact SG-O 2.77Å; L153-R155 PolarHBondContact O-N 3.47Å
154	P	95.2	Very high	96.3	Very high	35 Å²	35	34.8 Å²	34.8	23%	0.227	16%	0.159	C	C	.	.			trans	-60.2	131.5	-179.1	24.4	-32.1	0	0	0	110.4	P149 W156 Q188	P149-P154 HydrophobicContact CG-CB 3.87Å; P149-P154 HydrophobicContact CG-CG 4.37Å; P154-W156 VanDerWaalsContact C-N 3.34Å; P154-Q188 HydrophobicContact CB-CB 3.61Å; P154-Q188 HydrophobicContact CG-CB 3.71Å; P154-Q188 VanDerWaalsContact CG-OE1 3.3Å
155	R	95.7	Very high	96.3	Very high	103 Å²	103	37.3 Å²	37.3	39%	0.389	17%	0.167	S	C	.	.	S	Bend	trans	-67.3	-37.9	177.2	178.7	175.4	-70.1	-81.6	-5.5	112.3	V106 C107 L153	V106-R155 HydrophobicContact CG1-CB 3.81Å; V106-R155 HydrophobicContact CG1-CG 4.21Å; C107-R155 PolarHBondContact O-NE 3.21Å; L153-R155 PolarHBondContact O-N 3.47Å
156	W	97.9	Very high	96	Very high	58 Å²	58	43.3 Å²	43.3	22%	0.22	20%	0.199	C	C	.	.			trans	-134.5	137.2	-173.4	-62.3	122.1	0	0	0	110.9	P154 V158 L187 Q188 D222 Y239 C242 M273	P154-W156 VanDerWaalsContact C-N 3.34Å; W156-V158 HydrophobicContact CB-CG2 4.01Å; W156-L187 HydrophobicContact CB-CD2 4.14Å; W156-Q188 PolarHBondContact O-N 3.09Å; W156-D222 HydrophobicContact CE3-CB 3.96Å; W156-D222 HydrophobicContact CZ3-CB 4.44Å; W156-Y239 AromaticContact CD1-CE1 3.76Å; W156-C242 HydrophobicContact CD2-CB 3.61Å; W156-C242 HydrophobicContact CE3-CB 3.6Å; W156-C242 HydrophobicContact CG-CB 4.11Å; W156-C242 HydrophobicContact CH2-CB 4.28Å; W156-C242 HydrophobicContact CZ2-CB 4.28Å; W156-C242 HydrophobicContact CZ3-CB 3.94Å; W156-M273 HydrophobicContact CH2-CE 4.36Å
157	K	98.5	Very high	95.7	Very high	47 Å²	47	42.4 Å²	42.4	20%	0.204	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.3	166.4	-62.4	166.8	-75.8	161.1	0	108.1	Q188 L219 D220 W221 D222 C223	K157-Q188 CarbonylContact C-O 3.59Å; K157-Q188 VanDerWaalsContact CA-O 3.26Å; K157-Q188 WeakPolarHBondContact CA-O 3.49Å; K157-Q188 HydrophobicContact CG-CB 4.35Å; K157-Q188 HydrophobicContact CG-CG 4.24Å; K157-L219 HydrophobicContact CB-CD2 4.35Å; K157-L219 HydrophobicContact CD-CD2 4.02Å; K157-L219 HydrophobicContact CD-CG 4.5Å; K157-L219 HydrophobicContact CG-CD2 4.25Å; K157-D220 WeakPolarHBondContact CD-O 3.41Å; K157-D220 VanDerWaalsContact CE-O 3.32Å; K157-D220 WeakPolarHBondContact CE-O 3.41Å; K157-D220 PolarHBondContact NZ-O 3.01Å; K157-D220 IonicContact NZ-OD2 3.18Å; K157-W221 VanDerWaalsContact C-CE3 3.5Å; K157-W221 HydrophobicContact CB-CE3 3.75Å; K157-W221 HydrophobicContact CB-CZ3 4.16Å; K157-D222 WeakPolarHBondContact CB-OD2 3.3Å; K157-D222 WeakPolarHBondContact CE-OD1 3.34Å; K157-D222 VanDerWaalsContact CE-OD2 3.3Å; K157-D222 WeakPolarHBondContact CE-OD2 3.37Å; K157-D222 PolarHBondContact N-OD2 2.88Å; K157-D222 IonicContact NZ-OD1 3.66Å; K157-D222 PolarHBondContact NZ-OD1 3.28Å; K157-D222 WeakPolarHBondContact O-CB 3.29Å; K157-D222 PolarHBondContact O-N 2.89Å; K157-C223 PolarHBondContact O-N 3.17Å
158	V	98.8	Very high	95.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.2	-172.7	-168.9	0	0	0	0	111.6	W156 I160 L187 Q188 F189 A190 W221 I225	W156-V158 HydrophobicContact CB-CG2 4.01Å; V158-I160 HydrophobicContact CG1-CD1 3.64Å; V158-L187 HydrophobicContact CG2-CD1 4.39Å; V158-L187 HydrophobicContact CG2-CD2 4.07Å; V158-Q188 PolarHBondContact N-O 2.94Å; V158-F189 WeakPolarHBondContact O-CA 3.42Å; V158-F189 WeakPolarHBondContact O-CB 3.35Å; V158-A190 PolarHBondContact O-N 3.31Å; V158-W221 VanDerWaalsContact C-CE3 3.4Å; V158-W221 VanDerWaalsContact N-CE3 3.35Å; V158-W221 WeakPolarHBondContact O-CZ3 3.32Å; V158-I225 HydrophobicContact CG1-CD1 4.28Å; V158-I225 HydrophobicContact CG1-CG1 3.46Å; V158-I225 VanDerWaalsContact CG1-CG1 3.46Å
159	A	98.8	Very high	95.2	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.2	168.7	0	0	0	0	0	110	L161 Y192 A215 W221 C223 L224 I225	A159-L161 HydrophobicContact CB-CD2 4.41Å; A159-Y192 HydrophobicContact CB-CD2 4.23Å; A159-Y192 HydrophobicContact CB-CE2 3.95Å; A159-A215 HydrophobicContact CB-CB 4.01Å; A159-W221 HydrophobicContact CB-CB 4.21Å; A159-W221 HydrophobicContact CB-CD2 3.73Å; A159-W221 HydrophobicContact CB-CE3 4.34Å; A159-W221 HydrophobicContact CB-CG 3.63Å; A159-C223 PolarHBondContact N-O 3.15Å; A159-C223 VanDerWaalsContact N-O 3.08Å; A159-L224 HydrophobicContact CB-CD2 3.95Å; A159-L224 WeakPolarHBondContact O-CA 3.45Å; A159-I225 PolarHBondContact O-N 3.03Å
160	I	98.9	Very high	95.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.2	176.8	-48.1	-62.1	0	0	0	108.1	V158 V162 L178 L182 A190 L191 Y192 I225 H227 Y240	V158-I160 HydrophobicContact CG1-CD1 3.64Å; I160-V162 HydrophobicContact CG2-CG2 4.3Å; I160-L178 HydrophobicContact CG2-CD2 4.29Å; I160-L182 HydrophobicContact CD1-CD1 4.43Å; I160-L182 HydrophobicContact CG1-CD1 4.03Å; I160-A190 PolarHBondContact N-O 2.92Å; I160-L191 HydrophobicContact CB-CD2 3.8Å; I160-L191 HydrophobicContact CB-CG 4.49Å; I160-L191 HydrophobicContact CG1-CD2 4.27Å; I160-L191 HydrophobicContact CG2-CD2 3.78Å; I160-Y192 PolarHBondContact O-N 2.97Å; I160-I225 HydrophobicContact CD1-CB 3.59Å; I160-I225 HydrophobicContact CD1-CG1 3.54Å; I160-I225 HydrophobicContact CD1-CG2 4.29Å; I160-H227 HydrophobicContact CG2-CB 4.21Å; I160-Y240 HydrophobicContact CD1-CD2 4.06Å
161	L	98.9	Very high	95.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.8	-177.4	-51.5	-175.2	0	0	0	109.3	A159 Y192 I194 F208 F212 A215 L224 I225 F226 H227	A159-L161 HydrophobicContact CB-CD2 4.41Å; L161-Y192 HydrophobicContact CD2-CD2 3.85Å; L161-Y192 HydrophobicContact CD2-CG 4.05Å; L161-I194 HydrophobicContact CB-CD1 3.97Å; L161-I194 HydrophobicContact CD2-CD1 4.47Å; L161-F208 HydrophobicContact CB-CD1 3.92Å; L161-F208 HydrophobicContact CB-CE1 4.3Å; L161-F208 WeakPolarHBondContact O-CE1 3.36Å; L161-F212 HydrophobicContact CD1-CB 4.24Å; L161-A215 HydrophobicContact CD2-CB 4.14Å; L161-L224 HydrophobicContact CD1-CD2 4.28Å; L161-I225 PolarHBondContact N-O 2.91Å; L161-F226 HydrophobicContact CD1-CD1 4.12Å; L161-F226 HydrophobicContact CD1-CE1 3.93Å; L161-H227 PolarHBondContact O-N 3.16Å
162	V	98.8	Very high	95.7	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	104.5	-177.4	-175	0	0	0	0	109.3	I160 L174 Y192 V193 I194 H227 V229	I160-V162 HydrophobicContact CG2-CG2 4.3Å; V162-L174 HydrophobicContact CG1-CD2 4.24Å; V162-L174 HydrophobicContact CG2-CD2 4.28Å; V162-Y192 PolarHBondContact N-O 3.48Å; V162-V193 CarbonylContact O-C 3.58Å; V162-V193 WeakPolarHBondContact O-CA 3.31Å; V162-I194 PolarHBondContact O-N 3.49Å; V162-H227 WeakPolarHBondContact CA-O 3.41Å; V162-H227 HydrophobicContact CG2-CB 4.34Å; V162-V229 HydrophobicContact CG1-CB 3.8Å; V162-V229 HydrophobicContact CG1-CG2 4.07Å
163	P	98.1	Very high	95.9	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.039	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	137.5	176.8	32.8	-31.2	0	0	0	108.5	F202 R204 L207 F208 H227	P163-F202 HydrophobicContact CB-CZ 3.96Å; P163-R204 HydrophobicContact CB-CG 4.36Å; P163-R204 HydrophobicContact CG-CG 3.85Å; P163-L207 HydrophobicContact CB-CB 3.84Å; P163-L207 HydrophobicContact CB-CD1 3.83Å; P163-F208 VanDerWaalsContact CD-CE1 3.41Å; P163-F208 HydrophobicContact CG-CD1 4.46Å; P163-F208 HydrophobicContact CG-CE1 3.78Å; P163-F208 HydrophobicContact CG-CE2 4.17Å; P163-F208 HydrophobicContact CG-CZ 3.58Å; P163-H227 WeakPolarHBondContact CD-O 3.11Å
164	F	96.8	Very high	96.1	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.026	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	141.3	-165.9	-172.9	-92.9	0	0	0	112.8	R167 H168 L171 V193 I194 E195 Q196 V229	F164-R167 HydrophobicContact CD2-CB 4.25Å; F164-R167 HydrophobicContact CE2-CB 3.69Å; F164-R167 VanDerWaalsContact CE2-O 3.32Å; F164-R167 WeakPolarHBondContact CE2-O 3.37Å; F164-R167 VanDerWaalsContact CZ-C 3.49Å; F164-R167 HydrophobicContact CZ-CB 4.24Å; F164-H168 AromaticContact CE1-CE1 3.69Å; F164-H168 AromaticContact CE1-ND1 3.86Å; F164-H168 AromaticContact CZ-CE1 3.98Å; F164-H168 AromaticContact CZ-ND1 3.69Å; F164-L171 HydrophobicContact CD2-CB 4.48Å; F164-L171 HydrophobicContact CE2-CB 3.83Å; F164-L171 HydrophobicContact CE2-CD2 4.25Å; F164-V193 HydrophobicContact CB-CG1 3.58Å; F164-V193 HydrophobicContact CD1-CG1 4.3Å; F164-V193 HydrophobicContact CD2-CG1 4.31Å; F164-V193 HydrophobicContact CG-CG1 3.81Å; F164-I194 PolarHBondContact N-O 3.31Å; F164-E195 HydrophobicContact CD1-CB 4.37Å; F164-E195 HydrophobicContact CD1-CG 4.17Å; F164-E195 CarbonylContact O-C 3.29Å; F164-E195 VanDerWaalsContact O-CA 3.3Å; F164-E195 WeakPolarHBondContact O-CA 3.48Å; F164-Q196 PolarHBondContact O-N 3.04Å; F164-V229 HydrophobicContact CD2-CG2 4.05Å; F164-V229 HydrophobicContact CE2-CG2 4.28Å
165	R	93.8	Very high	96.2	Very high	55 Å²	55	33.8 Å²	33.8	21%	0.208	15%	0.152	C	C	.	.	S	Bend	trans	-164.6	126.8	162.9	-175.9	165.1	69.5	178.8	7.8	110.2	R167 Q196 E200 F202	R165-R167 PolarHBondContact O-N 2.96Å; R165-R167 VanDerWaalsContact O-N 3.11Å; R165-Q196 WeakPolarHBondContact CD-O 3.39Å; R165-E200 PolarHBondContact NH1-O 3.06Å; R165-E200 PolarHBondContact NH2-O 2.86Å; R165-F202 HydrophobicContact CB-CD2 3.9Å; R165-F202 HydrophobicContact CB-CE2 3.78Å
166	N	89.6	Confident	96.2	Very high	126 Å²	126	31.2 Å²	31.2	67%	0.674	14%	0.142	S	C	*	.	S	Bend	trans	51.7	33.4	173.4	-57.6	-18.3	0	0	0	114.7
167	R	90.1	Very high	96.2	Very high	36 Å²	36	29.5 Å²	29.5	14%	0.136	14%	0.136	C	C	.	.			trans	-116.4	41.6	177	-64.6	-64.8	-168.4	93.6	10.4	111.3	F164 R165 E169 H170 L171 V229 D230 H324 E328	F164-R167 HydrophobicContact CD2-CB 4.25Å; F164-R167 HydrophobicContact CE2-CB 3.69Å; F164-R167 VanDerWaalsContact CE2-O 3.32Å; F164-R167 WeakPolarHBondContact CE2-O 3.37Å; F164-R167 VanDerWaalsContact CZ-C 3.49Å; F164-R167 HydrophobicContact CZ-CB 4.24Å; R165-R167 PolarHBondContact O-N 2.96Å; R165-R167 VanDerWaalsContact O-N 3.11Å; R167-E169 PolarHBondContact O-N 3.32Å; R167-E169 VanDerWaalsContact O-N 3.14Å; R167-H170 HydrophobicContact CB-CB 4.21Å; R167-H170 PolarHBondContact NH1-CE1 3.1Å; R167-H170 PolarHBondContact NH1-ND1 3.41Å; R167-H170 PolarHBondContact O-N 3.42Å; R167-L171 PolarHBondContact O-N 3.44Å; R167-V229 HydrophobicContact CB-CG1 4.01Å; R167-V229 HydrophobicContact CG-CG1 4.12Å; R167-D230 IonicContact CZ-OD2 3.71Å; R167-D230 IonicContact NH1-OD2 2.68Å; R167-D230 PolarHBondContact NH1-OD2 2.98Å; R167-H324 PolarHBondContact NH1-ND1 2.91Å; R167-H324 VanDerWaalsContact NH1-ND1 3.11Å; R167-E328 IonicContact NH2-OE1 2.87Å; R167-E328 PolarHBondContact NH2-OE1 3.47Å
168	H	90.4	Very high	96.2	Very high	121 Å²	121	27.3 Å²	27.3	56%	0.56	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.5	-171.8	-59.6	-72.6	0	0	0	113.6	F164 P172	F164-H168 AromaticContact CE1-CE1 3.69Å; F164-H168 AromaticContact CE1-ND1 3.86Å; F164-H168 AromaticContact CZ-CE1 3.98Å; F164-H168 AromaticContact CZ-ND1 3.69Å; H168-P172 WeakPolarHBondContact O-CD 3.47Å; H168-P172 WeakPolarHBondContact O-CG 3.25Å
169	E	92.4	Very high	96.1	Very high	116 Å²	116	27.3 Å²	27.3	54%	0.542	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-29.2	173.9	-66.5	161.7	-166.4	0	0	112.5	R167 I173	R167-E169 PolarHBondContact O-N 3.32Å; R167-E169 VanDerWaalsContact O-N 3.14Å; E169-I173 WeakPolarHBondContact O-CD1 3.16Å; E169-I173 WeakPolarHBondContact O-CG1 3.35Å
170	H	95.3	Very high	96	Very high	9 Å²	9	28.1 Å²	28.1	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-83.4	-39.4	-175.3	-64.3	-166.7	0	0	0	112.3	R167 I173 L174 V229 I321 P322 H324	R167-H170 HydrophobicContact CB-CB 4.21Å; R167-H170 PolarHBondContact NH1-CE1 3.1Å; R167-H170 PolarHBondContact NH1-ND1 3.41Å; R167-H170 PolarHBondContact O-N 3.42Å; H170-I173 WeakPolarHBondContact O-CB 3.34Å; H170-I173 PolarHBondContact O-N 2.98Å; H170-I173 VanDerWaalsContact O-N 3.17Å; H170-L174 PolarHBondContact O-N 3.49Å; H170-V229 HydrophobicContact CB-CG1 4.2Å; H170-V229 HydrophobicContact CB-CG2 4.15Å; H170-I321 HydrophobicContact CB-CD1 4.05Å; H170-P322 PolarHBondContact NE2-O 3.17Å; H170-H324 AromaticContact CE1-CE1 3.71Å; H170-H324 AromaticContact CE1-ND1 3.76Å; H170-H324 AromaticContact ND1-CE1 3.99Å
171	L	96.8	Very high	95.9	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.058	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-45	-174.5	178.6	65.3	0	0	0	113.3	F164 R167 I173 L174 L175 V193 V229 F365	F164-L171 HydrophobicContact CD2-CB 4.48Å; F164-L171 HydrophobicContact CE2-CB 3.83Å; F164-L171 HydrophobicContact CE2-CD2 4.25Å; R167-L171 PolarHBondContact O-N 3.44Å; L171-I173 VanDerWaalsContact C-N 3.33Å; L171-I173 PolarHBondContact O-N 3.24Å; L171-L174 PolarHBondContact O-N 2.82Å; L171-L175 HydrophobicContact CD1-CD1 4.08Å; L171-L175 HydrophobicContact CD1-CD2 4.48Å; L171-L175 HydrophobicContact CD1-CG 4.05Å; L171-L175 HydrophobicContact CG-CD1 3.97Å; L171-L175 HydrophobicContact CG-CG 4.36Å; L171-L175 VanDerWaalsContact O-CG 3.32Å; L171-L175 WeakPolarHBondContact O-CG 3.41Å; L171-L175 PolarHBondContact O-N 3.15Å; L171-V193 HydrophobicContact CD1-CG2 3.9Å; L171-V193 HydrophobicContact CD2-CG1 4.32Å; L171-V193 HydrophobicContact CD2-CG2 4.21Å; L171-V229 HydrophobicContact CB-CG2 4.03Å; L171-V229 HydrophobicContact CD1-CG2 4.19Å; L171-F365 HydrophobicContact CD2-CE1 4.13Å; L171-F365 HydrophobicContact CD2-CE2 4.46Å; L171-F365 HydrophobicContact CD2-CZ 3.93Å
172	P	97.1	Very high	95.8	Very high	6 Å²	6	28.3 Å²	28.3	4%	0.039	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-40.3	175.6	-24.7	35.7	0	0	0	112.8	I125 L127 V130 H168 L175 R176	I125-P172 HydrophobicContact CG2-CB 3.93Å; I125-P172 WeakPolarHBondContact O-CB 3.26Å; I125-P172 WeakPolarHBondContact O-CG 3.42Å; L127-P172 HydrophobicContact CB-CG 4.16Å; L127-P172 HydrophobicContact CD1-CG 4.39Å; V130-P172 HydrophobicContact CG2-CB 3.91Å; H168-P172 WeakPolarHBondContact O-CD 3.47Å; H168-P172 WeakPolarHBondContact O-CG 3.25Å; P172-L175 PolarHBondContact O-N 3.35Å; P172-R176 WeakPolarHBondContact O-CB 3.45Å; P172-R176 PolarHBondContact O-N 2.91Å
173	I	97.6	Very high	95.6	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-47.1	176.7	-60.4	169.4	0	0	0	109.9	M122 E169 H170 L171 H177 L232 I321	M122-I173 WeakPolarHBondContact O-CD1 3.43Å; E169-I173 WeakPolarHBondContact O-CD1 3.16Å; E169-I173 WeakPolarHBondContact O-CG1 3.35Å; H170-I173 WeakPolarHBondContact O-CB 3.34Å; H170-I173 PolarHBondContact O-N 2.98Å; H170-I173 VanDerWaalsContact O-N 3.17Å; L171-I173 VanDerWaalsContact C-N 3.33Å; L171-I173 PolarHBondContact O-N 3.24Å; I173-H177 WeakPolarHBondContact O-CB 3.48Å; I173-H177 PolarHBondContact O-N 3.5Å; I173-H177 VanDerWaalsContact O-N 3.13Å; I173-L232 HydrophobicContact CG2-CD1 3.77Å; I173-I321 HydrophobicContact CB-CD1 3.93Å; I173-I321 HydrophobicContact CD1-CD1 4.23Å; I173-I321 HydrophobicContact CD1-CG2 4.43Å; I173-I321 HydrophobicContact CG2-CD1 3.77Å; I173-I321 HydrophobicContact CG2-CG1 4.43Å
174	L	97.9	Very high	95.4	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-59.4	-49.4	176.6	175.9	64.7	0	0	0	111.7	V162 H170 L171 R176 H177 L178 H227 V229 L232	V162-L174 HydrophobicContact CG1-CD2 4.24Å; V162-L174 HydrophobicContact CG2-CD2 4.28Å; H170-L174 PolarHBondContact O-N 3.49Å; L171-L174 PolarHBondContact O-N 2.82Å; L174-R176 PolarHBondContact O-N 3.5Å; L174-H177 PolarHBondContact O-N 3.11Å; L174-L178 HydrophobicContact CD1-CB 4.04Å; L174-L178 HydrophobicContact CD1-CD2 4.1Å; L174-L178 HydrophobicContact CG-CB 4.46Å; L174-L178 HydrophobicContact CG-CD2 4.43Å; L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 PolarHBondContact O-N 2.77Å; L174-H227 VanDerWaalsContact CD1-CE1 3.45Å; L174-H227 WeakPolarHBondContact CD1-CE1 3.37Å; L174-V229 WeakPolarHBondContact CB-O 3.3Å; L174-V229 HydrophobicContact CD2-CG2 4.26Å; L174-L232 HydrophobicContact CB-CD2 4.4Å; L174-L232 HydrophobicContact CD1-CD2 3.87Å
175	L	97.6	Very high	95.4	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-43	-177.1	-68.3	173.1	0	0	0	111.8	L127 V130 L171 P172 H177 V179 L191 L364 F365	L127-L175 HydrophobicContact CD1-CD1 3.64Å; V130-L175 HydrophobicContact CG1-CB 4.11Å; L171-L175 HydrophobicContact CD1-CD1 4.08Å; L171-L175 HydrophobicContact CD1-CD2 4.48Å; L171-L175 HydrophobicContact CD1-CG 4.05Å; L171-L175 HydrophobicContact CG-CD1 3.97Å; L171-L175 HydrophobicContact CG-CG 4.36Å; L171-L175 VanDerWaalsContact O-CG 3.32Å; L171-L175 WeakPolarHBondContact O-CG 3.41Å; L171-L175 PolarHBondContact O-N 3.15Å; P172-L175 PolarHBondContact O-N 3.35Å; L175-H177 PolarHBondContact O-N 3.44Å; L175-V179 HydrophobicContact CD2-CG2 4.4Å; L175-V179 WeakPolarHBondContact O-CB 3.18Å; L175-V179 WeakPolarHBondContact O-CG2 3.38Å; L175-V179 PolarHBondContact O-N 3.43Å; L175-L191 HydrophobicContact CD2-CD1 3.87Å; L175-L364 HydrophobicContact CB-CD1 4.45Å; L175-L364 HydrophobicContact CD1-CB 4.2Å; L175-L364 HydrophobicContact CD1-CD1 4.05Å; L175-F365 HydrophobicContact CD1-CD1 3.72Å; L175-F365 HydrophobicContact CD1-CE1 3.89Å
176	R	96.9	Very high	95.4	Very high	50 Å²	50	32.1 Å²	32.1	19%	0.189	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-38.4	174.8	-177.2	176.9	67.6	-165.9	-6.3	111.8	N121 S123 V130 P172 L174 P180	N121-R176 PolarHBondContact O-NH2 3.45Å; N121-R176 PolarHBondContact OD1-NH2 2.92Å; N121-R176 VanDerWaalsContact OD1-NH2 3.14Å; S123-R176 PolarHBondContact O-NH1 3.4Å; S123-R176 PolarHBondContact O-NH2 2.94Å; V130-R176 HydrophobicContact CG1-CB 3.98Å; V130-R176 HydrophobicContact CG2-CB 4.07Å; P172-R176 WeakPolarHBondContact O-CB 3.45Å; P172-R176 PolarHBondContact O-N 2.91Å; L174-R176 PolarHBondContact O-N 3.5Å; R176-P180 WeakPolarHBondContact O-CD 3.32Å; R176-P180 WeakPolarHBondContact O-CG 3.19Å
177	H	97.8	Very high	95.7	Very high	22 Å²	22	26.1 Å²	26.1	10%	0.102	12%	0.117	C	C	.	.	H	α-helix	trans	-82.3	-49.3	-177.4	-169.7	69.7	0	0	0	113.1	I173 L174 L175 V181 L232 M233	I173-H177 WeakPolarHBondContact O-CB 3.48Å; I173-H177 PolarHBondContact O-N 3.5Å; I173-H177 VanDerWaalsContact O-N 3.13Å; L174-H177 PolarHBondContact O-N 3.11Å; L175-H177 PolarHBondContact O-N 3.44Å; H177-V181 WeakPolarHBondContact O-CG2 3.37Å; H177-L232 HydrophobicContact CB-CD2 4.04Å; H177-M233 PolarHBondContact CE1-O 3.1Å; H177-M233 PolarHBondContact NE2-O 3.3Å
178	L	97.9	Very high	96.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-77.9	-43.6	-168.1	-178.1	61.4	0	0	0	112.6	I160 L174 V181 L182 L191 M233 Y240	I160-L178 HydrophobicContact CG2-CD2 4.29Å; L174-L178 HydrophobicContact CD1-CB 4.04Å; L174-L178 HydrophobicContact CD1-CD2 4.1Å; L174-L178 HydrophobicContact CG-CB 4.46Å; L174-L178 HydrophobicContact CG-CD2 4.43Å; L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 PolarHBondContact O-N 2.77Å; L178-V181 PolarHBondContact O-N 3.29Å; L178-L182 HydrophobicContact CD1-CD1 4.11Å; L178-L182 HydrophobicContact CD1-CD2 4.02Å; L178-L182 HydrophobicContact CD1-CG 3.88Å; L178-L182 HydrophobicContact CD2-CD1 4.24Å; L178-L182 HydrophobicContact CG-CD1 3.78Å; L178-L182 HydrophobicContact CG-CG 4Å; L178-L182 WeakPolarHBondContact O-CG 3.47Å; L178-L182 PolarHBondContact O-N 3.34Å; L178-L191 HydrophobicContact CD2-CD2 4.13Å; L178-M233 HydrophobicContact CD1-CE 3.41Å; L178-M233 VanDerWaalsContact CD1-CE 3.41Å; L178-Y240 HydrophobicContact CD1-CD2 4.36Å; L178-Y240 HydrophobicContact CD1-CE2 3.83Å
179	V	97	Very high	96.5	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-57	-50.1	-174.3	171.5	0	0	0	0	112	L134 M141 L175 V181 L182 Q183 F189 L191	L134-V179 HydrophobicContact CD1-CB 4.01Å; L134-V179 HydrophobicContact CD1-CG1 4.17Å; L134-V179 HydrophobicContact CD1-CG2 4.21Å; L134-V179 HydrophobicContact CD2-CB 4.48Å; L134-V179 HydrophobicContact CD2-CG1 4.44Å; M141-V179 HydrophobicContact CE-CG1 4.29Å; M141-V179 HydrophobicContact SD-CG1 4.04Å; L175-V179 HydrophobicContact CD2-CG2 4.4Å; L175-V179 WeakPolarHBondContact O-CB 3.18Å; L175-V179 WeakPolarHBondContact O-CG2 3.38Å; L175-V179 PolarHBondContact O-N 3.43Å; V179-V181 VanDerWaalsContact C-N 3.25Å; V179-V181 PolarHBondContact O-N 2.91Å; V179-L182 PolarHBondContact O-N 2.98Å; V179-Q183 HydrophobicContact CG1-CG 4.49Å; V179-Q183 VanDerWaalsContact O-CG 3.3Å; V179-Q183 WeakPolarHBondContact O-CG 3.47Å; V179-Q183 PolarHBondContact O-N 3.19Å; V179-Q183 VanDerWaalsContact O-N 3.08Å; V179-F189 HydrophobicContact CG1-CZ 4.44Å; V179-L191 HydrophobicContact CG2-CD1 3.63Å
180	P	95.7	Very high	96.8	Very high	16 Å²	16	14.6 Å²	14.6	10%	0.104	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-31.4	178	-23.4	35.5	0	0	0	113.5	L134 R176 K184	L134-P180 HydrophobicContact CD2-CG 3.69Å; R176-P180 WeakPolarHBondContact O-CD 3.32Å; R176-P180 WeakPolarHBondContact O-CG 3.19Å; P180-K184 VanDerWaalsContact O-CG 3.31Å; P180-K184 WeakPolarHBondContact O-CG 3.49Å; P180-K184 PolarHBondContact O-N 2.83Å
181	V	96.5	Very high	97	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.024	6%	0.064	C	C	.	.	H	α-helix	trans	-70.2	-46.5	178.3	178.7	0	0	0	0	110.7	L118 H177 L178 V179 Q183 K184 Q185 M233 D236	L118-V181 HydrophobicContact CD1-CG2 3.59Å; H177-V181 WeakPolarHBondContact O-CG2 3.37Å; L178-V181 PolarHBondContact O-N 3.29Å; V179-V181 VanDerWaalsContact C-N 3.25Å; V179-V181 PolarHBondContact O-N 2.91Å; V181-Q183 VanDerWaalsContact C-N 3.27Å; V181-Q183 PolarHBondContact O-N 3.46Å; V181-K184 WeakPolarHBondContact O-CB 3.48Å; V181-K184 PolarHBondContact O-N 2.95Å; V181-K184 VanDerWaalsContact O-N 3.16Å; V181-Q185 HydrophobicContact CG1-CG 4.44Å; V181-Q185 VanDerWaalsContact O-CG 3.32Å; V181-Q185 WeakPolarHBondContact O-CG 3.38Å; V181-Q185 PolarHBondContact O-N 2.85Å; V181-M233 HydrophobicContact CB-SD 4.31Å; V181-M233 HydrophobicContact CG1-CE 4.2Å; V181-M233 HydrophobicContact CG1-SD 3.49Å; V181-M233 WeakPolarHBondContact CG1-SD 3.33Å; V181-D236 HydrophobicContact CG1-CB 3.84Å
182	L	96.9	Very high	97.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.1	-37.4	177.2	-62	177.8	0	0	0	112.1	I160 L178 V179 Q185 R186 L187 F189 Y240	I160-L182 HydrophobicContact CD1-CD1 4.43Å; I160-L182 HydrophobicContact CG1-CD1 4.03Å; L178-L182 HydrophobicContact CD1-CD1 4.11Å; L178-L182 HydrophobicContact CD1-CD2 4.02Å; L178-L182 HydrophobicContact CD1-CG 3.88Å; L178-L182 HydrophobicContact CD2-CD1 4.24Å; L178-L182 HydrophobicContact CG-CD1 3.78Å; L178-L182 HydrophobicContact CG-CG 4Å; L178-L182 WeakPolarHBondContact O-CG 3.47Å; L178-L182 PolarHBondContact O-N 3.34Å; V179-L182 PolarHBondContact O-N 2.98Å; L182-Q185 PolarHBondContact O-N 3.48Å; L182-R186 PolarHBondContact O-N 3.24Å; L182-L187 HydrophobicContact CD2-CD1 3.9Å; L182-L187 PolarHBondContact O-N 3.35Å; L182-F189 HydrophobicContact CB-CD1 3.69Å; L182-F189 HydrophobicContact CB-CE1 3.42Å; L182-F189 VanDerWaalsContact CB-CE1 3.42Å; L182-F189 HydrophobicContact CB-CE2 4.41Å; L182-F189 HydrophobicContact CB-CG 4.29Å; L182-F189 HydrophobicContact CB-CZ 3.83Å; L182-F189 HydrophobicContact CD1-CD1 4.27Å; L182-F189 HydrophobicContact CD1-CD2 3.81Å; L182-F189 HydrophobicContact CD1-CE1 4.32Å; L182-F189 HydrophobicContact CD1-CE2 3.88Å; L182-F189 HydrophobicContact CD1-CG 4.02Å; L182-F189 HydrophobicContact CD1-CZ 4.14Å; L182-Y240 HydrophobicContact CD2-CD2 3.63Å; L182-Y240 HydrophobicContact CD2-CE2 4.48Å; L182-Y240 HydrophobicContact CD2-CG 3.98Å
183	Q	95.4	Very high	97.1	Very high	21 Å²	21	13.8 Å²	13.8	10%	0.098	6%	0.061	C	C	.	.	H	α-helix	trans	-64.3	-45.1	173.8	-69.8	172.1	-22.1	0	0	112.1	W147 V179 V181 Q185 R186 F189	W147-Q183 HydrophobicContact CD2-CG 3.79Å; W147-Q183 HydrophobicContact CE3-CG 4.13Å; W147-Q183 HydrophobicContact CG-CG 4.17Å; W147-Q183 HydrophobicContact CH2-CB 4.2Å; W147-Q183 HydrophobicContact CH2-CG 4.42Å; W147-Q183 HydrophobicContact CZ2-CB 4.18Å; W147-Q183 HydrophobicContact CZ2-CG 4.12Å; W147-Q183 HydrophobicContact CZ3-CB 4.41Å; W147-Q183 HydrophobicContact CZ3-CG 4.42Å; V179-Q183 HydrophobicContact CG1-CG 4.49Å; V179-Q183 VanDerWaalsContact O-CG 3.3Å; V179-Q183 WeakPolarHBondContact O-CG 3.47Å; V179-Q183 PolarHBondContact O-N 3.19Å; V179-Q183 VanDerWaalsContact O-N 3.08Å; V181-Q183 VanDerWaalsContact C-N 3.27Å; V181-Q183 PolarHBondContact O-N 3.46Å; Q183-Q185 PolarHBondContact O-N 3.36Å; Q183-R186 PolarHBondContact O-N 3.44Å; Q183-F189 HydrophobicContact CG-CE1 4.17Å; Q183-F189 HydrophobicContact CG-CZ 4.31Å
184	K	94.1	Very high	97.2	Very high	63 Å²	63	13.6 Å²	13.6	27%	0.274	6%	0.06	S	C	.	.	H	α-helix	trans	-60.9	-32	174	-75.4	175.2	-174.4	177.1	0	112.7	L111 P180 V181 R186 D236	L111-K184 WeakPolarHBondContact CD1-O 3.43Å; P180-K184 VanDerWaalsContact O-CG 3.31Å; P180-K184 WeakPolarHBondContact O-CG 3.49Å; P180-K184 PolarHBondContact O-N 2.83Å; V181-K184 WeakPolarHBondContact O-CB 3.48Å; V181-K184 PolarHBondContact O-N 2.95Å; V181-K184 VanDerWaalsContact O-N 3.16Å; K184-R186 PolarHBondContact O-N 2.87Å; K184-D236 IonicContact NZ-OD2 3.83Å
185	Q	95.7	Very high	97.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-2.7	174.9	-69.6	-177.1	0.4	0	0	113.1	M114 V181 L182 Q183 L187 D236 N238 Y239	M114-Q185 HydrophobicContact CE-CG 4.15Å; V181-Q185 HydrophobicContact CG1-CG 4.44Å; V181-Q185 VanDerWaalsContact O-CG 3.32Å; V181-Q185 WeakPolarHBondContact O-CG 3.38Å; V181-Q185 PolarHBondContact O-N 2.85Å; L182-Q185 PolarHBondContact O-N 3.48Å; Q183-Q185 PolarHBondContact O-N 3.36Å; Q185-L187 HydrophobicContact CB-CD1 4.11Å; Q185-L187 HydrophobicContact CB-CG 3.99Å; Q185-L187 PolarHBondContact O-N 3Å; Q185-L187 VanDerWaalsContact O-N 3.17Å; Q185-D236 PolarHBondContact NE2-O 2.98Å; Q185-N238 PolarHBondContact NE2-O 2.77Å; Q185-Y239 HydrophobicContact CB-CD2 3.91Å; Q185-Y239 HydrophobicContact CB-CE2 3.84Å; Q185-Y239 HydrophobicContact CG-CD2 3.94Å; Q185-Y239 HydrophobicContact CG-CE2 4.38Å; Q185-Y239 WeakPolarHBondContact O-CE2 3.45Å
186	R	95.1	Very high	97.2	Very high	66 Å²	66	15.6 Å²	15.6	25%	0.249	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	35.4	178.8	-58	-66.5	-175.4	-175.1	-7.5	113.5	Y101 C107 L111 P149 D151 L182 Q183 K184	Y101-R186 PolarHBondContact OH-NE 3.21Å; C107-R186 HydrophobicContact CB-CB 3.94Å; L111-R186 HydrophobicContact CD1-CB 4.11Å; L111-R186 HydrophobicContact CD1-CG 3.28Å; P149-R186 HydrophobicContact CB-CB 4.44Å; P149-R186 HydrophobicContact CG-CB 4.45Å; D151-R186 VanDerWaalsContact CG-NH1 3.31Å; D151-R186 IonicContact OD1-CZ 3.89Å; D151-R186 IonicContact OD1-NE 3.62Å; D151-R186 IonicContact OD1-NH1 2.73Å; D151-R186 PolarHBondContact OD1-NH1 2.77Å; D151-R186 IonicContact OD2-CZ 3.45Å; D151-R186 IonicContact OD2-NE 2.74Å; D151-R186 PolarHBondContact OD2-NE 3.41Å; D151-R186 IonicContact OD2-NH1 3.93Å; D151-R186 PolarHBondContact OD2-NH1 3.28Å; D151-R186 IonicContact OD2-NH2 3.31Å; D151-R186 PolarHBondContact OD2-NH2 3.36Å; L182-R186 PolarHBondContact O-N 3.24Å; Q183-R186 PolarHBondContact O-N 3.44Å; K184-R186 PolarHBondContact O-N 2.87Å
187	L	96.5	Very high	97.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.07	C	C	.	.			trans	-79.2	144.2	174.9	-62.6	172.9	0	0	0	110	W147 W156 V158 L182 Q185 F189 Y239	W147-L187 WeakPolarHBondContact CZ3-O 3.22Å; W156-L187 HydrophobicContact CB-CD2 4.14Å; V158-L187 HydrophobicContact CG2-CD1 4.39Å; V158-L187 HydrophobicContact CG2-CD2 4.07Å; L182-L187 HydrophobicContact CD2-CD1 3.9Å; L182-L187 PolarHBondContact O-N 3.35Å; Q185-L187 HydrophobicContact CB-CD1 4.11Å; Q185-L187 HydrophobicContact CB-CG 3.99Å; Q185-L187 PolarHBondContact O-N 3Å; Q185-L187 VanDerWaalsContact O-N 3.17Å; L187-F189 HydrophobicContact CB-CD1 4.27Å; L187-Y239 HydrophobicContact CD2-CE1 4.46Å; L187-Y239 HydrophobicContact CD2-CE2 3.84Å; L187-Y239 WeakPolarHBondContact CD2-OH 3.36Å; L187-Y239 HydrophobicContact CG-CE2 4.32Å
188	Q	98	Very high	96.7	Very high	28 Å²	28	15.9 Å²	15.9	13%	0.131	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	117.7	157.9	172.5	172.5	-12.5	0	0	107	F146 W147 K148 P154 W156 K157 V158 L219	F146-Q188 HydrophobicContact CE2-CG 3.99Å; F146-Q188 HydrophobicContact CZ-CG 3.97Å; W147-Q188 CarbonylContact O-C 3.59Å; W147-Q188 WeakPolarHBondContact O-CA 3.25Å; K148-Q188 HydrophobicContact CB-CB 4.19Å; K148-Q188 HydrophobicContact CB-CG 4.02Å; P154-Q188 HydrophobicContact CB-CB 3.61Å; P154-Q188 HydrophobicContact CG-CB 3.71Å; P154-Q188 VanDerWaalsContact CG-OE1 3.3Å; W156-Q188 PolarHBondContact O-N 3.09Å; K157-Q188 CarbonylContact C-O 3.59Å; K157-Q188 VanDerWaalsContact CA-O 3.26Å; K157-Q188 WeakPolarHBondContact CA-O 3.49Å; K157-Q188 HydrophobicContact CG-CB 4.35Å; K157-Q188 HydrophobicContact CG-CG 4.24Å; V158-Q188 PolarHBondContact N-O 2.94Å; Q188-L219 VanDerWaalsContact NE2-CD2 3.33Å
189	F	98.4	Very high	96.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	161.2	-174.4	71	-92.6	0	0	0	113.1	M141 F146 W147 V158 V179 L182 Q183 L187 L191	M141-F189 HydrophobicContact SD-CZ 4.48Å; F146-F189 WeakPolarHBondContact CA-O 3.43Å; W147-F189 HydrophobicContact CB-CD1 4.31Å; W147-F189 HydrophobicContact CB-CE1 3.75Å; W147-F189 HydrophobicContact CB-CE2 4.35Å; W147-F189 HydrophobicContact CB-CZ 3.77Å; W147-F189 HydrophobicContact CD2-CE1 4.13Å; W147-F189 HydrophobicContact CE3-CD1 4.07Å; W147-F189 AromaticContact CE3-CE1 3.68Å; W147-F189 HydrophobicContact CE3-CE1 3.68Å; W147-F189 HydrophobicContact CG-CE1 4.19Å; W147-F189 HydrophobicContact CG-CZ 4.42Å; W147-F189 PolarHBondContact N-O 3.32Å; W147-F189 PolarHBondContact O-N 3.3Å; V158-F189 WeakPolarHBondContact O-CA 3.42Å; V158-F189 WeakPolarHBondContact O-CB 3.35Å; V179-F189 HydrophobicContact CG1-CZ 4.44Å; L182-F189 HydrophobicContact CB-CD1 3.69Å; L182-F189 HydrophobicContact CB-CE1 3.42Å; L182-F189 VanDerWaalsContact CB-CE1 3.42Å; L182-F189 HydrophobicContact CB-CE2 4.41Å; L182-F189 HydrophobicContact CB-CG 4.29Å; L182-F189 HydrophobicContact CB-CZ 3.83Å; L182-F189 HydrophobicContact CD1-CD1 4.27Å; L182-F189 HydrophobicContact CD1-CD2 3.81Å; L182-F189 HydrophobicContact CD1-CE1 4.32Å; L182-F189 HydrophobicContact CD1-CE2 3.88Å; L182-F189 HydrophobicContact CD1-CG 4.02Å; L182-F189 HydrophobicContact CD1-CZ 4.14Å; Q183-F189 HydrophobicContact CG-CE1 4.17Å; Q183-F189 HydrophobicContact CG-CZ 4.31Å; L187-F189 HydrophobicContact CB-CD1 4.27Å; F189-L191 HydrophobicContact CD2-CD1 4.48Å; F189-L191 HydrophobicContact CD2-CG 4.33Å; F189-L191 HydrophobicContact CE2-CD1 3.96Å; F189-L191 HydrophobicContact CE2-CG 4.3Å
190	A	98.5	Very high	96	Very high	3 Å²	3	25.9 Å²	25.9	3%	0.025	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	147.6	162.7	0	0	0	0	0	110.1	G145 F146 V158 I160 Y192 W221	G145-A190 WeakPolarHBondContact O-CA 3.42Å; F146-A190 HydrophobicContact CD2-CB 4.36Å; V158-A190 PolarHBondContact O-N 3.31Å; I160-A190 PolarHBondContact N-O 2.92Å; A190-Y192 HydrophobicContact CB-CD2 4.45Å; A190-Y192 HydrophobicContact CB-CE2 3.67Å; A190-W221 HydrophobicContact CB-CH2 3.49Å; A190-W221 VanDerWaalsContact CB-CH2 3.49Å; A190-W221 HydrophobicContact CB-CZ2 3.49Å; A190-W221 VanDerWaalsContact CB-CZ2 3.49Å
191	L	98.7	Very high	95.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.1	178.2	-74.3	152.3	0	0	0	109.6	I160 L175 L178 V179 F189 L364 F365 T366	I160-L191 HydrophobicContact CB-CD2 3.8Å; I160-L191 HydrophobicContact CB-CG 4.49Å; I160-L191 HydrophobicContact CG1-CD2 4.27Å; I160-L191 HydrophobicContact CG2-CD2 3.78Å; L175-L191 HydrophobicContact CD2-CD1 3.87Å; L178-L191 HydrophobicContact CD2-CD2 4.13Å; V179-L191 HydrophobicContact CG2-CD1 3.63Å; F189-L191 HydrophobicContact CD2-CD1 4.48Å; F189-L191 HydrophobicContact CD2-CG 4.33Å; F189-L191 HydrophobicContact CE2-CD1 3.96Å; F189-L191 HydrophobicContact CE2-CG 4.3Å; L191-L364 WeakPolarHBondContact CD1-O 3.42Å; L191-F365 HydrophobicContact CB-CB 3.85Å; L191-F365 CarbonylContact O-C 3.45Å; L191-F365 WeakPolarHBondContact O-CA 3.5Å; L191-F365 WeakPolarHBondContact O-CB 3.29Å; L191-T366 PolarHBondContact O-N 3.26Å
192	Y	98.9	Very high	95.6	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	115	177.3	-62.8	-87.1	0	0	0	108.9	A159 I160 L161 V162 A190 I194 A215 D218 W221 T366 I368	A159-Y192 HydrophobicContact CB-CD2 4.23Å; A159-Y192 HydrophobicContact CB-CE2 3.95Å; I160-Y192 PolarHBondContact O-N 2.97Å; L161-Y192 HydrophobicContact CD2-CD2 3.85Å; L161-Y192 HydrophobicContact CD2-CG 4.05Å; V162-Y192 PolarHBondContact N-O 3.48Å; A190-Y192 HydrophobicContact CB-CD2 4.45Å; A190-Y192 HydrophobicContact CB-CE2 3.67Å; Y192-I194 WeakPolarHBondContact O-CD1 3.35Å; Y192-A215 HydrophobicContact CD1-CB 4.41Å; Y192-A215 HydrophobicContact CD2-CB 3.91Å; Y192-A215 HydrophobicContact CE1-CB 4.11Å; Y192-A215 HydrophobicContact CE2-CB 3.55Å; Y192-A215 HydrophobicContact CG-CB 4.31Å; Y192-D218 VanDerWaalsContact CE1-OD2 3.23Å; Y192-D218 WeakPolarHBondContact CE1-OD2 3.36Å; Y192-D218 WeakPolarHBondContact OH-CB 3.44Å; Y192-D218 PolarHBondContact OH-OD2 2.95Å; Y192-W221 HydrophobicContact CE2-CZ2 4.23Å; Y192-W221 PolarHBondContact OH-NE1 3.23Å; Y192-T366 WeakPolarHBondContact CA-O 3.41Å; Y192-T366 HydrophobicContact CD1-CG2 4.12Å; Y192-T366 HydrophobicContact CE1-CG2 4.3Å; Y192-I368 HydrophobicContact CD1-CD1 3.89Å
193	V	98.8	Very high	95.6	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	115.7	172.5	179	0	0	0	0	107.1	V162 F164 L171 F365 T366 N367 I368	V162-V193 CarbonylContact O-C 3.58Å; V162-V193 WeakPolarHBondContact O-CA 3.31Å; F164-V193 HydrophobicContact CB-CG1 3.58Å; F164-V193 HydrophobicContact CD1-CG1 4.3Å; F164-V193 HydrophobicContact CD2-CG1 4.31Å; F164-V193 HydrophobicContact CG-CG1 3.81Å; L171-V193 HydrophobicContact CD1-CG2 3.9Å; L171-V193 HydrophobicContact CD2-CG1 4.32Å; L171-V193 HydrophobicContact CD2-CG2 4.21Å; V193-F365 HydrophobicContact CB-CD2 3.67Å; V193-F365 HydrophobicContact CB-CE2 3.97Å; V193-F365 HydrophobicContact CB-CG 4.46Å; V193-F365 HydrophobicContact CG2-CB 4.02Å; V193-F365 HydrophobicContact CG2-CD1 4.41Å; V193-F365 HydrophobicContact CG2-CD2 3.38Å; V193-F365 HydrophobicContact CG2-CE2 3.87Å; V193-F365 HydrophobicContact CG2-CG 3.69Å; V193-T366 PolarHBondContact N-O 3.43Å; V193-N367 CarbonylContact O-C 3.59Å; V193-N367 WeakPolarHBondContact O-CA 3.48Å; V193-N367 PolarHBondContact O-OD1 3.08Å; V193-I368 PolarHBondContact O-N 3.48Å
194	I	98.8	Very high	95.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	99.1	-177	-51.3	91.6	0	0	0	108.5	L161 V162 F164 Y192 L207 V210 I368 V370	L161-I194 HydrophobicContact CB-CD1 3.97Å; L161-I194 HydrophobicContact CD2-CD1 4.47Å; V162-I194 PolarHBondContact O-N 3.49Å; F164-I194 PolarHBondContact N-O 3.31Å; Y192-I194 WeakPolarHBondContact O-CD1 3.35Å; I194-L207 HydrophobicContact CB-CB 4.3Å; I194-L207 HydrophobicContact CB-CD2 4.45Å; I194-L207 HydrophobicContact CG2-CB 4Å; I194-L207 HydrophobicContact CG2-CD2 3.6Å; I194-L207 HydrophobicContact CG2-CG 4.4Å; I194-V210 HydrophobicContact CG2-CB 4.17Å; I194-V210 HydrophobicContact CG2-CG1 3.8Å; I194-I368 CarbonylContact C-O 3.5Å; I194-I368 WeakPolarHBondContact CA-O 3.41Å; I194-I368 HydrophobicContact CG1-CD1 4.3Å; I194-I368 HydrophobicContact CG2-CB 4.5Å; I194-I368 HydrophobicContact CG2-CG2 4.49Å; I194-V370 HydrophobicContact CG2-CG2 4.22Å
195	E	98.2	Very high	95.8	Very high	43 Å²	43	25.8 Å²	25.8	20%	0.201	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	122.2	-174.5	-178.3	171.2	-162.7	0	0	111.7	F164 N367 I368 T369 V370	F164-E195 HydrophobicContact CD1-CB 4.37Å; F164-E195 HydrophobicContact CD1-CG 4.17Å; F164-E195 CarbonylContact O-C 3.29Å; F164-E195 VanDerWaalsContact O-CA 3.3Å; F164-E195 WeakPolarHBondContact O-CA 3.48Å; E195-N367 PolarHBondContact OE2-ND2 3.14Å; E195-I368 PolarHBondContact N-O 3.45Å; E195-T369 HydrophobicContact CB-CG2 4.43Å; E195-T369 HydrophobicContact CG-CG2 4.32Å; E195-T369 CarbonylContact O-C 3.6Å; E195-T369 WeakPolarHBondContact O-CA 3.41Å; E195-T369 PolarHBondContact OE2-OG1 2.76Å; E195-V370 PolarHBondContact O-N 2.98Å
196	Q	97.3	Very high	95.9	Very high	3 Å²	3	25.8 Å²	25.8	1%	0.014	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	111.9	173.1	-170.4	175.7	-32.8	0	0	110.9	F164 R165 P201 F202 L207 L372	F164-Q196 PolarHBondContact O-N 3.04Å; R165-Q196 WeakPolarHBondContact CD-O 3.39Å; Q196-P201 PolarHBondContact NE2-O 3.09Å; Q196-F202 HydrophobicContact CB-CD2 4.19Å; Q196-F202 HydrophobicContact CB-CE2 4.2Å; Q196-L207 HydrophobicContact CB-CD1 3.93Å; Q196-L207 HydrophobicContact CB-CD2 3.85Å; Q196-L207 HydrophobicContact CB-CG 4.41Å; Q196-L207 HydrophobicContact CG-CD2 4.47Å; Q196-L372 HydrophobicContact CG-CD1 4.43Å; Q196-L372 HydrophobicContact CG-CG 4.47Å
197	G	94.3	Very high	96	Very high	19 Å²	19	22.7 Å²	22.7	20%	0.196	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	170.9	169.4	0	0	0	0	0	113.3	V370	G197-V370 PolarHBondContact N-O 3.35Å
198	G	89.9	Confident	96.2	Very high	58 Å²	58	22.7 Å²	22.7	60%	0.598	14%	0.14	S	C	*	.	S	Bend	trans	78	-168.9	176	0	0	0	0	0	114.6
199	T	89.4	Confident	96.2	Very high	144 Å²	144	21.3 Å²	21.3	88%	0.883	13%	0.134	S	C	*	.	S	Bend	trans	-110.9	-3.9	-169.4	53.9	0	0	0	0	114.4
200	E	91	Very high	96.2	Very high	67 Å²	67	21.3 Å²	21.3	31%	0.313	13%	0.134	S	C	.	.	S	Bend	trans	-61.1	155.1	176.5	-71.7	-68.9	160.9	0	0	111.3	R165 W288	R165-E200 PolarHBondContact NH1-O 3.06Å; R165-E200 PolarHBondContact NH2-O 2.86Å; E200-W288 HydrophobicContact CB-CE3 4.27Å; E200-W288 HydrophobicContact CB-CZ3 3.8Å
201	P	91.4	Very high	96.2	Very high	45 Å²	45	21.2 Å²	21.2	29%	0.292	13%	0.132	S	C	.	.	P	Polyproline II helix	trans	-52.4	147.7	174	-26.1	35.2	0	0	0	112.2	Q196 N203 W288	Q196-P201 PolarHBondContact NE2-O 3.09Å; P201-N203 PolarHBondContact O-N 3.49Å; P201-W288 HydrophobicContact CB-CB 4.21Å; P201-W288 VanDerWaalsContact O-CE3 3.25Å
202	F	93.3	Very high	96.2	Very high	31 Å²	31	21.4 Å²	21.4	14%	0.136	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-64.3	133.2	-179.5	-170.2	-118.5	0	0	0	109.4	P163 R165 Q196 R204 L207 G289	P163-F202 HydrophobicContact CB-CZ 3.96Å; R165-F202 HydrophobicContact CB-CD2 3.9Å; R165-F202 HydrophobicContact CB-CE2 3.78Å; Q196-F202 HydrophobicContact CB-CD2 4.19Å; Q196-F202 HydrophobicContact CB-CE2 4.2Å; F202-R204 HydrophobicContact CD1-CB 4.16Å; F202-R204 HydrophobicContact CE1-CB 3.83Å; F202-R204 HydrophobicContact CE1-CG 4.38Å; F202-L207 HydrophobicContact CD2-CD1 4.01Å; F202-L207 HydrophobicContact CE1-CD1 4.4Å; F202-L207 HydrophobicContact CE2-CD1 3.26Å; F202-L207 HydrophobicContact CZ-CD1 3.51Å; F202-G289 PolarHBondContact O-N 3.45Å
203	N	95.5	Very high	96.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.147	C	C	.	.			trans	-123	78.8	-179.8	-169.6	-26	0	0	0	109.5	P201 A205 M206 L207 N285 F287 W288	P201-N203 PolarHBondContact O-N 3.49Å; N203-A205 VanDerWaalsContact C-N 3.28Å; N203-A205 PolarHBondContact O-N 3.3Å; N203-M206 HydrophobicContact CB-CB 4.12Å; N203-M206 PolarHBondContact O-N 3.18Å; N203-M206 WeakPolarHBondContact OD1-CB 3.28Å; N203-M206 PolarHBondContact OD1-N 3Å; N203-L207 VanDerWaalsContact O-CG 3.28Å; N203-L207 WeakPolarHBondContact O-CG 3.36Å; N203-L207 PolarHBondContact O-N 2.96Å; N203-L207 VanDerWaalsContact O-N 3.1Å; N203-N285 PolarHBondContact ND2-O 3.49Å; N203-F287 PolarHBondContact OD1-O 2.95Å; N203-W288 HydrophobicContact CB-CD2 4.22Å; N203-W288 HydrophobicContact CB-CE3 3.99Å; N203-W288 HydrophobicContact CB-CH2 4.29Å; N203-W288 HydrophobicContact CB-CZ3 4.02Å; N203-W288 WeakPolarHBondContact ND2-CZ2 3.48Å; N203-W288 PolarHBondContact ND2-NE1 2.94Å
204	R	96.4	Very high	96.2	Very high	26 Å²	26	25 Å²	25	10%	0.098	15%	0.149	C	C	.	.	H	α-helix	trans	-51.6	-46.3	-179.2	-178.2	178.7	168.3	-89.2	-3.9	112.5	P163 F202 L207 F208 D228 E293	P163-R204 HydrophobicContact CB-CG 4.36Å; P163-R204 HydrophobicContact CG-CG 3.85Å; F202-R204 HydrophobicContact CD1-CB 4.16Å; F202-R204 HydrophobicContact CE1-CB 3.83Å; F202-R204 HydrophobicContact CE1-CG 4.38Å; R204-L207 PolarHBondContact O-N 3.44Å; R204-F208 HydrophobicContact CG-CD2 4.36Å; R204-F208 HydrophobicContact CG-CE2 3.76Å; R204-F208 HydrophobicContact CG-CZ 4.39Å; R204-F208 VanDerWaalsContact CZ-CE2 3.49Å; R204-F208 WeakPolarHBondContact O-CD2 3.41Å; R204-F208 PolarHBondContact O-N 3.3Å; R204-D228 IonicContact CZ-OD1 3.93Å; R204-D228 IonicContact NE-OD1 3.53Å; R204-D228 PolarHBondContact NE-OD1 3.28Å; R204-D228 IonicContact NE-OD2 2.92Å; R204-D228 IonicContact NH2-OD1 3.55Å; R204-D228 PolarHBondContact NH2-OD1 2.87Å; R204-D228 IonicContact NH2-OD2 3.49Å; R204-E293 WeakPolarHBondContact CD-OE1 3.24Å; R204-E293 IonicContact CZ-OE1 3.93Å; R204-E293 IonicContact NE-OE1 2.96Å; R204-E293 IonicContact NH1-OE1 2.69Å; R204-E293 PolarHBondContact NH1-OE1 3.47Å
205	A	97.6	Very high	96.2	Very high	1 Å²	1	25 Å²	25	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-63.4	-46.9	-177.9	0	0	0	0	0	113.1	N203 L207 F208 N209 F283 P284 E293	N203-A205 VanDerWaalsContact C-N 3.28Å; N203-A205 PolarHBondContact O-N 3.3Å; A205-L207 VanDerWaalsContact C-N 3.32Å; A205-L207 PolarHBondContact O-N 2.93Å; A205-F208 PolarHBondContact O-N 3.36Å; A205-N209 PolarHBondContact O-N 3.44Å; A205-F283 HydrophobicContact CB-CB 3.98Å; A205-F283 HydrophobicContact CB-CD1 4.06Å; A205-F283 HydrophobicContact CB-CG 4.32Å; A205-F283 WeakPolarHBondContact O-CB 3.27Å; A205-P284 HydrophobicContact CB-CG 4.38Å; A205-P284 WeakPolarHBondContact CB-O 3.48Å; A205-E293 HydrophobicContact CB-CB 3.8Å; A205-E293 HydrophobicContact CB-CG 3.82Å
206	M	97.6	Very high	96.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.7	-35.2	177.6	-169.6	177.2	-176.3	0	0	111.7	N203 F208 N209 V210 N285 W288 L353 L372 L376 A377	N203-M206 HydrophobicContact CB-CB 4.12Å; N203-M206 PolarHBondContact O-N 3.18Å; N203-M206 WeakPolarHBondContact OD1-CB 3.28Å; N203-M206 PolarHBondContact OD1-N 3Å; M206-F208 VanDerWaalsContact C-N 3.35Å; M206-F208 PolarHBondContact O-N 2.97Å; M206-N209 WeakPolarHBondContact O-CB 3.49Å; M206-N209 PolarHBondContact O-N 2.92Å; M206-V210 WeakPolarHBondContact O-CG2 3.47Å; M206-V210 PolarHBondContact O-N 3.22Å; M206-N285 HydrophobicContact CB-CB 4.36Å; M206-N285 HydrophobicContact CG-CB 4.15Å; M206-N285 WeakPolarHBondContact CG-OD1 3.33Å; M206-N285 HydrophobicContact SD-CB 4.32Å; M206-W288 HydrophobicContact SD-CH2 4.21Å; M206-W288 HydrophobicContact SD-CZ2 3.89Å; M206-L353 HydrophobicContact CE-CD1 3.53Å; M206-L353 HydrophobicContact CG-CD1 3.56Å; M206-L353 HydrophobicContact SD-CD1 4.4Å; M206-L372 HydrophobicContact CB-CD1 4.18Å; M206-L372 HydrophobicContact CE-CD2 3.92Å; M206-L372 HydrophobicContact CG-CD1 3.94Å; M206-L372 HydrophobicContact SD-CB 4.23Å; M206-L372 HydrophobicContact SD-CD1 3.91Å; M206-L372 HydrophobicContact SD-CD2 4.2Å; M206-L372 HydrophobicContact SD-CG 4.35Å; M206-L376 HydrophobicContact CE-CB 4.11Å; M206-A377 HydrophobicContact CE-CB 3.86Å; M206-A377 HydrophobicContact SD-CB 4.47Å
207	L	98.6	Very high	96.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-36.2	175	-66.4	165.3	0	0	0	112.5	P163 I194 Q196 F202 N203 R204 A205 N209 V210 G211 V370 L372	P163-L207 HydrophobicContact CB-CB 3.84Å; P163-L207 HydrophobicContact CB-CD1 3.83Å; I194-L207 HydrophobicContact CB-CB 4.3Å; I194-L207 HydrophobicContact CB-CD2 4.45Å; I194-L207 HydrophobicContact CG2-CB 4Å; I194-L207 HydrophobicContact CG2-CD2 3.6Å; I194-L207 HydrophobicContact CG2-CG 4.4Å; Q196-L207 HydrophobicContact CB-CD1 3.93Å; Q196-L207 HydrophobicContact CB-CD2 3.85Å; Q196-L207 HydrophobicContact CB-CG 4.41Å; Q196-L207 HydrophobicContact CG-CD2 4.47Å; F202-L207 HydrophobicContact CD2-CD1 4.01Å; F202-L207 HydrophobicContact CE1-CD1 4.4Å; F202-L207 HydrophobicContact CE2-CD1 3.26Å; F202-L207 HydrophobicContact CZ-CD1 3.51Å; N203-L207 VanDerWaalsContact O-CG 3.28Å; N203-L207 WeakPolarHBondContact O-CG 3.36Å; N203-L207 PolarHBondContact O-N 2.96Å; N203-L207 VanDerWaalsContact O-N 3.1Å; R204-L207 PolarHBondContact O-N 3.44Å; A205-L207 VanDerWaalsContact C-N 3.32Å; A205-L207 PolarHBondContact O-N 2.93Å; L207-N209 VanDerWaalsContact C-N 3.34Å; L207-V210 PolarHBondContact O-N 3.21Å; L207-G211 PolarHBondContact O-N 2.9Å; L207-V370 HydrophobicContact CD2-CG2 3.71Å; L207-L372 HydrophobicContact CD2-CD1 3.6Å; L207-L372 HydrophobicContact CG-CD1 3.98Å
208	F	98.8	Very high	96.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-39.3	171.7	-71.8	-51.9	0	0	0	112.6	L161 P163 R204 A205 M206 G211 F212 F226 F283	L161-F208 HydrophobicContact CB-CD1 3.92Å; L161-F208 HydrophobicContact CB-CE1 4.3Å; L161-F208 WeakPolarHBondContact O-CE1 3.36Å; P163-F208 VanDerWaalsContact CD-CE1 3.41Å; P163-F208 HydrophobicContact CG-CD1 4.46Å; P163-F208 HydrophobicContact CG-CE1 3.78Å; P163-F208 HydrophobicContact CG-CE2 4.17Å; P163-F208 HydrophobicContact CG-CZ 3.58Å; R204-F208 HydrophobicContact CG-CD2 4.36Å; R204-F208 HydrophobicContact CG-CE2 3.76Å; R204-F208 HydrophobicContact CG-CZ 4.39Å; R204-F208 VanDerWaalsContact CZ-CE2 3.49Å; R204-F208 WeakPolarHBondContact O-CD2 3.41Å; R204-F208 PolarHBondContact O-N 3.3Å; A205-F208 PolarHBondContact O-N 3.36Å; M206-F208 VanDerWaalsContact C-N 3.35Å; M206-F208 PolarHBondContact O-N 2.97Å; F208-G211 PolarHBondContact O-N 3.42Å; F208-F212 WeakPolarHBondContact O-CB 3.33Å; F208-F212 PolarHBondContact O-N 2.82Å; F208-F226 HydrophobicContact CB-CD1 3.95Å; F208-F226 HydrophobicContact CB-CE1 4.25Å; F208-F226 HydrophobicContact CD1-CB 3.97Å; F208-F226 AromaticContact CD1-CD1 3.52Å; F208-F226 HydrophobicContact CD1-CD1 3.52Å; F208-F226 HydrophobicContact CD1-CG 4.19Å; F208-F226 HydrophobicContact CD2-CB 4.39Å; F208-F226 HydrophobicContact CD2-CD1 4.36Å; F208-F226 HydrophobicContact CE1-CB 3.53Å; F208-F226 AromaticContact CE1-CD1 4Å; F208-F226 HydrophobicContact CE1-CD1 4Å; F208-F226 HydrophobicContact CE1-CG 4.25Å; F208-F226 HydrophobicContact CE2-CB 4.04Å; F208-F226 HydrophobicContact CG-CB 4.37Å; F208-F226 AromaticContact CG-CD1 3.72Å; F208-F226 HydrophobicContact CG-CD1 3.72Å; F208-F226 HydrophobicContact CG-CE1 4.49Å; F208-F226 HydrophobicContact CG-CG 4.37Å; F208-F226 HydrophobicContact CZ-CB 3.6Å; F208-F283 HydrophobicContact CB-CD2 3.63Å; F208-F283 HydrophobicContact CB-CE2 3.8Å; F208-F283 HydrophobicContact CB-CG 4.42Å; F208-F283 HydrophobicContact CD2-CD2 4.07Å; F208-F283 HydrophobicContact CD2-CE1 4.13Å; F208-F283 AromaticContact CD2-CE2 3.69Å; F208-F283 HydrophobicContact CD2-CE2 3.69Å; F208-F283 HydrophobicContact CD2-CG 4.49Å; F208-F283 AromaticContact CD2-CZ 3.7Å; F208-F283 HydrophobicContact CD2-CZ 3.7Å; F208-F283 HydrophobicContact CE2-CE2 4.5Å; F208-F283 HydrophobicContact CE2-CZ 4.15Å; F208-F283 HydrophobicContact CG-CD2 4.22Å; F208-F283 AromaticContact CG-CE2 3.94Å; F208-F283 HydrophobicContact CG-CE2 3.94Å; F208-F283 HydrophobicContact CG-CZ 4.39Å
209	N	98.8	Very high	96.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-41.6	175.1	-75.6	-21.9	0	0	0	112	A205 M206 L207 K213 F277 F283 N285 L350 L353	A205-N209 PolarHBondContact O-N 3.44Å; M206-N209 WeakPolarHBondContact O-CB 3.49Å; M206-N209 PolarHBondContact O-N 2.92Å; L207-N209 VanDerWaalsContact C-N 3.34Å; N209-K213 WeakPolarHBondContact O-CG 3.2Å; N209-K213 PolarHBondContact O-N 2.9Å; N209-F277 VanDerWaalsContact OD1-CZ 3.26Å; N209-F277 WeakPolarHBondContact OD1-CZ 3.17Å; N209-F283 PolarHBondContact ND2-O 3.21Å; N209-F283 PolarHBondContact OD1-N 2.83Å; N209-N285 PolarHBondContact ND2-OD1 3.35Å; N209-L350 HydrophobicContact CB-CD2 3.89Å; N209-L353 HydrophobicContact CB-CD1 4.47Å; N209-L353 HydrophobicContact CB-CD2 3.85Å
210	V	98.8	Very high	97.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-51.5	172.2	168.2	0	0	0	0	110.5	I194 M206 L207 F212 K213 E214 L353 Y355 I368 V370 L372	I194-V210 HydrophobicContact CG2-CB 4.17Å; I194-V210 HydrophobicContact CG2-CG1 3.8Å; M206-V210 WeakPolarHBondContact O-CG2 3.47Å; M206-V210 PolarHBondContact O-N 3.22Å; L207-V210 PolarHBondContact O-N 3.21Å; V210-F212 VanDerWaalsContact C-N 3.28Å; V210-F212 PolarHBondContact O-N 3.48Å; V210-K213 PolarHBondContact O-N 2.96Å; V210-K213 VanDerWaalsContact O-N 3.1Å; V210-E214 PolarHBondContact O-N 3.13Å; V210-L353 HydrophobicContact CG2-CD1 4.25Å; V210-L353 HydrophobicContact CG2-CD2 4.16Å; V210-Y355 HydrophobicContact CB-CE2 4.47Å; V210-Y355 HydrophobicContact CG1-CD2 3.96Å; V210-Y355 HydrophobicContact CG1-CE2 3.76Å; V210-Y355 HydrophobicContact CG2-CD1 3.95Å; V210-Y355 HydrophobicContact CG2-CD2 4.07Å; V210-Y355 HydrophobicContact CG2-CE1 4.21Å; V210-Y355 HydrophobicContact CG2-CE2 4.33Å; V210-Y355 HydrophobicContact CG2-CG 3.88Å; V210-I368 HydrophobicContact CG1-CG2 4.04Å; V210-V370 HydrophobicContact CG1-CG1 3.89Å; V210-V370 HydrophobicContact CG1-CG2 4.25Å; V210-L372 HydrophobicContact CG2-CD2 4.38Å
211	G	98.8	Very high	97.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.2	-42.3	179.7	0	0	0	0	0	112.4	L207 F208 E214 A215	L207-G211 PolarHBondContact O-N 2.9Å; F208-G211 PolarHBondContact O-N 3.42Å; G211-E214 PolarHBondContact O-N 2.94Å; G211-A215 WeakPolarHBondContact O-CB 3.42Å; G211-A215 PolarHBondContact O-N 3.35Å
212	F	98.8	Very high	97.8	Very high	5 Å²	5	30 Å²	30	2%	0.022	15%	0.146	C	C	.	.	H	α-helix	trans	-59.6	-52.1	173.5	166.6	-107.4	0	0	0	112	L161 F208 V210 E214 A215 I216 L224 V274 F277 K278 L350	L161-F212 HydrophobicContact CD1-CB 4.24Å; F208-F212 WeakPolarHBondContact O-CB 3.33Å; F208-F212 PolarHBondContact O-N 2.82Å; V210-F212 VanDerWaalsContact C-N 3.28Å; V210-F212 PolarHBondContact O-N 3.48Å; F212-E214 VanDerWaalsContact C-N 3.26Å; F212-E214 PolarHBondContact O-N 3.45Å; F212-A215 PolarHBondContact O-N 2.76Å; F212-I216 HydrophobicContact CD2-CG2 3.8Å; F212-I216 HydrophobicContact CE2-CG2 3.41Å; F212-I216 VanDerWaalsContact CE2-CG2 3.41Å; F212-I216 HydrophobicContact CZ-CG2 3.93Å; F212-I216 WeakPolarHBondContact O-CG1 3.06Å; F212-I216 WeakPolarHBondContact O-CG2 3.5Å; F212-I216 PolarHBondContact O-N 2.8Å; F212-I216 VanDerWaalsContact O-N 3.09Å; F212-L224 HydrophobicContact CB-CD1 4.35Å; F212-L224 HydrophobicContact CD2-CD1 3.29Å; F212-L224 HydrophobicContact CD2-CD2 3.81Å; F212-L224 HydrophobicContact CD2-CG 4.13Å; F212-L224 HydrophobicContact CE2-CD1 3.84Å; F212-L224 HydrophobicContact CG-CD1 4.11Å; F212-V274 HydrophobicContact CE2-CG1 4.06Å; F212-V274 HydrophobicContact CE2-CG2 4.35Å; F212-V274 HydrophobicContact CZ-CG1 4.47Å; F212-F277 HydrophobicContact CB-CD1 4.17Å; F212-F277 HydrophobicContact CB-CE1 3.59Å; F212-F277 HydrophobicContact CB-CZ 4.46Å; F212-F277 AromaticContact CD1-CD1 3.83Å; F212-F277 HydrophobicContact CD1-CD1 3.83Å; F212-F277 AromaticContact CD1-CE1 3.66Å; F212-F277 HydrophobicContact CD1-CE1 3.66Å; F212-F277 AromaticContact CD2-CD1 3.73Å; F212-F277 HydrophobicContact CD2-CD1 3.73Å; F212-F277 HydrophobicContact CD2-CE1 4.04Å; F212-F277 HydrophobicContact CE1-CD1 4.1Å; F212-F277 HydrophobicContact CE1-CE1 4.33Å; F212-F277 AromaticContact CE2-CD1 3.98Å; F212-F277 HydrophobicContact CE2-CD1 3.98Å; F212-F277 AromaticContact CG-CD1 3.61Å; F212-F277 HydrophobicContact CG-CD1 3.61Å; F212-F277 AromaticContact CG-CE1 3.46Å; F212-F277 HydrophobicContact CG-CE1 3.46Å; F212-F277 VanDerWaalsContact CG-CE1 3.46Å; F212-F277 HydrophobicContact CZ-CD1 4.15Å; F212-K278 HydrophobicContact CE1-CG 4.35Å; F212-K278 HydrophobicContact CZ-CD 4.31Å; F212-K278 HydrophobicContact CZ-CG 3.7Å; F212-L350 HydrophobicContact CD1-CD1 3.96Å; F212-L350 HydrophobicContact CD1-CD2 3.56Å; F212-L350 HydrophobicContact CD1-CG 4.42Å; F212-L350 HydrophobicContact CE1-CD1 3.66Å; F212-L350 HydrophobicContact CE1-CD2 4.04Å; F212-L350 HydrophobicContact CE1-CG 4.5Å
213	K	98.7	Very high	98.1	Very high	73 Å²	73	28.5 Å²	28.5	32%	0.317	14%	0.139	S	C	.	.	H	α-helix	trans	-61.6	-33.1	-177.4	-74.8	-84.7	-171.7	164.9	0	112.7	N209 V210 I216 K217 L350 L353 Y355	N209-K213 WeakPolarHBondContact O-CG 3.2Å; N209-K213 PolarHBondContact O-N 2.9Å; V210-K213 PolarHBondContact O-N 2.96Å; V210-K213 VanDerWaalsContact O-N 3.1Å; K213-I216 WeakPolarHBondContact O-CG1 3.38Å; K213-K217 WeakPolarHBondContact O-CE 3.43Å; K213-K217 WeakPolarHBondContact O-CG 3.41Å; K213-L350 WeakPolarHBondContact CE-O 3.29Å; K213-L350 HydrophobicContact CG-CD2 4.37Å; K213-L350 PolarHBondContact NZ-O 2.87Å; K213-L353 HydrophobicContact CG-CD2 4.11Å; K213-Y355 HydrophobicContact CB-CE1 4.41Å; K213-Y355 WeakPolarHBondContact CB-OH 3.47Å
214	E	98.8	Very high	98.2	Very high	9 Å²	9	28.5 Å²	28.5	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-78.8	-45.4	174.2	-64.4	-47.2	125.1	0	0	112.3	V210 G211 F212 I216 K217 Y355 I359 I368	V210-E214 PolarHBondContact O-N 3.13Å; G211-E214 PolarHBondContact O-N 2.94Å; F212-E214 VanDerWaalsContact C-N 3.26Å; F212-E214 PolarHBondContact O-N 3.45Å; E214-I216 VanDerWaalsContact C-N 3.3Å; E214-I216 PolarHBondContact O-N 3.5Å; E214-K217 VanDerWaalsContact O-CB 3.31Å; E214-K217 WeakPolarHBondContact O-CB 3.46Å; E214-K217 PolarHBondContact O-N 3.04Å; E214-K217 IonicContact OE1-NZ 3.72Å; E214-K217 PolarHBondContact OE1-NZ 2.79Å; E214-K217 WeakPolarHBondContact OE2-CE 3.33Å; E214-K217 IonicContact OE2-NZ 3.08Å; E214-K217 PolarHBondContact OE2-NZ 2.82Å; E214-Y355 HydrophobicContact CG-CE2 4.29Å; E214-Y355 WeakPolarHBondContact OE1-CE2 3.08Å; E214-Y355 VanDerWaalsContact OE1-CZ 3.27Å; E214-Y355 PolarHBondContact OE1-OH 2.87Å; E214-I359 WeakPolarHBondContact OE2-CD1 3.23Å; E214-I368 HydrophobicContact CB-CD1 3.51Å; E214-I368 HydrophobicContact CB-CG1 4.44Å; E214-I368 HydrophobicContact CG-CD1 3.9Å; E214-I368 HydrophobicContact CG-CG1 4.47Å; E214-I368 HydrophobicContact CG-CG2 4.02Å
215	A	98.6	Very high	98.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.3	-39.8	-177.9	0	0	0	0	0	112.6	A159 L161 Y192 G211 F212 K217 D218 L219 W221	A159-A215 HydrophobicContact CB-CB 4.01Å; L161-A215 HydrophobicContact CD2-CB 4.14Å; Y192-A215 HydrophobicContact CD1-CB 4.41Å; Y192-A215 HydrophobicContact CD2-CB 3.91Å; Y192-A215 HydrophobicContact CE1-CB 4.11Å; Y192-A215 HydrophobicContact CE2-CB 3.55Å; Y192-A215 HydrophobicContact CG-CB 4.31Å; G211-A215 WeakPolarHBondContact O-CB 3.42Å; G211-A215 PolarHBondContact O-N 3.35Å; F212-A215 PolarHBondContact O-N 2.76Å; A215-K217 PolarHBondContact O-N 3.14Å; A215-K217 VanDerWaalsContact O-N 3.16Å; A215-D218 PolarHBondContact O-N 2.91Å; A215-D218 VanDerWaalsContact O-N 3.12Å; A215-L219 PolarHBondContact O-N 3.31Å; A215-W221 VanDerWaalsContact O-CD1 3.23Å; A215-W221 PolarHBondContact O-NE1 3.5Å
216	I	98.1	Very high	98.4	Very high	63 Å²	63	27.2 Å²	27.2	32%	0.323	13%	0.134	S	C	.	.	H	α-helix	trans	-67.6	-10.7	178.3	61.9	147.6	0	0	0	114.2	F212 K213 E214	F212-I216 HydrophobicContact CD2-CG2 3.8Å; F212-I216 HydrophobicContact CE2-CG2 3.41Å; F212-I216 VanDerWaalsContact CE2-CG2 3.41Å; F212-I216 HydrophobicContact CZ-CG2 3.93Å; F212-I216 WeakPolarHBondContact O-CG1 3.06Å; F212-I216 WeakPolarHBondContact O-CG2 3.5Å; F212-I216 PolarHBondContact O-N 2.8Å; F212-I216 VanDerWaalsContact O-N 3.09Å; K213-I216 WeakPolarHBondContact O-CG1 3.38Å; E214-I216 VanDerWaalsContact C-N 3.3Å; E214-I216 PolarHBondContact O-N 3.5Å
217	K	97.9	Very high	98.4	Very high	135 Å²	135	27.3 Å²	27.3	59%	0.587	13%	0.134	S	C	*	.	H	α-helix	trans	-80.8	-27.5	173.7	-59.6	174.4	-171.6	170.5	0	111.8	K213 E214 A215	K213-K217 WeakPolarHBondContact O-CE 3.43Å; K213-K217 WeakPolarHBondContact O-CG 3.41Å; E214-K217 VanDerWaalsContact O-CB 3.31Å; E214-K217 WeakPolarHBondContact O-CB 3.46Å; E214-K217 PolarHBondContact O-N 3.04Å; E214-K217 IonicContact OE1-NZ 3.72Å; E214-K217 PolarHBondContact OE1-NZ 2.79Å; E214-K217 WeakPolarHBondContact OE2-CE 3.33Å; E214-K217 IonicContact OE2-NZ 3.08Å; E214-K217 PolarHBondContact OE2-NZ 2.82Å; A215-K217 PolarHBondContact O-N 3.14Å; A215-K217 VanDerWaalsContact O-N 3.16Å
218	D	96.8	Very high	98.4	Very high	72 Å²	72	28.6 Å²	28.6	39%	0.385	14%	0.141	S	C	.	.	H	α-helix	trans	-83.6	-40.7	-178.2	-69.7	-28.5	0	0	0	111.9	Y192 A215 R361	Y192-D218 VanDerWaalsContact CE1-OD2 3.23Å; Y192-D218 WeakPolarHBondContact CE1-OD2 3.36Å; Y192-D218 WeakPolarHBondContact OH-CB 3.44Å; Y192-D218 PolarHBondContact OH-OD2 2.95Å; A215-D218 PolarHBondContact O-N 2.91Å; A215-D218 VanDerWaalsContact O-N 3.12Å; D218-R361 IonicContact OD1-NH2 3.16Å; D218-R361 PolarHBondContact OD1-NH2 3.18Å
219	L	97.1	Very high	98.3	Very high	53 Å²	53	29 Å²	29	28%	0.277	14%	0.144	S	C	.	.			trans	-153.6	152.8	-177.9	-165.2	68.8	0	0	0	111.7	F146 K157 Q188 A215 W221	F146-L219 HydrophobicContact CE2-CD2 4.39Å; K157-L219 HydrophobicContact CB-CD2 4.35Å; K157-L219 HydrophobicContact CD-CD2 4.02Å; K157-L219 HydrophobicContact CD-CG 4.5Å; K157-L219 HydrophobicContact CG-CD2 4.25Å; Q188-L219 VanDerWaalsContact NE2-CD2 3.33Å; A215-L219 PolarHBondContact O-N 3.31Å; L219-W221 VanDerWaalsContact C-N 3.28Å; L219-W221 HydrophobicContact CB-CD2 4.09Å; L219-W221 HydrophobicContact CB-CG 4.46Å; L219-W221 HydrophobicContact CB-CH2 4.48Å; L219-W221 HydrophobicContact CB-CZ2 3.86Å; L219-W221 HydrophobicContact CD2-CD2 4.11Å; L219-W221 HydrophobicContact CD2-CE3 3.86Å; L219-W221 HydrophobicContact CD2-CH2 3.73Å; L219-W221 HydrophobicContact CD2-CZ2 3.98Å; L219-W221 HydrophobicContact CD2-CZ3 3.67Å; L219-W221 PolarHBondContact O-N 2.87Å
220	D	97.6	Very high	98.1	Very high	115 Å²	115	29.4 Å²	29.4	62%	0.615	15%	0.146	S	C	*	.			trans	-71	83.4	162.9	174.6	28.8	0	0	0	109.9	K157	K157-D220 WeakPolarHBondContact CD-O 3.41Å; K157-D220 VanDerWaalsContact CE-O 3.32Å; K157-D220 WeakPolarHBondContact CE-O 3.41Å; K157-D220 PolarHBondContact NZ-O 3.01Å; K157-D220 IonicContact NZ-OD2 3.18Å
221	W	98.6	Very high	98	Very high	3 Å²	3	29.5 Å²	29.5	1%	0.011	15%	0.146	C	C	.	.			trans	-71.7	142.9	176.4	-60.8	107.1	0	0	0	111.5	F146 K157 V158 A159 A190 Y192 A215 L219 V274	F146-W221 HydrophobicContact CD2-CH2 4.1Å; F146-W221 HydrophobicContact CE2-CH2 4.12Å; K157-W221 VanDerWaalsContact C-CE3 3.5Å; K157-W221 HydrophobicContact CB-CE3 3.75Å; K157-W221 HydrophobicContact CB-CZ3 4.16Å; V158-W221 VanDerWaalsContact C-CE3 3.4Å; V158-W221 VanDerWaalsContact N-CE3 3.35Å; V158-W221 WeakPolarHBondContact O-CZ3 3.32Å; A159-W221 HydrophobicContact CB-CB 4.21Å; A159-W221 HydrophobicContact CB-CD2 3.73Å; A159-W221 HydrophobicContact CB-CE3 4.34Å; A159-W221 HydrophobicContact CB-CG 3.63Å; A190-W221 HydrophobicContact CB-CH2 3.49Å; A190-W221 VanDerWaalsContact CB-CH2 3.49Å; A190-W221 HydrophobicContact CB-CZ2 3.49Å; A190-W221 VanDerWaalsContact CB-CZ2 3.49Å; Y192-W221 HydrophobicContact CE2-CZ2 4.23Å; Y192-W221 PolarHBondContact OH-NE1 3.23Å; A215-W221 VanDerWaalsContact O-CD1 3.23Å; A215-W221 PolarHBondContact O-NE1 3.5Å; L219-W221 VanDerWaalsContact C-N 3.28Å; L219-W221 HydrophobicContact CB-CD2 4.09Å; L219-W221 HydrophobicContact CB-CG 4.46Å; L219-W221 HydrophobicContact CB-CH2 4.48Å; L219-W221 HydrophobicContact CB-CZ2 3.86Å; L219-W221 HydrophobicContact CD2-CD2 4.11Å; L219-W221 HydrophobicContact CD2-CE3 3.86Å; L219-W221 HydrophobicContact CD2-CH2 3.73Å; L219-W221 HydrophobicContact CD2-CZ2 3.98Å; L219-W221 HydrophobicContact CD2-CZ3 3.67Å; L219-W221 PolarHBondContact O-N 2.87Å; W221-V274 HydrophobicContact CB-CG2 4.33Å; W221-V274 WeakPolarHBondContact O-CG2 3.19Å
222	D	98.6	Very high	98	Very high	44 Å²	44	29.6 Å²	29.6	24%	0.235	15%	0.147	C	C	.	.	S	Bend	trans	-80.3	-42.9	179	-58.6	-44	0	0	0	110.8	W156 K157 V274	W156-D222 HydrophobicContact CE3-CB 3.96Å; W156-D222 HydrophobicContact CZ3-CB 4.44Å; K157-D222 WeakPolarHBondContact CB-OD2 3.3Å; K157-D222 WeakPolarHBondContact CE-OD1 3.34Å; K157-D222 VanDerWaalsContact CE-OD2 3.3Å; K157-D222 WeakPolarHBondContact CE-OD2 3.37Å; K157-D222 PolarHBondContact N-OD2 2.88Å; K157-D222 IonicContact NZ-OD1 3.66Å; K157-D222 PolarHBondContact NZ-OD1 3.28Å; K157-D222 WeakPolarHBondContact O-CB 3.29Å; K157-D222 PolarHBondContact O-N 2.89Å; D222-V274 PolarHBondContact O-N 3.33Å
223	C	98.6	Very high	97.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	167	176.2	62.7	0	0	0	0	113.2	K157 A159 C242 M245 L272 M273	K157-C223 PolarHBondContact O-N 3.17Å; A159-C223 PolarHBondContact N-O 3.15Å; A159-C223 VanDerWaalsContact N-O 3.08Å; C223-C242 HydrophobicContact CB-CB 3.61Å; C223-C242 WeakPolarHBondContact CB-SG 3.23Å; C223-C242 PolarHBondContact N-SG 3.4Å; C223-C242 VanDerWaalsContact N-SG 3.42Å; C223-C242 WeakPolarHBondContact SG-CA 3.31Å; C223-C242 WeakPolarHBondContact SG-CB 3.45Å; C223-C242 CovalentContact SG-SG 2.03Å; C223-C242 PolarHBondContact SG-SG 3.29Å; C223-M245 HydrophobicContact CB-CE 4.32Å; C223-L272 WeakPolarHBondContact CA-O 3.39Å; C223-L272 VanDerWaalsContact CB-O 3.31Å; C223-L272 WeakPolarHBondContact CB-O 2.96Å; C223-M273 HydrophobicContact CB-SD 4.41Å
224	L	98.8	Very high	97.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.2	179.5	-53.4	161.4	0	0	0	108	A159 L161 F212 F226 G271 L272 V274 F277	A159-L224 HydrophobicContact CB-CD2 3.95Å; A159-L224 WeakPolarHBondContact O-CA 3.45Å; L161-L224 HydrophobicContact CD1-CD2 4.28Å; F212-L224 HydrophobicContact CB-CD1 4.35Å; F212-L224 HydrophobicContact CD2-CD1 3.29Å; F212-L224 HydrophobicContact CD2-CD2 3.81Å; F212-L224 HydrophobicContact CD2-CG 4.13Å; F212-L224 HydrophobicContact CE2-CD1 3.84Å; F212-L224 HydrophobicContact CG-CD1 4.11Å; L224-F226 HydrophobicContact CB-CE1 3.93Å; L224-F226 HydrophobicContact CB-CE2 4.32Å; L224-F226 HydrophobicContact CB-CZ 3.71Å; L224-F226 HydrophobicContact CD1-CE1 4.18Å; L224-F226 HydrophobicContact CD1-CZ 3.86Å; L224-F226 HydrophobicContact CG-CZ 4.45Å; L224-G271 CarbonylContact O-C 3.49Å; L224-G271 WeakPolarHBondContact O-CA 3.47Å; L224-L272 PolarHBondContact N-O 3.42Å; L224-L272 PolarHBondContact O-N 3.44Å; L224-V274 HydrophobicContact CD1-CG2 4.43Å; L224-V274 HydrophobicContact CD2-CG2 4.28Å; L224-V274 HydrophobicContact CG-CG2 4.07Å; L224-F277 HydrophobicContact CD1-CB 3.81Å; L224-F277 HydrophobicContact CD1-CD1 3.56Å; L224-F277 HydrophobicContact CD1-CD2 4.39Å; L224-F277 HydrophobicContact CD1-CE1 4.19Å; L224-F277 HydrophobicContact CD1-CG 3.66Å
225	I	98.8	Very high	97.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.9	167.2	-52.4	-65.1	0	0	0	107.5	V158 A159 I160 L161 H227 Y240 M245 F249 V269 S270	V158-I225 HydrophobicContact CG1-CD1 4.28Å; V158-I225 HydrophobicContact CG1-CG1 3.46Å; V158-I225 VanDerWaalsContact CG1-CG1 3.46Å; A159-I225 PolarHBondContact O-N 3.03Å; I160-I225 HydrophobicContact CD1-CB 3.59Å; I160-I225 HydrophobicContact CD1-CG1 3.54Å; I160-I225 HydrophobicContact CD1-CG2 4.29Å; L161-I225 PolarHBondContact N-O 2.91Å; I225-H227 HydrophobicContact CG2-CB 4.45Å; I225-Y240 HydrophobicContact CG1-CD2 4.27Å; I225-Y240 HydrophobicContact CG2-CD2 4Å; I225-Y240 HydrophobicContact CG2-CE2 3.93Å; I225-M245 HydrophobicContact CD1-CE 3.74Å; I225-F249 HydrophobicContact CD1-CD2 4.45Å; I225-F249 HydrophobicContact CD1-CE2 3.49Å; I225-F249 VanDerWaalsContact CD1-CE2 3.49Å; I225-F249 HydrophobicContact CD1-CZ 3.69Å; I225-V269 HydrophobicContact CG2-CG1 3.76Å; I225-S270 CarbonylContact C-O 3.56Å; I225-S270 WeakPolarHBondContact CA-O 3.42Å
226	F	98.8	Very high	97.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	112	175.9	-50.3	-65.7	0	0	0	107.4	L161 F208 L224 V269 S270 L272 F277 F283	L161-F226 HydrophobicContact CD1-CD1 4.12Å; L161-F226 HydrophobicContact CD1-CE1 3.93Å; F208-F226 HydrophobicContact CB-CD1 3.95Å; F208-F226 HydrophobicContact CB-CE1 4.25Å; F208-F226 HydrophobicContact CD1-CB 3.97Å; F208-F226 AromaticContact CD1-CD1 3.52Å; F208-F226 HydrophobicContact CD1-CD1 3.52Å; F208-F226 HydrophobicContact CD1-CG 4.19Å; F208-F226 HydrophobicContact CD2-CB 4.39Å; F208-F226 HydrophobicContact CD2-CD1 4.36Å; F208-F226 HydrophobicContact CE1-CB 3.53Å; F208-F226 AromaticContact CE1-CD1 4Å; F208-F226 HydrophobicContact CE1-CD1 4Å; F208-F226 HydrophobicContact CE1-CG 4.25Å; F208-F226 HydrophobicContact CE2-CB 4.04Å; F208-F226 HydrophobicContact CG-CB 4.37Å; F208-F226 AromaticContact CG-CD1 3.72Å; F208-F226 HydrophobicContact CG-CD1 3.72Å; F208-F226 HydrophobicContact CG-CE1 4.49Å; F208-F226 HydrophobicContact CG-CG 4.37Å; F208-F226 HydrophobicContact CZ-CB 3.6Å; L224-F226 HydrophobicContact CB-CE1 3.93Å; L224-F226 HydrophobicContact CB-CE2 4.32Å; L224-F226 HydrophobicContact CB-CZ 3.71Å; L224-F226 HydrophobicContact CD1-CE1 4.18Å; L224-F226 HydrophobicContact CD1-CZ 3.86Å; L224-F226 HydrophobicContact CG-CZ 4.45Å; F226-V269 WeakPolarHBondContact O-CA 3.29Å; F226-S270 PolarHBondContact N-O 3.49Å; F226-S270 PolarHBondContact O-N 3.3Å; F226-L272 HydrophobicContact CD2-CD1 4.23Å; F226-L272 HydrophobicContact CE2-CB 4.1Å; F226-L272 HydrophobicContact CE2-CD1 3.61Å; F226-L272 HydrophobicContact CE2-CG 4.39Å; F226-F277 HydrophobicContact CE1-CD2 4.32Å; F226-F277 AromaticContact CE1-CE2 3.87Å; F226-F277 HydrophobicContact CE1-CE2 3.87Å; F226-F277 HydrophobicContact CE1-CZ 4.07Å; F226-F277 HydrophobicContact CE2-CD2 4.17Å; F226-F277 HydrophobicContact CE2-CE2 4.24Å; F226-F277 AromaticContact CZ-CD2 3.47Å; F226-F277 HydrophobicContact CZ-CD2 3.47Å; F226-F277 VanDerWaalsContact CZ-CD2 3.47Å; F226-F277 AromaticContact CZ-CE2 3.41Å; F226-F277 HydrophobicContact CZ-CE2 3.41Å; F226-F277 VanDerWaalsContact CZ-CE2 3.41Å; F226-F277 HydrophobicContact CZ-CG 4.12Å; F226-F277 HydrophobicContact CZ-CZ 4.03Å; F226-F283 HydrophobicContact CB-CE2 4.48Å; F226-F283 HydrophobicContact CB-CZ 4.4Å; F226-F283 AromaticContact CD1-CE2 3.66Å; F226-F283 HydrophobicContact CD1-CE2 3.66Å; F226-F283 HydrophobicContact CD1-CZ 4.37Å; F226-F283 AromaticContact CD2-CE2 3.89Å; F226-F283 HydrophobicContact CD2-CE2 3.89Å; F226-F283 HydrophobicContact CD2-CZ 4.13Å; F226-F283 HydrophobicContact CE1-CD2 4.4Å; F226-F283 AromaticContact CE1-CE2 3.73Å; F226-F283 HydrophobicContact CE1-CE2 3.73Å; F226-F283 AromaticContact CE2-CE2 3.99Å; F226-F283 HydrophobicContact CE2-CE2 3.99Å; F226-F283 AromaticContact CG-CE2 3.72Å; F226-F283 HydrophobicContact CG-CE2 3.72Å; F226-F283 HydrophobicContact CG-CZ 4.02Å; F226-F283 AromaticContact CZ-CE2 3.91Å; F226-F283 HydrophobicContact CZ-CE2 3.91Å
227	H	98.7	Very high	97.5	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	117.6	-165.5	-162.4	-67.7	0	0	0	110.9	I160 L161 V162 P163 L174 I225 H231 Y240 V269	I160-H227 HydrophobicContact CG2-CB 4.21Å; L161-H227 PolarHBondContact O-N 3.16Å; V162-H227 WeakPolarHBondContact CA-O 3.41Å; V162-H227 HydrophobicContact CG2-CB 4.34Å; P163-H227 WeakPolarHBondContact CD-O 3.11Å; L174-H227 VanDerWaalsContact CD1-CE1 3.45Å; L174-H227 WeakPolarHBondContact CD1-CE1 3.37Å; I225-H227 HydrophobicContact CG2-CB 4.45Å; H227-H231 PolarHBondContact CE1-O 3Å; H227-Y240 AromaticContact CD2-CE2 3.62Å; H227-Y240 AromaticContact CD2-CZ 3.88Å; H227-Y240 PolarHBondContact CD2-OH 2.86Å; H227-Y240 VanDerWaalsContact CD2-OH 3.29Å; H227-Y240 AromaticContact NE2-CE2 3.95Å; H227-Y240 AromaticContact NE2-CZ 3.93Å; H227-Y240 PolarHBondContact NE2-OH 2.85Å; H227-V269 HydrophobicContact CB-CG1 4.41Å; H227-V269 VanDerWaalsContact CD2-CG1 3.48Å; H227-V269 WeakPolarHBondContact CD2-CG1 3.33Å
228	D	97.1	Very high	97.4	Very high	28 Å²	28	21.5 Å²	21.5	15%	0.15	11%	0.108	C	C	.	.			trans	-65.7	142.8	171	-65.7	-10	0	0	0	109.8	R204 D230 H231 G268	R204-D228 IonicContact CZ-OD1 3.93Å; R204-D228 IonicContact NE-OD1 3.53Å; R204-D228 PolarHBondContact NE-OD1 3.28Å; R204-D228 IonicContact NE-OD2 2.92Å; R204-D228 IonicContact NH2-OD1 3.55Å; R204-D228 PolarHBondContact NH2-OD1 2.87Å; R204-D228 IonicContact NH2-OD2 3.49Å; D228-D230 PolarHBondContact O-N 3.09Å; D228-H231 IonicContact OD2-CD2 2.85Å; D228-G268 PolarHBondContact N-O 2.86Å; D228-G268 VanDerWaalsContact OD2-CA 3.3Å; D228-G268 WeakPolarHBondContact OD2-CA 3.48Å
229	V	96.8	Very high	97.4	Very high	8 Å²	8	18.5 Å²	18.5	5%	0.048	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-9.3	-172.9	68.8	0	0	0	0	113.4	V162 F164 R167 H170 L171 L174	V162-V229 HydrophobicContact CG1-CB 3.8Å; V162-V229 HydrophobicContact CG1-CG2 4.07Å; F164-V229 HydrophobicContact CD2-CG2 4.05Å; F164-V229 HydrophobicContact CE2-CG2 4.28Å; R167-V229 HydrophobicContact CB-CG1 4.01Å; R167-V229 HydrophobicContact CG-CG1 4.12Å; H170-V229 HydrophobicContact CB-CG1 4.2Å; H170-V229 HydrophobicContact CB-CG2 4.15Å; L171-V229 HydrophobicContact CB-CG2 4.03Å; L171-V229 HydrophobicContact CD1-CG2 4.19Å; L174-V229 WeakPolarHBondContact CB-O 3.3Å; L174-V229 HydrophobicContact CD2-CG2 4.26Å
230	D	95.1	Very high	97.4	Very high	9 Å²	9	16 Å²	16	5%	0.048	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.9	15.6	-159.5	60.2	20.2	0	0	0	115.8	R167 D228 S320 I321 H324	R167-D230 IonicContact CZ-OD2 3.71Å; R167-D230 IonicContact NH1-OD2 2.68Å; R167-D230 PolarHBondContact NH1-OD2 2.98Å; D228-D230 PolarHBondContact O-N 3.09Å; D230-S320 CarbonylContact O-C 3.6Å; D230-S320 WeakPolarHBondContact O-CA 3.41Å; D230-I321 HydrophobicContact CB-CB 4.27Å; D230-I321 HydrophobicContact CB-CD1 4.41Å; D230-I321 HydrophobicContact CB-CG1 4.47Å; D230-I321 PolarHBondContact O-N 3.12Å; D230-H324 WeakPolarHBondContact CB-CE1 3.32Å; D230-H324 WeakPolarHBondContact CB-NE2 3.25Å; D230-H324 PolarHBondContact O-NE2 3.39Å; D230-H324 IonicContact OD1-CE1 2.8Å; D230-H324 IonicContact OD1-NE2 3.7Å; D230-H324 IonicContact OD2-CD2 3.98Å; D230-H324 IonicContact OD2-CE1 3.71Å; D230-H324 PolarHBondContact OD2-CE1 2.93Å; D230-H324 IonicContact OD2-CG 2.73Å; D230-H324 IonicContact OD2-ND1 3.15Å; D230-H324 PolarHBondContact OD2-ND1 2.84Å; D230-H324 IonicContact OD2-NE2 2.74Å; D230-H324 PolarHBondContact OD2-NE2 3.4Å
231	H	97.2	Very high	97.3	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.009	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.6	171.4	-72.4	-42.2	0	0	0	110.9	H227 D228 L253 G268 V269 Y318 S320	H227-H231 PolarHBondContact CE1-O 3Å; D228-H231 IonicContact OD2-CD2 2.85Å; H231-L253 WeakPolarHBondContact ND1-CD2 3.46Å; H231-G268 WeakPolarHBondContact CD2-CA 3.45Å; H231-V269 HydrophobicContact CB-CG2 4.03Å; H231-Y318 HydrophobicContact CB-CD1 3.93Å; H231-S320 PolarHBondContact CE1-OG 3.07Å; H231-S320 PolarHBondContact ND1-OG 2.82Å
232	L	97.8	Very high	97.2	Very high	1 Å²	1	10.4 Å²	10.4	1%	0.005	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.7	-176.7	-55.3	178.3	0	0	0	109.2	V120 M122 I173 L174 H177 Y318 M319 I321	V120-L232 HydrophobicContact CG1-CB 3.73Å; V120-L232 HydrophobicContact CG1-CD1 3.41Å; V120-L232 VanDerWaalsContact CG1-CD1 3.41Å; V120-L232 HydrophobicContact CG1-CG 4.21Å; M122-L232 HydrophobicContact CE-CD1 4.24Å; M122-L232 HydrophobicContact CG-CD1 4.1Å; I173-L232 HydrophobicContact CG2-CD1 3.77Å; L174-L232 HydrophobicContact CB-CD2 4.4Å; L174-L232 HydrophobicContact CD1-CD2 3.87Å; H177-L232 HydrophobicContact CB-CD2 4.04Å; L232-Y318 VanDerWaalsContact C-CD1 3.47Å; L232-Y318 CarbonylContact O-C 3.48Å; L232-Y318 VanDerWaalsContact O-CA 3.25Å; L232-Y318 WeakPolarHBondContact O-CA 3.33Å; L232-M319 PolarHBondContact N-O 2.9Å; L232-M319 PolarHBondContact O-N 3.06Å; L232-I321 HydrophobicContact CD1-CD1 4.24Å; L232-I321 HydrophobicContact CD1-CG1 3.92Å; L232-I321 HydrophobicContact CG-CD1 4.46Å; L232-I321 HydrophobicContact CG-CG1 4.22Å
233	M	97.5	Very high	96.9	Very high	2 Å²	2	9.8 Å²	9.8	1%	0.01	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	138.5	-179.9	71.6	-177.2	78.3	0	0	111.3	L118 H177 L178 V181 Y240 Y318	L118-M233 HydrophobicContact CD1-CG 4.05Å; H177-M233 PolarHBondContact CE1-O 3.1Å; H177-M233 PolarHBondContact NE2-O 3.3Å; L178-M233 HydrophobicContact CD1-CE 3.41Å; L178-M233 VanDerWaalsContact CD1-CE 3.41Å; V181-M233 HydrophobicContact CB-SD 4.31Å; V181-M233 HydrophobicContact CG1-CE 4.2Å; V181-M233 HydrophobicContact CG1-SD 3.49Å; V181-M233 WeakPolarHBondContact CG1-SD 3.33Å; M233-Y240 HydrophobicContact CE-CD1 4.07Å; M233-Y240 HydrophobicContact CE-CD2 4.41Å; M233-Y240 HydrophobicContact CE-CE1 3.43Å; M233-Y240 VanDerWaalsContact CE-CE1 3.43Å; M233-Y240 HydrophobicContact CE-CE2 3.81Å; M233-Y240 WeakPolarHBondContact CE-OH 3.35Å; M233-Y240 HydrophobicContact SD-CE1 4.39Å; M233-Y318 HydrophobicContact CB-CD1 4.06Å; M233-Y318 HydrophobicContact CB-CE1 3.56Å; M233-Y318 HydrophobicContact CB-CE2 4.14Å
234	E	97.9	Very high	96.7	Very high	14 Å²	14	14.7 Å²	14.7	7%	0.065	7%	0.073	C	C	.	.	S	Bend	trans	-90.4	-1.3	176.7	-68.3	-166.1	-86.4	0	0	112.8	R117 L118 V120 Y258 R317 M319	R117-E234 CarbonylContact C-O 3.58Å; R117-E234 WeakPolarHBondContact CA-O 3.48Å; L118-E234 PolarHBondContact N-O 2.85Å; V120-E234 HydrophobicContact CG2-CG 4.16Å; E234-Y258 WeakPolarHBondContact OE1-CE1 3.36Å; E234-Y258 VanDerWaalsContact OE1-CZ 3.3Å; E234-Y258 PolarHBondContact OE1-OH 3.32Å; E234-Y258 VanDerWaalsContact OE1-OH 3.07Å; E234-R317 HydrophobicContact CB-CB 4.14Å; E234-R317 HydrophobicContact CG-CB 4.38Å; E234-R317 PolarHBondContact N-O 3.26Å; E234-R317 VanDerWaalsContact OE1-CB 3.23Å; E234-R317 WeakPolarHBondContact OE1-CB 2.97Å; E234-R317 IonicContact OE1-CZ 3.72Å; E234-R317 IonicContact OE1-NE 3.26Å; E234-R317 PolarHBondContact OE1-NE 3.34Å; E234-R317 IonicContact OE1-NH2 3.87Å; E234-M319 HydrophobicContact CG-CG 3.79Å
235	N	97.1	Very high	96.6	Very high	21 Å²	21	15.5 Å²	15.5	11%	0.112	8%	0.077	C	C	.	.	B	Isolated β-bridge	trans	-146.5	118.1	-173.4	-161	-50.3	0	0	0	112.7	G116 R237 N238	G116-N235 VanDerWaalsContact C-OD1 3.31Å; G116-N235 WeakPolarHBondContact CA-OD1 3.36Å; G116-N235 CarbonylContact O-C 3.56Å; G116-N235 VanDerWaalsContact O-CA 3.26Å; G116-N235 WeakPolarHBondContact O-CA 3.38Å; G116-N235 PolarHBondContact O-OD1 3.48Å; N235-R237 PolarHBondContact O-N 3.13Å; N235-R237 VanDerWaalsContact O-N 3.17Å; N235-R237 WeakPolarHBondContact OD1-CB 3.36Å; N235-R237 PolarHBondContact OD1-N 3.22Å; N235-N238 WeakPolarHBondContact O-CB 3.25Å; N235-N238 PolarHBondContact O-N 2.74Å
236	D	95.6	Very high	96.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-9	-179.9	64.1	14.6	0	0	0	113.9	M114 K115 G116 L118 V181 K184 Q185 N238	M114-D236 WeakPolarHBondContact CA-OD1 3.36Å; M114-D236 WeakPolarHBondContact CE-O 3.4Å; K115-D236 PolarHBondContact N-OD1 3.32Å; K115-D236 VanDerWaalsContact N-OD1 3.1Å; K115-D236 PolarHBondContact N-OD2 3.29Å; K115-D236 VanDerWaalsContact N-OD2 3.17Å; G116-D236 WeakPolarHBondContact CA-OD1 3.2Å; G116-D236 PolarHBondContact N-OD1 2.87Å; G116-D236 PolarHBondContact O-N 2.86Å; L118-D236 HydrophobicContact CD1-CB 4.04Å; L118-D236 HydrophobicContact CD2-CB 3.99Å; L118-D236 HydrophobicContact CG-CB 4.18Å; V181-D236 HydrophobicContact CG1-CB 3.84Å; K184-D236 IonicContact NZ-OD2 3.83Å; Q185-D236 PolarHBondContact NE2-O 2.98Å; D236-N238 VanDerWaalsContact C-N 3.31Å
237	R	95.4	Very high	96.6	Very high	78 Å²	78	16.9 Å²	16.9	29%	0.294	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5	171	-58	169.8	172	-172.3	-0.4	113.6	Y94 M114 N235 Y239 L315	Y94-R237 HydrophobicContact CE1-CG 4.23Å; Y94-R237 WeakPolarHBondContact OH-CB 2.89Å; Y94-R237 WeakPolarHBondContact OH-CD 3.49Å; Y94-R237 WeakPolarHBondContact OH-CG 3.46Å; M114-R237 HydrophobicContact CB-CG 3.99Å; M114-R237 HydrophobicContact CE-CB 4.45Å; M114-R237 HydrophobicContact CE-CG 4.42Å; M114-R237 PolarHBondContact O-NE 2.64Å; M114-R237 PolarHBondContact O-NH2 3.31Å; M114-R237 VanDerWaalsContact O-NH2 3.17Å; N235-R237 PolarHBondContact O-N 3.13Å; N235-R237 VanDerWaalsContact O-N 3.17Å; N235-R237 WeakPolarHBondContact OD1-CB 3.36Å; N235-R237 PolarHBondContact OD1-N 3.22Å; R237-Y239 VanDerWaalsContact C-N 3.26Å; R237-Y239 PolarHBondContact O-N 3.26Å; R237-L315 HydrophobicContact CB-CD2 3.72Å
238	N	96.4	Very high	96.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-76.1	82.8	164.8	-160.4	11.2	0	0	0	109.9	Q185 N235 D236 Y240 F249 L315 Y318	Q185-N238 PolarHBondContact NE2-O 2.77Å; N235-N238 WeakPolarHBondContact O-CB 3.25Å; N235-N238 PolarHBondContact O-N 2.74Å; D236-N238 VanDerWaalsContact C-N 3.31Å; N238-Y240 WeakPolarHBondContact O-CD1 3.33Å; N238-Y240 PolarHBondContact O-N 3.36Å; N238-F249 PolarHBondContact ND2-O 3.41Å; N238-L315 VanDerWaalsContact CB-O 3.3Å; N238-L315 WeakPolarHBondContact CB-O 3.37Å; N238-L315 PolarHBondContact ND2-O 2.92Å; N238-Y318 VanDerWaalsContact ND2-CE2 3.34Å; N238-Y318 WeakPolarHBondContact ND2-CE2 3.42Å; N238-Y318 PolarHBondContact ND2-OH 3.19Å
239	Y	96.4	Very high	96.7	Very high	10 Å²	10	15.5 Å²	15.5	4%	0.039	8%	0.075	C	C	.	.			trans	-68	121	-169.7	-174.6	-119.9	0	0	0	113	E109 M114 W156 Q185 L187 R237 G241 F249	E109-Y239 HydrophobicContact CG-CD1 3.73Å; E109-Y239 HydrophobicContact CG-CE1 3.62Å; E109-Y239 HydrophobicContact CG-CG 4.29Å; M114-Y239 HydrophobicContact CE-CD2 4.48Å; W156-Y239 AromaticContact CD1-CE1 3.76Å; Q185-Y239 HydrophobicContact CB-CD2 3.91Å; Q185-Y239 HydrophobicContact CB-CE2 3.84Å; Q185-Y239 HydrophobicContact CG-CD2 3.94Å; Q185-Y239 HydrophobicContact CG-CE2 4.38Å; Q185-Y239 WeakPolarHBondContact O-CE2 3.45Å; L187-Y239 HydrophobicContact CD2-CE1 4.46Å; L187-Y239 HydrophobicContact CD2-CE2 3.84Å; L187-Y239 WeakPolarHBondContact CD2-OH 3.36Å; L187-Y239 HydrophobicContact CG-CE2 4.32Å; R237-Y239 VanDerWaalsContact C-N 3.26Å; R237-Y239 PolarHBondContact O-N 3.26Å; Y239-G241 VanDerWaalsContact CE1-CA 3.42Å; Y239-G241 PolarHBondContact O-N 3.14Å; Y239-F249 VanDerWaalsContact O-CE1 3.29Å; Y239-F249 WeakPolarHBondContact O-CE1 3.26Å
240	Y	97.6	Very high	96.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.073	C	C	.	.			trans	-82.7	10.6	-179.9	-86.3	29.5	0	0	0	114	I160 L178 L182 I225 H227 M233 N238 F249 V269 Y318	I160-Y240 HydrophobicContact CD1-CD2 4.06Å; L178-Y240 HydrophobicContact CD1-CD2 4.36Å; L178-Y240 HydrophobicContact CD1-CE2 3.83Å; L182-Y240 HydrophobicContact CD2-CD2 3.63Å; L182-Y240 HydrophobicContact CD2-CE2 4.48Å; L182-Y240 HydrophobicContact CD2-CG 3.98Å; I225-Y240 HydrophobicContact CG1-CD2 4.27Å; I225-Y240 HydrophobicContact CG2-CD2 4Å; I225-Y240 HydrophobicContact CG2-CE2 3.93Å; H227-Y240 AromaticContact CD2-CE2 3.62Å; H227-Y240 AromaticContact CD2-CZ 3.88Å; H227-Y240 PolarHBondContact CD2-OH 2.86Å; H227-Y240 VanDerWaalsContact CD2-OH 3.29Å; H227-Y240 AromaticContact NE2-CE2 3.95Å; H227-Y240 AromaticContact NE2-CZ 3.93Å; H227-Y240 PolarHBondContact NE2-OH 2.85Å; M233-Y240 HydrophobicContact CE-CD1 4.07Å; M233-Y240 HydrophobicContact CE-CD2 4.41Å; M233-Y240 HydrophobicContact CE-CE1 3.43Å; M233-Y240 VanDerWaalsContact CE-CE1 3.43Å; M233-Y240 HydrophobicContact CE-CE2 3.81Å; M233-Y240 WeakPolarHBondContact CE-OH 3.35Å; M233-Y240 HydrophobicContact SD-CE1 4.39Å; N238-Y240 WeakPolarHBondContact O-CD1 3.33Å; N238-Y240 PolarHBondContact O-N 3.36Å; Y240-F249 AromaticContact CD1-CD1 3.95Å; Y240-F249 HydrophobicContact CD1-CD1 3.95Å; Y240-F249 HydrophobicContact CD1-CE1 4.1Å; Y240-F249 HydrophobicContact CD1-CG 4.46Å; Y240-F249 HydrophobicContact CE1-CB 4.33Å; Y240-F249 HydrophobicContact CE1-CD1 4.01Å; Y240-F249 HydrophobicContact CE1-CG 4.17Å; Y240-V269 HydrophobicContact CE2-CG1 4.44Å; Y240-Y318 WeakPolarHBondContact CE1-OH 3.38Å; Y240-Y318 WeakPolarHBondContact OH-CE1 3.42Å; Y240-Y318 PolarHBondContact OH-OH 3.26Å
241	G	95.6	Very high	96.7	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	-72.2	174.1	171.8	0	0	0	0	0	112.8	Y239 T243 M245	Y239-G241 VanDerWaalsContact CE1-CA 3.42Å; Y239-G241 PolarHBondContact O-N 3.14Å; G241-T243 PolarHBondContact O-N 2.97Å; G241-M245 WeakPolarHBondContact O-CE 3.23Å
242	C	95.9	Very high	96.6	Very high	1 Å²	1	18 Å²	18	1%	0.007	9%	0.086	C	C	.	.	S	Bend	trans	-83.2	25.6	-169	-46.1	0	0	0	0	114.3	W156 C223 M273	W156-C242 HydrophobicContact CD2-CB 3.61Å; W156-C242 HydrophobicContact CE3-CB 3.6Å; W156-C242 HydrophobicContact CG-CB 4.11Å; W156-C242 HydrophobicContact CH2-CB 4.28Å; W156-C242 HydrophobicContact CZ2-CB 4.28Å; W156-C242 HydrophobicContact CZ3-CB 3.94Å; C223-C242 HydrophobicContact CB-CB 3.61Å; C223-C242 WeakPolarHBondContact CB-SG 3.23Å; C223-C242 PolarHBondContact N-SG 3.4Å; C223-C242 VanDerWaalsContact N-SG 3.42Å; C223-C242 WeakPolarHBondContact SG-CA 3.31Å; C223-C242 WeakPolarHBondContact SG-CB 3.45Å; C223-C242 CovalentContact SG-SG 2.03Å; C223-C242 PolarHBondContact SG-SG 3.29Å; C242-M273 HydrophobicContact CB-CE 3.81Å; C242-M273 HydrophobicContact CB-SD 3.76Å; C242-M273 WeakPolarHBondContact O-CE 3.45Å
243	T	92.4	Very high	96.4	Very high	30 Å²	30	18 Å²	18	18%	0.184	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	138.8	-179	-44.1	0	0	0	0	110.9	E109 G241 M245 R247	E109-T243 WeakPolarHBondContact OE1-CB 3.39Å; E109-T243 PolarHBondContact OE1-OG1 3.23Å; G241-T243 PolarHBondContact O-N 2.97Å; T243-M245 VanDerWaalsContact C-N 3.33Å; T243-M245 PolarHBondContact O-N 2.96Å; T243-R247 PolarHBondContact O-NH1 2.76Å
244	D	94.2	Very high	96.1	Very high	103 Å²	103	19.8 Å²	19.8	55%	0.551	10%	0.096	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	33.7	177	-49.8	-44.9	0	0	0	115.3	P246 R247 S309	D244-P246 CarbonylContact O-C 3.52Å; D244-R247 IonicContact OD2-NH1 2.96Å; D244-S309 WeakPolarHBondContact CB-OG 3.17Å; D244-S309 WeakPolarHBondContact O-CB 3.26Å; D244-S309 PolarHBondContact O-OG 3.27Å
245	M	97.4	Very high	95.6	Very high	18 Å²	18	20.7 Å²	20.7	9%	0.089	10%	0.099	C	C	.	.	S	Bend	trans	-75.9	146.4	178.4	-66.4	-68.6	-174.9	0	0	112.4	C223 I225 G241 T243 R247 F249 M273 Q276	C223-M245 HydrophobicContact CB-CE 4.32Å; I225-M245 HydrophobicContact CD1-CE 3.74Å; G241-M245 WeakPolarHBondContact O-CE 3.23Å; T243-M245 VanDerWaalsContact C-N 3.33Å; T243-M245 PolarHBondContact O-N 2.96Å; M245-R247 HydrophobicContact CE-CB 4.45Å; M245-R247 HydrophobicContact SD-CB 3.61Å; M245-F249 HydrophobicContact CE-CE2 4.04Å; M245-F249 HydrophobicContact CE-CZ 3.68Å; M245-M273 HydrophobicContact CB-CG 3.78Å; M245-M273 HydrophobicContact CG-CG 4.22Å; M245-Q276 VanDerWaalsContact CB-OE1 3.3Å; M245-Q276 PolarHBondContact O-NE2 3Å
246	P	98.5	Very high	95	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.013	10%	0.096	C	C	.	.	S	Bend	cis	-67.7	139.4	-1.9	-24.2	39.8	0	0	0	112.6	D244 F266 G271 L272 V301 Y306 V308 S309	D244-P246 CarbonylContact O-C 3.52Å; P246-F266 HydrophobicContact CB-CZ 4.14Å; P246-G271 CarbonylContact C-O 3.53Å; P246-G271 VanDerWaalsContact CA-O 3.31Å; P246-G271 WeakPolarHBondContact CA-O 3.26Å; P246-L272 HydrophobicContact CB-CD1 4.24Å; P246-L272 HydrophobicContact CB-CD2 4.49Å; P246-L272 HydrophobicContact CB-CG 3.88Å; P246-L272 HydrophobicContact CG-CD2 4.26Å; P246-L272 HydrophobicContact CG-CG 4.06Å; P246-V301 HydrophobicContact CB-CG1 4.2Å; P246-V301 HydrophobicContact CB-CG2 4.4Å; P246-V301 HydrophobicContact CG-CG1 3.88Å; P246-V301 HydrophobicContact CG-CG2 4.22Å; P246-Y306 HydrophobicContact CG-CG 4.39Å; P246-V308 HydrophobicContact CB-CG2 4.48Å; P246-V308 WeakPolarHBondContact O-CA 3.33Å; P246-S309 PolarHBondContact O-N 3.31Å
247	R	98.4	Very high	94.7	Very high	26 Å²	26	22.6 Å²	22.6	10%	0.098	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.4	-171.2	-176.4	162.5	177.2	146.6	0.4	111.6	T243 D244 M245 F249 S270 G271 S309	T243-R247 PolarHBondContact O-NH1 2.76Å; D244-R247 IonicContact OD2-NH1 2.96Å; M245-R247 HydrophobicContact CE-CB 4.45Å; M245-R247 HydrophobicContact SD-CB 3.61Å; R247-F249 HydrophobicContact CB-CE2 4.01Å; R247-F249 HydrophobicContact CB-CZ 3.98Å; R247-F249 VanDerWaalsContact CD-CE1 3.46Å; R247-F249 HydrophobicContact CG-CD1 4.18Å; R247-F249 HydrophobicContact CG-CD2 4.35Å; R247-F249 HydrophobicContact CG-CE1 3.83Å; R247-F249 HydrophobicContact CG-CE2 4.02Å; R247-F249 HydrophobicContact CG-CG 4.42Å; R247-F249 HydrophobicContact CG-CZ 3.76Å; R247-S270 CarbonylContact O-C 3.52Å; R247-S270 VanDerWaalsContact O-CA 3.25Å; R247-S270 WeakPolarHBondContact O-CA 3.13Å; R247-G271 PolarHBondContact N-O 2.91Å; R247-G271 PolarHBondContact O-N 3.04Å; R247-S309 WeakPolarHBondContact CB-OG 3.28Å; R247-S309 WeakPolarHBondContact CG-OG 3.17Å
248	H	98.4	Very high	94.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111.8	171.3	-178.2	-138.6	0	0	0	108.8	A250 V251 F265 F266 G267 V269 V308 S309 R310 P311	H248-A250 PolarHBondContact CE1-O 2.84Å; H248-A250 VanDerWaalsContact CE1-O 3.27Å; H248-A250 PolarHBondContact NE2-O 2.82Å; H248-V251 WeakPolarHBondContact O-CG2 3.24Å; H248-F265 AromaticContact CE1-CD1 3.62Å; H248-F265 AromaticContact CE1-CE1 3.95Å; H248-F265 AromaticContact NE2-CD1 3.9Å; H248-F265 AromaticContact NE2-CE1 3.87Å; H248-F266 HydrophobicContact CB-CD2 3.63Å; H248-F266 HydrophobicContact CB-CE2 3.72Å; H248-F266 AromaticContact CD2-CD2 3.95Å; H248-F266 AromaticContact CG-CD2 3.95Å; H248-G267 PolarHBondContact NE2-O 3.18Å; H248-G267 VanDerWaalsContact NE2-O 3.13Å; H248-V269 PolarHBondContact CD2-O 3.13Å; H248-V308 HydrophobicContact CB-CG1 3.85Å; H248-S309 PolarHBondContact N-O 3.1Å; H248-R310 HydrophobicContact CB-CG 3.89Å; H248-R310 PolarHBondContact ND1-NE 3.39Å; H248-P311 WeakPolarHBondContact O-CD 3.35Å
249	F	98.3	Very high	94.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.			trans	-86.7	-44.1	-176.6	-63.4	-85.3	0	0	0	111.9	I225 N238 Y239 Y240 M245 R247 V251 V269 G316 Y318	I225-F249 HydrophobicContact CD1-CD2 4.45Å; I225-F249 HydrophobicContact CD1-CE2 3.49Å; I225-F249 VanDerWaalsContact CD1-CE2 3.49Å; I225-F249 HydrophobicContact CD1-CZ 3.69Å; N238-F249 PolarHBondContact ND2-O 3.41Å; Y239-F249 VanDerWaalsContact O-CE1 3.29Å; Y239-F249 WeakPolarHBondContact O-CE1 3.26Å; Y240-F249 AromaticContact CD1-CD1 3.95Å; Y240-F249 HydrophobicContact CD1-CD1 3.95Å; Y240-F249 HydrophobicContact CD1-CE1 4.1Å; Y240-F249 HydrophobicContact CD1-CG 4.46Å; Y240-F249 HydrophobicContact CE1-CB 4.33Å; Y240-F249 HydrophobicContact CE1-CD1 4.01Å; Y240-F249 HydrophobicContact CE1-CG 4.17Å; M245-F249 HydrophobicContact CE-CE2 4.04Å; M245-F249 HydrophobicContact CE-CZ 3.68Å; R247-F249 HydrophobicContact CB-CE2 4.01Å; R247-F249 HydrophobicContact CB-CZ 3.98Å; R247-F249 VanDerWaalsContact CD-CE1 3.46Å; R247-F249 HydrophobicContact CG-CD1 4.18Å; R247-F249 HydrophobicContact CG-CD2 4.35Å; R247-F249 HydrophobicContact CG-CE1 3.83Å; R247-F249 HydrophobicContact CG-CE2 4.02Å; R247-F249 HydrophobicContact CG-CG 4.42Å; R247-F249 HydrophobicContact CG-CZ 3.76Å; F249-V251 VanDerWaalsContact C-N 3.28Å; F249-V251 PolarHBondContact O-N 2.73Å; F249-V269 HydrophobicContact CB-CB 4.14Å; F249-V269 HydrophobicContact CB-CG1 4Å; F249-V269 HydrophobicContact CD2-CG1 4.12Å; F249-V269 HydrophobicContact CG-CG1 4.37Å; F249-V269 PolarHBondContact N-O 3.5Å; F249-G316 WeakPolarHBondContact O-CA 3.41Å; F249-Y318 HydrophobicContact CB-CE2 4.45Å; F249-Y318 WeakPolarHBondContact CB-OH 3.3Å; F249-Y318 VanDerWaalsContact O-CE2 3.25Å; F249-Y318 WeakPolarHBondContact O-CE2 3.42Å
250	A	97	Very high	93.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.			trans	-84.5	57.6	-175.5	0	0	0	0	0	113.5	H248 L253 V269 Y318	H248-A250 PolarHBondContact CE1-O 2.84Å; H248-A250 VanDerWaalsContact CE1-O 3.27Å; H248-A250 PolarHBondContact NE2-O 2.82Å; A250-L253 HydrophobicContact CB-CD2 4Å; A250-V269 HydrophobicContact CB-CB 3.9Å; A250-V269 HydrophobicContact CB-CG2 4.1Å; A250-V269 PolarHBondContact N-O 3.39Å; A250-Y318 HydrophobicContact CB-CD1 4.35Å; A250-Y318 HydrophobicContact CB-CD2 3.94Å; A250-Y318 HydrophobicContact CB-CE2 4.14Å; A250-Y318 HydrophobicContact CB-CG 4.07Å
251	V	95.7	Very high	93.4	Very high	15 Å²	15	24.1 Å²	24.1	9%	0.091	12%	0.123	C	C	.	.			trans	-67.3	-41.1	-174.5	-173.8	0	0	0	0	113.1	H248 F249 L260 R310 P311 G316	H248-V251 WeakPolarHBondContact O-CG2 3.24Å; F249-V251 VanDerWaalsContact C-N 3.28Å; F249-V251 PolarHBondContact O-N 2.73Å; V251-L260 HydrophobicContact CG1-CD1 4.25Å; V251-R310 HydrophobicContact CG2-CB 3.87Å; V251-R310 HydrophobicContact CG2-CG 3.75Å; V251-P311 HydrophobicContact CG2-CG 3.85Å; V251-G316 PolarHBondContact N-O 3.14Å
252	K	94.8	Very high	93.1	Very high	56 Å²	56	26 Å²	26	24%	0.243	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	94	-172.9	-65.4	-175.3	176	178.1	0	109	Y258 G313 D314 G316 R317 Y318	K252-Y258 HydrophobicContact CB-CD1 4.12Å; K252-Y258 WeakPolarHBondContact CB-O 3.41Å; K252-Y258 WeakPolarHBondContact CD-O 3.42Å; K252-Y258 VanDerWaalsContact CG-O 3.28Å; K252-Y258 WeakPolarHBondContact CG-O 3.43Å; K252-Y258 WeakPolarHBondContact O-CD1 3.34Å; K252-G313 WeakPolarHBondContact CE-O 3.28Å; K252-G313 PolarHBondContact NZ-O 2.78Å; K252-D314 IonicContact NZ-OD1 3.24Å; K252-D314 PolarHBondContact NZ-OD1 2.69Å; K252-D314 VanDerWaalsContact NZ-OD1 3.08Å; K252-G316 PolarHBondContact N-O 2.82Å; K252-R317 HydrophobicContact CB-CB 4.49Å; K252-R317 HydrophobicContact CB-CG 3.88Å; K252-R317 HydrophobicContact CD-CG 3.9Å; K252-R317 WeakPolarHBondContact O-CA 3.43Å; K252-Y318 PolarHBondContact O-N 3.27Å
253	L	93.4	Very high	92.8	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.8	177.6	-65.1	164.6	0	0	0	109.9	H231 A250 K255 Y256 S257 Y258 F265	H231-L253 WeakPolarHBondContact ND1-CD2 3.46Å; A250-L253 HydrophobicContact CB-CD2 4Å; L253-K255 VanDerWaalsContact C-N 3.28Å; L253-K255 HydrophobicContact CB-CG 4.02Å; L253-K255 PolarHBondContact O-N 3.42Å; L253-Y256 HydrophobicContact CB-CD2 3.82Å; L253-Y256 HydrophobicContact CB-CE2 4.34Å; L253-Y256 HydrophobicContact CB-CG 4.49Å; L253-Y256 HydrophobicContact CD1-CD2 3.79Å; L253-Y256 HydrophobicContact CD1-CE2 3.55Å; L253-Y256 HydrophobicContact CG-CD2 4.38Å; L253-Y256 CarbonylContact O-C 3.58Å; L253-Y256 WeakPolarHBondContact O-CA 3.35Å; L253-Y256 PolarHBondContact O-N 3.27Å; L253-S257 PolarHBondContact O-N 2.88Å; L253-Y258 WeakPolarHBondContact O-CA 3.13Å; L253-Y258 PolarHBondContact O-N 3.35Å; L253-F265 HydrophobicContact CD1-CE1 4.07Å; L253-F265 HydrophobicContact CD1-CZ 4.02Å
254	D	92.8	Very high	92.9	Very high	39 Å²	39	33.3 Å²	33.3	21%	0.209	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-52.8	-40.8	176.2	64.6	-22	0	0	0	114.1	Y256 S257 Y258 Y318 M319 S320	D254-Y256 PolarHBondContact O-N 3.01Å; D254-Y256 VanDerWaalsContact O-N 3.17Å; D254-S257 WeakPolarHBondContact O-CA 3.15Å; D254-S257 PolarHBondContact O-N 2.96Å; D254-Y258 HydrophobicContact CB-CE1 3.82Å; D254-Y258 HydrophobicContact CB-CE2 3.88Å; D254-Y258 VanDerWaalsContact CB-CZ 3.42Å; D254-Y258 WeakPolarHBondContact CB-OH 3.42Å; D254-Y318 PolarHBondContact N-O 3.26Å; D254-M319 VanDerWaalsContact CG-CA 3.5Å; D254-M319 WeakPolarHBondContact OD2-CA 3.43Å; D254-S320 WeakPolarHBondContact OD1-CB 3.34Å; D254-S320 PolarHBondContact OD1-N 3.49Å; D254-S320 PolarHBondContact OD1-OG 3.31Å; D254-S320 PolarHBondContact OD2-N 3.35Å
255	K	85.6	Confident	92.8	Very high	33 Å²	33	28.9 Å²	28.9	14%	0.143	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-59.9	-24.3	175.9	64.8	173.6	175.5	-177.1	0	113.3	E39 L253	E39-K255 HydrophobicContact CG-CB 4.31Å; E39-K255 WeakPolarHBondContact OE1-CB 3.37Å; L253-K255 VanDerWaalsContact C-N 3.28Å; L253-K255 HydrophobicContact CB-CG 4.02Å; L253-K255 PolarHBondContact O-N 3.42Å
256	Y	86.1	Confident	92.8	Very high	10 Å²	10	28 Å²	28	4%	0.039	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-102.6	23.9	173.2	-52	-39.1	0	0	0	112	E39 F42 L253 D254 Y258 M259 P261 F265	E39-Y256 HydrophobicContact CB-CE1 4.25Å; E39-Y256 HydrophobicContact CG-CD1 4.17Å; E39-Y256 HydrophobicContact CG-CE1 3.86Å; F42-Y256 HydrophobicContact CB-CD1 3.88Å; F42-Y256 HydrophobicContact CB-CE1 3.76Å; F42-Y256 AromaticContact CD2-CE1 3.83Å; F42-Y256 HydrophobicContact CD2-CE1 3.83Å; F42-Y256 AromaticContact CD2-CZ 3.77Å; F42-Y256 HydrophobicContact CG-CE1 4.29Å; L253-Y256 HydrophobicContact CB-CD2 3.82Å; L253-Y256 HydrophobicContact CB-CE2 4.34Å; L253-Y256 HydrophobicContact CB-CG 4.49Å; L253-Y256 HydrophobicContact CD1-CD2 3.79Å; L253-Y256 HydrophobicContact CD1-CE2 3.55Å; L253-Y256 HydrophobicContact CG-CD2 4.38Å; L253-Y256 CarbonylContact O-C 3.58Å; L253-Y256 WeakPolarHBondContact O-CA 3.35Å; L253-Y256 PolarHBondContact O-N 3.27Å; D254-Y256 PolarHBondContact O-N 3.01Å; D254-Y256 VanDerWaalsContact O-N 3.17Å; Y256-Y258 PolarHBondContact O-N 3.49Å; Y256-M259 WeakPolarHBondContact CB-O 3.33Å; Y256-M259 PolarHBondContact O-N 2.92Å; Y256-M259 VanDerWaalsContact O-N 3.09Å; Y256-P261 HydrophobicContact CD2-CG 3.42Å; Y256-P261 VanDerWaalsContact CD2-CG 3.42Å; Y256-P261 HydrophobicContact CE2-CG 3.76Å; Y256-P261 HydrophobicContact CG-CG 3.92Å; Y256-F265 HydrophobicContact CE2-CE2 4.35Å; Y256-F265 HydrophobicContact CE2-CZ 4.02Å
257	S	88.6	Confident	92.6	Very high	51 Å²	51	28.1 Å²	28.1	36%	0.357	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	36.6	-177.5	-61.3	0	0	0	0	112.6	L253 D254 M259	L253-S257 PolarHBondContact O-N 2.88Å; D254-S257 WeakPolarHBondContact O-CA 3.15Å; D254-S257 PolarHBondContact O-N 2.96Å; S257-M259 VanDerWaalsContact CB-CE 3.43Å; S257-M259 PolarHBondContact O-N 2.85Å
258	Y	92.4	Very high	92.4	Very high	57 Å²	57	27 Å²	27	22%	0.224	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	26.3	-177.5	-60.6	-75	0	0	0	114.9	E234 K252 L253 D254 Y256 R317	E234-Y258 WeakPolarHBondContact OE1-CE1 3.36Å; E234-Y258 VanDerWaalsContact OE1-CZ 3.3Å; E234-Y258 PolarHBondContact OE1-OH 3.32Å; E234-Y258 VanDerWaalsContact OE1-OH 3.07Å; K252-Y258 HydrophobicContact CB-CD1 4.12Å; K252-Y258 WeakPolarHBondContact CB-O 3.41Å; K252-Y258 WeakPolarHBondContact CD-O 3.42Å; K252-Y258 VanDerWaalsContact CG-O 3.28Å; K252-Y258 WeakPolarHBondContact CG-O 3.43Å; K252-Y258 WeakPolarHBondContact O-CD1 3.34Å; L253-Y258 WeakPolarHBondContact O-CA 3.13Å; L253-Y258 PolarHBondContact O-N 3.35Å; D254-Y258 HydrophobicContact CB-CE1 3.82Å; D254-Y258 HydrophobicContact CB-CE2 3.88Å; D254-Y258 VanDerWaalsContact CB-CZ 3.42Å; D254-Y258 WeakPolarHBondContact CB-OH 3.42Å; Y256-Y258 PolarHBondContact O-N 3.49Å; Y258-R317 HydrophobicContact CD1-CB 4.14Å; Y258-R317 HydrophobicContact CD1-CG 3.91Å; Y258-R317 HydrophobicContact CE1-CB 4.14Å; Y258-R317 HydrophobicContact CE1-CG 4.33Å
259	M	88.4	Confident	92.4	Very high	26 Å²	26	27 Å²	27	13%	0.128	14%	0.135	C	C	.	.			trans	-108.8	145.9	172.6	-65.8	172.2	-81.6	0	0	110.5	A46 R47 Q50 Y256 S257 P261	A46-M259 HydrophobicContact CB-CB 3.41Å; A46-M259 VanDerWaalsContact CB-CB 3.41Å; A46-M259 HydrophobicContact CB-CE 4.46Å; A46-M259 HydrophobicContact CB-CG 4.43Å; A46-M259 HydrophobicContact CB-SD 4.22Å; R47-M259 HydrophobicContact CG-CE 3.49Å; R47-M259 VanDerWaalsContact CG-CE 3.49Å; R47-M259 HydrophobicContact CG-SD 3.91Å; Q50-M259 HydrophobicContact CB-SD 4.2Å; Q50-M259 PolarHBondContact OE1-SD 2.91Å; Y256-M259 WeakPolarHBondContact CB-O 3.33Å; Y256-M259 PolarHBondContact O-N 2.92Å; Y256-M259 VanDerWaalsContact O-N 3.09Å; S257-M259 VanDerWaalsContact CB-CE 3.43Å; S257-M259 PolarHBondContact O-N 2.85Å; M259-P261 WeakPolarHBondContact O-CD 3.28Å
260	L	90.1	Very high	92.4	Very high	37 Å²	37	27.1 Å²	27.1	19%	0.194	14%	0.136	C	C	.	.			trans	-72.4	123.1	172.9	-176.1	70.3	0	0	0	108.9	A46 V251 Y262 F265 R310	A46-L260 WeakPolarHBondContact CB-O 3.42Å; V251-L260 HydrophobicContact CG1-CD1 4.25Å; L260-Y262 WeakPolarHBondContact CD2-O 3.41Å; L260-Y262 WeakPolarHBondContact CG-O 3.37Å; L260-Y262 PolarHBondContact O-N 3.29Å; L260-F265 HydrophobicContact CD1-CB 4.04Å; L260-F265 HydrophobicContact CD1-CD1 3.87Å; L260-F265 HydrophobicContact CD1-CG 4.37Å; L260-R310 VanDerWaalsContact CD2-NH1 3.3Å
261	P	86.7	Confident	92.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-56.5	-45.2	-176.8	-31.1	38.7	0	0	0	114.6	F42 I49 Y256 M259 F265	F42-P261 HydrophobicContact CB-CB 3.94Å; F42-P261 HydrophobicContact CB-CG 4.14Å; F42-P261 HydrophobicContact CD1-CB 4.16Å; F42-P261 HydrophobicContact CG-CB 4.18Å; I49-P261 WeakPolarHBondContact CD1-O 3.47Å; Y256-P261 HydrophobicContact CD2-CG 3.42Å; Y256-P261 VanDerWaalsContact CD2-CG 3.42Å; Y256-P261 HydrophobicContact CE2-CG 3.76Å; Y256-P261 HydrophobicContact CG-CG 3.92Å; M259-P261 WeakPolarHBondContact O-CD 3.28Å; P261-F265 HydrophobicContact CB-CD2 4.32Å; P261-F265 HydrophobicContact CB-CG 4.46Å; P261-F265 HydrophobicContact CG-CD1 4.44Å; P261-F265 HydrophobicContact CG-CD2 4.08Å; P261-F265 HydrophobicContact CG-CE2 4.29Å; P261-F265 HydrophobicContact CG-CG 4.16Å
262	Y	90.4	Very high	92.7	Very high	40 Å²	40	26.4 Å²	26.4	16%	0.157	13%	0.131	C	C	.	.			trans	-162.7	164	177.4	48.8	-88.9	0	0	0	109.5	F42 L260 E264 F265 D295	F42-Y262 HydrophobicContact CD1-CD1 4.35Å; F42-Y262 AromaticContact CD1-CE1 3.86Å; F42-Y262 HydrophobicContact CD1-CE1 3.86Å; F42-Y262 HydrophobicContact CE1-CD1 4.42Å; F42-Y262 AromaticContact CE1-CE1 3.58Å; F42-Y262 HydrophobicContact CE1-CE1 3.58Å; F42-Y262 HydrophobicContact CZ-CE1 4.35Å; L260-Y262 WeakPolarHBondContact CD2-O 3.41Å; L260-Y262 WeakPolarHBondContact CG-O 3.37Å; L260-Y262 PolarHBondContact O-N 3.29Å; Y262-E264 VanDerWaalsContact C-N 3.29Å; Y262-E264 HydrophobicContact CD2-CB 4.04Å; Y262-E264 HydrophobicContact CE2-CB 4.25Å; Y262-E264 PolarHBondContact O-N 3.17Å; Y262-F265 HydrophobicContact CD2-CB 3.97Å; Y262-F265 HydrophobicContact CE1-CB 4.35Å; Y262-F265 HydrophobicContact CE1-CD2 4.06Å; Y262-F265 HydrophobicContact CE2-CB 3.76Å; Y262-F265 HydrophobicContact CE2-CD2 4.43Å; Y262-F265 HydrophobicContact CG-CB 4.35Å; Y262-F265 AromaticContact CZ-CD2 3.81Å; Y262-F265 VanDerWaalsContact O-CB 3.22Å; Y262-F265 WeakPolarHBondContact O-CB 3.32Å; Y262-F265 PolarHBondContact O-N 3.14Å; Y262-F265 VanDerWaalsContact O-N 3.13Å; Y262-D295 VanDerWaalsContact CE2-OD1 3.29Å; Y262-D295 WeakPolarHBondContact CE2-OD1 3.44Å; Y262-D295 PolarHBondContact OH-OD1 3.33Å; Y262-D295 VanDerWaalsContact OH-OD1 3.08Å
263	N	90.3	Very high	92.9	Very high	95 Å²	95	25.3 Å²	25.3	51%	0.508	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-32.8	-168.4	-76.9	-20.6	0	0	0	113.8	F265 W298 R310	N263-F265 VanDerWaalsContact C-N 3.3Å; N263-W298 WeakPolarHBondContact O-CH2 3.49Å; N263-R310 VanDerWaalsContact O-CZ 3.29Å; N263-R310 PolarHBondContact O-NH1 2.8Å; N263-R310 PolarHBondContact O-NH2 3.37Å
264	E	93.1	Very high	93.1	Very high	90 Å²	90	25.9 Å²	25.9	42%	0.421	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-6.9	-178	-59.3	74.4	-166.1	0	0	112.8	Y262 F266 W298	Y262-E264 VanDerWaalsContact C-N 3.29Å; Y262-E264 HydrophobicContact CD2-CB 4.04Å; Y262-E264 HydrophobicContact CE2-CB 4.25Å; Y262-E264 PolarHBondContact O-N 3.17Å; E264-F266 PolarHBondContact O-N 3.3Å; E264-F266 VanDerWaalsContact O-N 3.14Å; E264-W298 HydrophobicContact CB-CD2 4.11Å; E264-W298 HydrophobicContact CB-CG 4.05Å; E264-W298 HydrophobicContact CG-CZ2 4.46Å
265	F	93.2	Very high	93.4	Very high	9 Å²	9	31 Å²	31	4%	0.039	15%	0.151	C	C	.	.			trans	-59.1	119.4	-177.5	-178.1	-96	0	0	0	111.1	H248 L253 Y256 L260 P261 Y262 N263 R310	H248-F265 AromaticContact CE1-CD1 3.62Å; H248-F265 AromaticContact CE1-CE1 3.95Å; H248-F265 AromaticContact NE2-CD1 3.9Å; H248-F265 AromaticContact NE2-CE1 3.87Å; L253-F265 HydrophobicContact CD1-CE1 4.07Å; L253-F265 HydrophobicContact CD1-CZ 4.02Å; Y256-F265 HydrophobicContact CE2-CE2 4.35Å; Y256-F265 HydrophobicContact CE2-CZ 4.02Å; L260-F265 HydrophobicContact CD1-CB 4.04Å; L260-F265 HydrophobicContact CD1-CD1 3.87Å; L260-F265 HydrophobicContact CD1-CG 4.37Å; P261-F265 HydrophobicContact CB-CD2 4.32Å; P261-F265 HydrophobicContact CB-CG 4.46Å; P261-F265 HydrophobicContact CG-CD1 4.44Å; P261-F265 HydrophobicContact CG-CD2 4.08Å; P261-F265 HydrophobicContact CG-CE2 4.29Å; P261-F265 HydrophobicContact CG-CG 4.16Å; Y262-F265 HydrophobicContact CD2-CB 3.97Å; Y262-F265 HydrophobicContact CE1-CB 4.35Å; Y262-F265 HydrophobicContact CE1-CD2 4.06Å; Y262-F265 HydrophobicContact CE2-CB 3.76Å; Y262-F265 HydrophobicContact CE2-CD2 4.43Å; Y262-F265 HydrophobicContact CG-CB 4.35Å; Y262-F265 AromaticContact CZ-CD2 3.81Å; Y262-F265 VanDerWaalsContact O-CB 3.22Å; Y262-F265 WeakPolarHBondContact O-CB 3.32Å; Y262-F265 PolarHBondContact O-N 3.14Å; Y262-F265 VanDerWaalsContact O-N 3.13Å; N263-F265 VanDerWaalsContact C-N 3.3Å; F265-R310 PolarHBondContact O-NH2 3.23Å
266	F	96.8	Very high	94	Very high	1 Å²	1	30 Å²	30	0%	0.004	15%	0.147	C	C	.	.			trans	-132.8	17.3	-175.7	-158.5	-153.8	0	0	0	113.4	P246 H248 E264 L272 L297 W298 V301 V308	P246-F266 HydrophobicContact CB-CZ 4.14Å; H248-F266 HydrophobicContact CB-CD2 3.63Å; H248-F266 HydrophobicContact CB-CE2 3.72Å; H248-F266 AromaticContact CD2-CD2 3.95Å; H248-F266 AromaticContact CG-CD2 3.95Å; E264-F266 PolarHBondContact O-N 3.3Å; E264-F266 VanDerWaalsContact O-N 3.14Å; F266-L272 HydrophobicContact CE1-CD1 4.16Å; F266-L272 HydrophobicContact CZ-CD1 4.11Å; F266-L297 HydrophobicContact CD1-CB 4.38Å; F266-L297 HydrophobicContact CD1-CD2 3.58Å; F266-L297 HydrophobicContact CD1-CG 3.93Å; F266-L297 HydrophobicContact CE1-CD2 3.51Å; F266-L297 HydrophobicContact CE1-CG 3.92Å; F266-L297 HydrophobicContact CZ-CD2 4.47Å; F266-W298 HydrophobicContact CB-CB 4.26Å; F266-W298 HydrophobicContact CB-CE3 4.1Å; F266-W298 HydrophobicContact CD1-CB 4.42Å; F266-W298 HydrophobicContact CG-CE3 4.26Å; F266-V301 HydrophobicContact CE1-CG2 4.23Å; F266-V308 HydrophobicContact CD2-CG1 4.04Å; F266-V308 HydrophobicContact CE1-CG2 4.31Å; F266-V308 HydrophobicContact CE2-CG1 3.69Å; F266-V308 HydrophobicContact CE2-CG2 4.34Å; F266-V308 HydrophobicContact CZ-CG1 4.25Å; F266-V308 HydrophobicContact CZ-CG2 4.16Å
267	G	93.8	Very high	94.6	Very high	3 Å²	3	29.6 Å²	29.6	3%	0.031	15%	0.146	C	C	.	.			trans	-80.8	-176.7	178.2	0	0	0	0	0	114	H248 V269 D294	H248-G267 PolarHBondContact NE2-O 3.18Å; H248-G267 VanDerWaalsContact NE2-O 3.13Å; G267-V269 PolarHBondContact O-N 3.29Å; G267-D294 WeakPolarHBondContact CA-OD2 3.05Å; G267-D294 PolarHBondContact N-OD2 2.82Å
268	G	95.3	Very high	95.1	Very high	4 Å²	4	32.8 Å²	32.8	4%	0.041	15%	0.153	C	C	.	.	S	Bend	trans	76.5	-90	179	0	0	0	0	0	113.2	D228 H231	D228-G268 PolarHBondContact N-O 2.86Å; D228-G268 VanDerWaalsContact OD2-CA 3.3Å; D228-G268 WeakPolarHBondContact OD2-CA 3.48Å; H231-G268 WeakPolarHBondContact CD2-CA 3.45Å
269	V	98.5	Very high	95.4	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	119.4	177	-170.7	0	0	0	0	110.8	I225 F226 H227 H231 Y240 H248 F249 A250 G267 Y318	I225-V269 HydrophobicContact CG2-CG1 3.76Å; F226-V269 WeakPolarHBondContact O-CA 3.29Å; H227-V269 HydrophobicContact CB-CG1 4.41Å; H227-V269 VanDerWaalsContact CD2-CG1 3.48Å; H227-V269 WeakPolarHBondContact CD2-CG1 3.33Å; H231-V269 HydrophobicContact CB-CG2 4.03Å; Y240-V269 HydrophobicContact CE2-CG1 4.44Å; H248-V269 PolarHBondContact CD2-O 3.13Å; F249-V269 HydrophobicContact CB-CB 4.14Å; F249-V269 HydrophobicContact CB-CG1 4Å; F249-V269 HydrophobicContact CD2-CG1 4.12Å; F249-V269 HydrophobicContact CG-CG1 4.37Å; F249-V269 PolarHBondContact N-O 3.5Å; A250-V269 HydrophobicContact CB-CB 3.9Å; A250-V269 HydrophobicContact CB-CG2 4.1Å; A250-V269 PolarHBondContact N-O 3.39Å; G267-V269 PolarHBondContact O-N 3.29Å; V269-Y318 HydrophobicContact CB-CE1 4.45Å; V269-Y318 HydrophobicContact CG2-CD1 4.44Å; V269-Y318 HydrophobicContact CG2-CE1 3.91Å
270	S	98.5	Very high	95.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	165.9	178.8	56.9	0	0	0	0	111.3	I225 F226 R247	I225-S270 CarbonylContact C-O 3.56Å; I225-S270 WeakPolarHBondContact CA-O 3.42Å; F226-S270 PolarHBondContact N-O 3.49Å; F226-S270 PolarHBondContact O-N 3.3Å; R247-S270 CarbonylContact O-C 3.52Å; R247-S270 VanDerWaalsContact O-CA 3.25Å; R247-S270 WeakPolarHBondContact O-CA 3.13Å
271	G	98.4	Very high	96.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151.6	177.9	0	0	0	0	0	113.2	L224 P246 R247	L224-G271 CarbonylContact O-C 3.49Å; L224-G271 WeakPolarHBondContact O-CA 3.47Å; P246-G271 CarbonylContact C-O 3.53Å; P246-G271 VanDerWaalsContact CA-O 3.31Å; P246-G271 WeakPolarHBondContact CA-O 3.26Å; R247-G271 PolarHBondContact N-O 2.91Å; R247-G271 PolarHBondContact O-N 3.04Å
272	L	98.8	Very high	96.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	146.2	176.6	-81.6	87.8	0	0	0	109.6	C223 L224 F226 P246 F266 Q276 F277 I280 L297 V301	C223-L272 WeakPolarHBondContact CA-O 3.39Å; C223-L272 VanDerWaalsContact CB-O 3.31Å; C223-L272 WeakPolarHBondContact CB-O 2.96Å; L224-L272 PolarHBondContact N-O 3.42Å; L224-L272 PolarHBondContact O-N 3.44Å; F226-L272 HydrophobicContact CD2-CD1 4.23Å; F226-L272 HydrophobicContact CE2-CB 4.1Å; F226-L272 HydrophobicContact CE2-CD1 3.61Å; F226-L272 HydrophobicContact CE2-CG 4.39Å; P246-L272 HydrophobicContact CB-CD1 4.24Å; P246-L272 HydrophobicContact CB-CD2 4.49Å; P246-L272 HydrophobicContact CB-CG 3.88Å; P246-L272 HydrophobicContact CG-CD2 4.26Å; P246-L272 HydrophobicContact CG-CG 4.06Å; F266-L272 HydrophobicContact CE1-CD1 4.16Å; F266-L272 HydrophobicContact CZ-CD1 4.11Å; L272-Q276 HydrophobicContact CB-CB 4.38Å; L272-Q276 HydrophobicContact CD2-CB 4.12Å; L272-F277 HydrophobicContact CB-CB 4.3Å; L272-F277 HydrophobicContact CD2-CD2 4.41Å; L272-I280 HydrophobicContact CD2-CD1 3.6Å; L272-I280 HydrophobicContact CD2-CG1 4.45Å; L272-L297 HydrophobicContact CD1-CD2 4.3Å; L272-V301 HydrophobicContact CD2-CG2 4.03Å
273	M	98.8	Very high	97.2	Very high	34 Å²	34	35.3 Å²	35.3	17%	0.167	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	148	164.4	-65.7	-81.5	-168.2	0	0	109.8	W156 C223 C242 M245 K275 Q276 F277	W156-M273 HydrophobicContact CH2-CE 4.36Å; C223-M273 HydrophobicContact CB-SD 4.41Å; C242-M273 HydrophobicContact CB-CE 3.81Å; C242-M273 HydrophobicContact CB-SD 3.76Å; C242-M273 WeakPolarHBondContact O-CE 3.45Å; M245-M273 HydrophobicContact CB-CG 3.78Å; M245-M273 HydrophobicContact CG-CG 4.22Å; M273-K275 HydrophobicContact CB-CG 3.87Å; M273-K275 PolarHBondContact O-N 2.69Å; M273-Q276 HydrophobicContact CB-CB 4.2Å; M273-Q276 HydrophobicContact CB-CG 3.95Å; M273-Q276 HydrophobicContact CG-CG 4.49Å; M273-Q276 WeakPolarHBondContact O-CA 2.98Å; M273-Q276 WeakPolarHBondContact O-CB 3.42Å; M273-Q276 PolarHBondContact O-N 3.49Å; M273-F277 PolarHBondContact O-N 2.82Å
274	V	98.8	Very high	97.5	Very high	13 Å²	13	30.8 Å²	30.8	8%	0.079	14%	0.136	C	C	.	.	H	α-helix	trans	-55.2	-39.8	176.1	163.8	0	0	0	0	111.5	F212 W221 D222 L224 Q276 F277 K278	F212-V274 HydrophobicContact CE2-CG1 4.06Å; F212-V274 HydrophobicContact CE2-CG2 4.35Å; F212-V274 HydrophobicContact CZ-CG1 4.47Å; W221-V274 HydrophobicContact CB-CG2 4.33Å; W221-V274 WeakPolarHBondContact O-CG2 3.19Å; D222-V274 PolarHBondContact O-N 3.33Å; L224-V274 HydrophobicContact CD1-CG2 4.43Å; L224-V274 HydrophobicContact CD2-CG2 4.28Å; L224-V274 HydrophobicContact CG-CG2 4.07Å; V274-Q276 PolarHBondContact O-N 3.36Å; V274-F277 PolarHBondContact O-N 2.88Å; V274-K278 HydrophobicContact CG1-CD 4.13Å; V274-K278 WeakPolarHBondContact O-CB 3.33Å; V274-K278 WeakPolarHBondContact O-CG 3.48Å; V274-K278 PolarHBondContact O-N 2.71Å
275	K	98.5	Very high	97.7	Very high	147 Å²	147	26.5 Å²	26.5	64%	0.639	12%	0.115	S	C	*	.	H	α-helix	trans	-62.7	-38.2	175.2	67.6	-177.5	178.7	-178.7	0	113.3	M273 R279	M273-K275 HydrophobicContact CB-CG 3.87Å; M273-K275 PolarHBondContact O-N 2.69Å; K275-R279 VanDerWaalsContact O-CB 3.25Å; K275-R279 WeakPolarHBondContact O-CB 3.45Å; K275-R279 PolarHBondContact O-N 3.45Å
276	Q	98.8	Very high	97.7	Very high	13 Å²	13	26.7 Å²	26.7	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-70.6	-45.5	179.2	-70.5	167.3	-27.9	0	0	110	M245 L272 M273 V274 K278 R279 I280 Y306	M245-Q276 VanDerWaalsContact CB-OE1 3.3Å; M245-Q276 PolarHBondContact O-NE2 3Å; L272-Q276 HydrophobicContact CB-CB 4.38Å; L272-Q276 HydrophobicContact CD2-CB 4.12Å; M273-Q276 HydrophobicContact CB-CB 4.2Å; M273-Q276 HydrophobicContact CB-CG 3.95Å; M273-Q276 HydrophobicContact CG-CG 4.49Å; M273-Q276 WeakPolarHBondContact O-CA 2.98Å; M273-Q276 WeakPolarHBondContact O-CB 3.42Å; M273-Q276 PolarHBondContact O-N 3.49Å; V274-Q276 PolarHBondContact O-N 3.36Å; Q276-K278 PolarHBondContact O-N 2.82Å; Q276-R279 WeakPolarHBondContact O-CB 3.32Å; Q276-R279 PolarHBondContact O-N 2.74Å; Q276-R279 VanDerWaalsContact O-N 3.11Å; Q276-I280 WeakPolarHBondContact O-CG1 3.48Å; Q276-I280 PolarHBondContact O-N 3.21Å; Q276-Y306 HydrophobicContact CB-CE2 4.12Å; Q276-Y306 HydrophobicContact CG-CD2 4.39Å; Q276-Y306 HydrophobicContact CG-CE1 4.08Å; Q276-Y306 HydrophobicContact CG-CE2 3.9Å
277	F	98.8	Very high	97.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-44.7	178.7	-166.6	-111.6	0	0	0	112.3	N209 F212 L224 F226 L272 M273 V274 R279 I280 N281 G282 F283 L350	N209-F277 VanDerWaalsContact OD1-CZ 3.26Å; N209-F277 WeakPolarHBondContact OD1-CZ 3.17Å; F212-F277 HydrophobicContact CB-CD1 4.17Å; F212-F277 HydrophobicContact CB-CE1 3.59Å; F212-F277 HydrophobicContact CB-CZ 4.46Å; F212-F277 AromaticContact CD1-CD1 3.83Å; F212-F277 HydrophobicContact CD1-CD1 3.83Å; F212-F277 AromaticContact CD1-CE1 3.66Å; F212-F277 HydrophobicContact CD1-CE1 3.66Å; F212-F277 AromaticContact CD2-CD1 3.73Å; F212-F277 HydrophobicContact CD2-CD1 3.73Å; F212-F277 HydrophobicContact CD2-CE1 4.04Å; F212-F277 HydrophobicContact CE1-CD1 4.1Å; F212-F277 HydrophobicContact CE1-CE1 4.33Å; F212-F277 AromaticContact CE2-CD1 3.98Å; F212-F277 HydrophobicContact CE2-CD1 3.98Å; F212-F277 AromaticContact CG-CD1 3.61Å; F212-F277 HydrophobicContact CG-CD1 3.61Å; F212-F277 AromaticContact CG-CE1 3.46Å; F212-F277 HydrophobicContact CG-CE1 3.46Å; F212-F277 VanDerWaalsContact CG-CE1 3.46Å; F212-F277 HydrophobicContact CZ-CD1 4.15Å; L224-F277 HydrophobicContact CD1-CB 3.81Å; L224-F277 HydrophobicContact CD1-CD1 3.56Å; L224-F277 HydrophobicContact CD1-CD2 4.39Å; L224-F277 HydrophobicContact CD1-CE1 4.19Å; L224-F277 HydrophobicContact CD1-CG 3.66Å; F226-F277 HydrophobicContact CE1-CD2 4.32Å; F226-F277 AromaticContact CE1-CE2 3.87Å; F226-F277 HydrophobicContact CE1-CE2 3.87Å; F226-F277 HydrophobicContact CE1-CZ 4.07Å; F226-F277 HydrophobicContact CE2-CD2 4.17Å; F226-F277 HydrophobicContact CE2-CE2 4.24Å; F226-F277 AromaticContact CZ-CD2 3.47Å; F226-F277 HydrophobicContact CZ-CD2 3.47Å; F226-F277 VanDerWaalsContact CZ-CD2 3.47Å; F226-F277 AromaticContact CZ-CE2 3.41Å; F226-F277 HydrophobicContact CZ-CE2 3.41Å; F226-F277 VanDerWaalsContact CZ-CE2 3.41Å; F226-F277 HydrophobicContact CZ-CG 4.12Å; F226-F277 HydrophobicContact CZ-CZ 4.03Å; L272-F277 HydrophobicContact CB-CB 4.3Å; L272-F277 HydrophobicContact CD2-CD2 4.41Å; M273-F277 PolarHBondContact O-N 2.82Å; V274-F277 PolarHBondContact O-N 2.88Å; F277-R279 PolarHBondContact O-N 2.53Å; F277-I280 WeakPolarHBondContact O-CG1 3.19Å; F277-I280 PolarHBondContact O-N 2.95Å; F277-N281 PolarHBondContact O-N 2.9Å; F277-G282 VanDerWaalsContact CE2-CA 3.47Å; F277-G282 VanDerWaalsContact CZ-CA 3.47Å; F277-G282 PolarHBondContact O-N 3.25Å; F277-F283 AromaticContact CE2-CD2 3.47Å; F277-F283 HydrophobicContact CE2-CD2 3.47Å; F277-F283 VanDerWaalsContact CE2-CD2 3.47Å; F277-F283 AromaticContact CE2-CE2 3.82Å; F277-F283 HydrophobicContact CE2-CE2 3.82Å; F277-F283 HydrophobicContact CE2-CG 4.49Å; F277-F283 AromaticContact CZ-CD2 3.76Å; F277-F283 HydrophobicContact CZ-CD2 3.76Å; F277-F283 HydrophobicContact CZ-CE2 4.38Å; F277-L350 HydrophobicContact CD1-CD1 3.99Å; F277-L350 HydrophobicContact CE1-CD1 3.96Å; F277-L350 HydrophobicContact CE1-CD2 3.97Å; F277-L350 HydrophobicContact CE1-CG 4.32Å
278	K	98.6	Very high	97.5	Very high	118 Å²	118	27.2 Å²	27.2	51%	0.513	12%	0.12	S	C	.	.	H	α-helix	trans	-60.4	-44.2	172	-72.5	177.8	179.8	177.3	0	111.8	F212 V274 Q276 I280 N281	F212-K278 HydrophobicContact CE1-CG 4.35Å; F212-K278 HydrophobicContact CZ-CD 4.31Å; F212-K278 HydrophobicContact CZ-CG 3.7Å; V274-K278 HydrophobicContact CG1-CD 4.13Å; V274-K278 WeakPolarHBondContact O-CB 3.33Å; V274-K278 WeakPolarHBondContact O-CG 3.48Å; V274-K278 PolarHBondContact O-N 2.71Å; Q276-K278 PolarHBondContact O-N 2.82Å; K278-I280 VanDerWaalsContact C-N 3.29Å; K278-I280 PolarHBondContact O-N 3.19Å; K278-N281 PolarHBondContact O-N 2.68Å; K278-N281 VanDerWaalsContact O-N 3.15Å
279	R	98.5	Very high	97.1	Very high	188 Å²	188	27.8 Å²	27.8	71%	0.709	13%	0.126	S	C	*	.	H	α-helix	trans	-60.7	-36.5	-178	179.1	61.7	175.5	163.9	0.6	112.7	K275 Q276 F277 N281 Y306	K275-R279 VanDerWaalsContact O-CB 3.25Å; K275-R279 WeakPolarHBondContact O-CB 3.45Å; K275-R279 PolarHBondContact O-N 3.45Å; Q276-R279 WeakPolarHBondContact O-CB 3.32Å; Q276-R279 PolarHBondContact O-N 2.74Å; Q276-R279 VanDerWaalsContact O-N 3.11Å; F277-R279 PolarHBondContact O-N 2.53Å; R279-N281 VanDerWaalsContact C-N 3.3Å; R279-Y306 HydrophobicContact CG-CE2 4.33Å
280	I	98.4	Very high	96.4	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	6.4	-179.4	68.4	169.2	0	0	0	113.9	L272 Q276 F277 K278 G282 L297 R300 V301 A304 Y306 Q345	L272-I280 HydrophobicContact CD2-CD1 3.6Å; L272-I280 HydrophobicContact CD2-CG1 4.45Å; Q276-I280 WeakPolarHBondContact O-CG1 3.48Å; Q276-I280 PolarHBondContact O-N 3.21Å; F277-I280 WeakPolarHBondContact O-CG1 3.19Å; F277-I280 PolarHBondContact O-N 2.95Å; K278-I280 VanDerWaalsContact C-N 3.29Å; K278-I280 PolarHBondContact O-N 3.19Å; I280-G282 PolarHBondContact O-N 3.47Å; I280-L297 HydrophobicContact CD1-CD1 3.67Å; I280-R300 HydrophobicContact CB-CB 4.25Å; I280-R300 HydrophobicContact CD1-CB 4.31Å; I280-V301 HydrophobicContact CD1-CG2 4.15Å; I280-A304 HydrophobicContact CG2-CB 3.67Å; I280-Y306 HydrophobicContact CG2-CE2 4.47Å; I280-Q345 WeakPolarHBondContact O-CG 3.14Å; I280-Q345 PolarHBondContact O-NE2 3.46Å
281	N	98.6	Very high	95.8	Very high	24 Å²	24	29.9 Å²	29.9	13%	0.128	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	30.4	-171.9	-167.4	32.7	0	0	0	113.4	F277 K278 R279 Q345 G349 L350 N351	F277-N281 PolarHBondContact O-N 2.9Å; K278-N281 PolarHBondContact O-N 2.68Å; K278-N281 VanDerWaalsContact O-N 3.15Å; R279-N281 VanDerWaalsContact C-N 3.3Å; N281-Q345 PolarHBondContact ND2-O 3.43Å; N281-G349 CarbonylContact O-C 3.57Å; N281-G349 VanDerWaalsContact O-CA 3.23Å; N281-G349 WeakPolarHBondContact O-CA 3.37Å; N281-L350 PolarHBondContact O-N 2.79Å; N281-L350 PolarHBondContact OD1-N 2.85Å; N281-N351 PolarHBondContact ND2-OD1 3.45Å; N281-N351 PolarHBondContact OD1-N 2.95Å; N281-N351 VanDerWaalsContact OD1-N 3.15Å; N281-N351 PolarHBondContact OD1-OD1 2.87Å
282	G	98.4	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	59	-157.6	-177.4	0	0	0	0	0	115	F277 I280 R300	F277-G282 VanDerWaalsContact CE2-CA 3.47Å; F277-G282 VanDerWaalsContact CZ-CA 3.47Å; F277-G282 PolarHBondContact O-N 3.25Å; I280-G282 PolarHBondContact O-N 3.47Å; G282-R300 WeakPolarHBondContact O-CD 3.45Å; G282-R300 PolarHBondContact O-NH1 3.42Å; G282-R300 VanDerWaalsContact O-NH1 3.07Å
283	F	98.4	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-72.9	158.4	177.2	-84.6	-88	0	0	0	112.2	A205 F208 N209 F226 F277 L297 G349	A205-F283 HydrophobicContact CB-CB 3.98Å; A205-F283 HydrophobicContact CB-CD1 4.06Å; A205-F283 HydrophobicContact CB-CG 4.32Å; A205-F283 WeakPolarHBondContact O-CB 3.27Å; F208-F283 HydrophobicContact CB-CD2 3.63Å; F208-F283 HydrophobicContact CB-CE2 3.8Å; F208-F283 HydrophobicContact CB-CG 4.42Å; F208-F283 HydrophobicContact CD2-CD2 4.07Å; F208-F283 HydrophobicContact CD2-CE1 4.13Å; F208-F283 AromaticContact CD2-CE2 3.69Å; F208-F283 HydrophobicContact CD2-CE2 3.69Å; F208-F283 HydrophobicContact CD2-CG 4.49Å; F208-F283 AromaticContact CD2-CZ 3.7Å; F208-F283 HydrophobicContact CD2-CZ 3.7Å; F208-F283 HydrophobicContact CE2-CE2 4.5Å; F208-F283 HydrophobicContact CE2-CZ 4.15Å; F208-F283 HydrophobicContact CG-CD2 4.22Å; F208-F283 AromaticContact CG-CE2 3.94Å; F208-F283 HydrophobicContact CG-CE2 3.94Å; F208-F283 HydrophobicContact CG-CZ 4.39Å; N209-F283 PolarHBondContact ND2-O 3.21Å; N209-F283 PolarHBondContact OD1-N 2.83Å; F226-F283 HydrophobicContact CB-CE2 4.48Å; F226-F283 HydrophobicContact CB-CZ 4.4Å; F226-F283 AromaticContact CD1-CE2 3.66Å; F226-F283 HydrophobicContact CD1-CE2 3.66Å; F226-F283 HydrophobicContact CD1-CZ 4.37Å; F226-F283 AromaticContact CD2-CE2 3.89Å; F226-F283 HydrophobicContact CD2-CE2 3.89Å; F226-F283 HydrophobicContact CD2-CZ 4.13Å; F226-F283 HydrophobicContact CE1-CD2 4.4Å; F226-F283 AromaticContact CE1-CE2 3.73Å; F226-F283 HydrophobicContact CE1-CE2 3.73Å; F226-F283 AromaticContact CE2-CE2 3.99Å; F226-F283 HydrophobicContact CE2-CE2 3.99Å; F226-F283 AromaticContact CG-CE2 3.72Å; F226-F283 HydrophobicContact CG-CE2 3.72Å; F226-F283 HydrophobicContact CG-CZ 4.02Å; F226-F283 AromaticContact CZ-CE2 3.91Å; F226-F283 HydrophobicContact CZ-CE2 3.91Å; F277-F283 AromaticContact CE2-CD2 3.47Å; F277-F283 HydrophobicContact CE2-CD2 3.47Å; F277-F283 VanDerWaalsContact CE2-CD2 3.47Å; F277-F283 AromaticContact CE2-CE2 3.82Å; F277-F283 HydrophobicContact CE2-CE2 3.82Å; F277-F283 HydrophobicContact CE2-CG 4.49Å; F277-F283 AromaticContact CZ-CD2 3.76Å; F277-F283 HydrophobicContact CZ-CD2 3.76Å; F277-F283 HydrophobicContact CZ-CE2 4.38Å; F283-L297 HydrophobicContact CD1-CB 4.12Å; F283-L297 HydrophobicContact CD1-CD1 4.06Å; F283-L297 HydrophobicContact CD1-CD2 4.35Å; F283-L297 HydrophobicContact CD1-CG 4.4Å; F283-L297 HydrophobicContact CD2-CD1 4.31Å; F283-L297 HydrophobicContact CE1-CB 3.82Å; F283-L297 HydrophobicContact CE1-CD1 3.95Å; F283-L297 HydrophobicContact CE1-CD2 3.44Å; F283-L297 VanDerWaalsContact CE1-CD2 3.44Å; F283-L297 HydrophobicContact CE1-CG 3.93Å; F283-L297 HydrophobicContact CE2-CD1 4.16Å; F283-L297 HydrophobicContact CE2-CD2 4.1Å; F283-L297 HydrophobicContact CG-CD1 4.24Å; F283-L297 HydrophobicContact CZ-CB 4.5Å; F283-L297 HydrophobicContact CZ-CD1 4Å; F283-L297 HydrophobicContact CZ-CD2 3.28Å; F283-L297 HydrophobicContact CZ-CG 4.11Å; F283-G349 VanDerWaalsContact O-CA 3.24Å; F283-G349 WeakPolarHBondContact O-CA 3.23Å
284	P	97	Very high	95.1	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.			trans	-68.2	140.7	166.8	30.8	-37.7	0	0	0	112	A205 F287 E293 D296 D348	A205-P284 HydrophobicContact CB-CG 4.38Å; A205-P284 WeakPolarHBondContact CB-O 3.48Å; P284-F287 HydrophobicContact CB-CD2 3.62Å; P284-F287 HydrophobicContact CB-CE2 3.66Å; P284-F287 HydrophobicContact CG-CD2 3.38Å; P284-F287 HydrophobicContact CG-CE2 3.45Å; P284-F287 VanDerWaalsContact CG-CE2 3.45Å; P284-E293 HydrophobicContact CG-CB 4.39Å; P284-D296 WeakPolarHBondContact CB-OD2 3.18Å; P284-D296 HydrophobicContact CG-CB 3.93Å; P284-D296 VanDerWaalsContact CG-OD2 3.3Å; P284-D296 WeakPolarHBondContact CG-OD2 3.29Å; P284-D348 WeakPolarHBondContact CA-OD2 3.35Å; P284-D348 WeakPolarHBondContact CB-OD2 3.48Å
285	N	96.7	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-91.9	-8.3	174.2	-59.3	-44.1	0	0	0	113	N203 M206 N209 W288 D348 G349 N352 A377	N203-N285 PolarHBondContact ND2-O 3.49Å; M206-N285 HydrophobicContact CB-CB 4.36Å; M206-N285 HydrophobicContact CG-CB 4.15Å; M206-N285 WeakPolarHBondContact CG-OD1 3.33Å; M206-N285 HydrophobicContact SD-CB 4.32Å; N209-N285 PolarHBondContact ND2-OD1 3.35Å; N285-W288 PolarHBondContact O-NE1 2.76Å; N285-D348 WeakPolarHBondContact CA-OD1 3.35Å; N285-D348 VanDerWaalsContact CB-OD1 3.31Å; N285-D348 WeakPolarHBondContact CB-OD1 3.31Å; N285-D348 PolarHBondContact N-OD1 3.49Å; N285-D348 PolarHBondContact N-OD2 3.42Å; N285-G349 PolarHBondContact ND2-O 3.25Å; N285-N352 PolarHBondContact ND2-OD1 2.81Å; N285-A377 HydrophobicContact CB-CB 3.38Å
286	A	94.1	Very high	94.9	Very high	14 Å²	14	24 Å²	24	12%	0.116	11%	0.112	C	C	.	.			trans	-83.1	-6.9	-171.4	0	0	0	0	0	115.7	W288 L337 R344 D348 V379	A286-W288 PolarHBondContact O-N 2.97Å; A286-L337 HydrophobicContact CB-CD1 3.7Å; A286-L337 HydrophobicContact CB-CD2 4.31Å; A286-L337 WeakPolarHBondContact O-CD1 3.15Å; A286-R344 VanDerWaalsContact CB-NH1 3.29Å; A286-D348 WeakPolarHBondContact CB-OD2 3.3Å; A286-D348 PolarHBondContact N-OD2 2.93Å; A286-V379 HydrophobicContact CB-CG2 3.91Å
287	F	93.3	Very high	94.9	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.009	11%	0.109	C	C	.	.			trans	-86.9	98.9	-178.2	-71.8	-98.4	0	0	0	111.1	N203 P284 G292 E293 D296 F331 R334 L337 L338	N203-F287 PolarHBondContact OD1-O 2.95Å; P284-F287 HydrophobicContact CB-CD2 3.62Å; P284-F287 HydrophobicContact CB-CE2 3.66Å; P284-F287 HydrophobicContact CG-CD2 3.38Å; P284-F287 HydrophobicContact CG-CE2 3.45Å; P284-F287 VanDerWaalsContact CG-CE2 3.45Å; F287-G292 VanDerWaalsContact CE1-O 3.26Å; F287-G292 WeakPolarHBondContact CE1-O 3.4Å; F287-G292 WeakPolarHBondContact CZ-O 3.33Å; F287-E293 HydrophobicContact CB-CB 3.76Å; F287-E293 HydrophobicContact CD1-CB 4.1Å; F287-E293 HydrophobicContact CD2-CB 3.99Å; F287-E293 HydrophobicContact CG-CB 3.69Å; F287-D296 HydrophobicContact CE2-CB 3.77Å; F287-D296 HydrophobicContact CZ-CB 3.83Å; F287-F331 HydrophobicContact CD1-CD1 4.11Å; F287-F331 HydrophobicContact CD1-CE1 4.37Å; F287-R334 HydrophobicContact CD1-CB 4.3Å; F287-R334 HydrophobicContact CE1-CB 3.99Å; F287-L337 HydrophobicContact CD1-CD1 4.1Å; F287-L337 HydrophobicContact CD2-CD1 3.92Å; F287-L337 HydrophobicContact CE1-CB 4.05Å; F287-L337 HydrophobicContact CE1-CD1 4.09Å; F287-L337 HydrophobicContact CE2-CB 4.11Å; F287-L337 HydrophobicContact CE2-CD1 3.95Å; F287-L337 HydrophobicContact CG-CD1 4.01Å; F287-L337 HydrophobicContact CZ-CB 3.64Å; F287-L337 HydrophobicContact CZ-CD1 4.02Å; F287-L338 HydrophobicContact CE1-CG 4.42Å; F287-L338 HydrophobicContact CZ-CD2 4.34Å; F287-L338 HydrophobicContact CZ-CG 4.25Å
288	W	92.1	Very high	94.9	Very high	13 Å²	13	25.1 Å²	25.1	5%	0.049	12%	0.116	C	C	.	.			trans	-106.6	101.7	-179	-70.2	85.3	0	0	0	110.9	E200 P201 N203 M206 N285 A286 F331 L372 S373 R374	E200-W288 HydrophobicContact CB-CE3 4.27Å; E200-W288 HydrophobicContact CB-CZ3 3.8Å; P201-W288 HydrophobicContact CB-CB 4.21Å; P201-W288 VanDerWaalsContact O-CE3 3.25Å; N203-W288 HydrophobicContact CB-CD2 4.22Å; N203-W288 HydrophobicContact CB-CE3 3.99Å; N203-W288 HydrophobicContact CB-CH2 4.29Å; N203-W288 HydrophobicContact CB-CZ3 4.02Å; N203-W288 WeakPolarHBondContact ND2-CZ2 3.48Å; N203-W288 PolarHBondContact ND2-NE1 2.94Å; M206-W288 HydrophobicContact SD-CH2 4.21Å; M206-W288 HydrophobicContact SD-CZ2 3.89Å; N285-W288 PolarHBondContact O-NE1 2.76Å; A286-W288 PolarHBondContact O-N 2.97Å; W288-F331 VanDerWaalsContact O-CD2 3.25Å; W288-F331 WeakPolarHBondContact O-CD2 3.46Å; W288-L372 HydrophobicContact CH2-CB 3.75Å; W288-L372 HydrophobicContact CZ3-CB 4.34Å; W288-S373 VanDerWaalsContact CH2-CA 3.45Å; W288-S373 WeakPolarHBondContact CZ2-O 3.2Å; W288-R374 HydrophobicContact CD2-CG 3.96Å; W288-R374 HydrophobicContact CG-CG 4.1Å; W288-R374 HydrophobicContact CZ2-CG 4.22Å
289	G	87.9	Confident	94.8	Very high	16 Å²	16	21.8 Å²	21.8	17%	0.165	10%	0.103	C	C	.	.	S	Bend	trans	111.2	-168.3	-171.9	0	0	0	0	0	112	F202	F202-G289 PolarHBondContact O-N 3.45Å
290	W	82.9	Confident	94.8	Very high	37 Å²	37	12.8 Å²	12.8	14%	0.14	7%	0.07	C	C	.	.	B	Isolated β-bridge	trans	-83.8	123.6	-170.2	-173.4	92.5	0	0	0	113.2	N38 F42 H325 A329 Q330 F331	N38-W290 HydrophobicContact CB-CH2 3.29Å; N38-W290 HydrophobicContact CB-CZ2 4.04Å; N38-W290 HydrophobicContact CB-CZ3 3.65Å; N38-W290 VanDerWaalsContact CG-CH2 3.41Å; N38-W290 WeakPolarHBondContact ND2-CZ3 3.42Å; F42-W290 AromaticContact CE2-CH2 3.62Å; F42-W290 HydrophobicContact CE2-CH2 3.62Å; F42-W290 HydrophobicContact CE2-CZ2 4.01Å; F42-W290 AromaticContact CZ-CH2 3.92Å; F42-W290 HydrophobicContact CZ-CH2 3.92Å; W290-H325 AromaticContact CD1-CE1 3.46Å; W290-H325 VanDerWaalsContact CD1-CE1 3.46Å; W290-H325 AromaticContact CD1-CG 3.84Å; W290-H325 AromaticContact CD1-ND1 3.46Å; W290-H325 AromaticContact CD1-NE2 3.82Å; W290-H325 AromaticContact NE1-CD2 3.61Å; W290-H325 AromaticContact NE1-CE1 3.39Å; W290-H325 PolarHBondContact NE1-CE1 3.02Å; W290-H325 AromaticContact NE1-CG 3.88Å; W290-H325 AromaticContact NE1-ND1 3.75Å; W290-H325 AromaticContact NE1-NE2 3.27Å; W290-H325 PolarHBondContact NE1-NE2 3.34Å; W290-A329 PolarHBondContact N-O 3.15Å; W290-Q330 HydrophobicContact CE3-CG 4.39Å; W290-F331 PolarHBondContact O-N 2.73Å; W290-F331 VanDerWaalsContact O-N 3.1Å
291	G	85.3	Confident	94.8	Very high	7 Å²	7	12.8 Å²	12.8	7%	0.072	7%	0.069	C	C	.	.	S	Bend	trans	101.9	146.2	156.7	0	0	0	0	0	117.4	E293 R334	G291-E293 WeakPolarHBondContact CA-OE2 3.45Å; G291-R334 WeakPolarHBondContact O-CB 3.39Å; G291-R334 WeakPolarHBondContact O-CD 3.42Å
292	G	90.1	Very high	94.8	Very high	3 Å²	3	15 Å²	15	3%	0.031	8%	0.079	C	C	.	.	S	Bend	trans	94.9	-6.3	171.7	0	0	0	0	0	114.4	F287 D296 L338	F287-G292 VanDerWaalsContact CE1-O 3.26Å; F287-G292 WeakPolarHBondContact CE1-O 3.4Å; F287-G292 WeakPolarHBondContact CZ-O 3.33Å; G292-D296 PolarHBondContact O-N 3.26Å; G292-D296 VanDerWaalsContact O-N 3.13Å; G292-L338 WeakPolarHBondContact O-CD2 3.25Å
293	E	95.8	Very high	94.8	Very high	18 Å²	18	18.8 Å²	18.8	8%	0.084	10%	0.096	C	C	.	.	H	α-helix	trans	-77	-30	179.2	81.4	-66.4	170.2	0	0	113.2	R204 A205 P284 F287 G291 L297	R204-E293 WeakPolarHBondContact CD-OE1 3.24Å; R204-E293 IonicContact CZ-OE1 3.93Å; R204-E293 IonicContact NE-OE1 2.96Å; R204-E293 IonicContact NH1-OE1 2.69Å; R204-E293 PolarHBondContact NH1-OE1 3.47Å; A205-E293 HydrophobicContact CB-CB 3.8Å; A205-E293 HydrophobicContact CB-CG 3.82Å; P284-E293 HydrophobicContact CG-CB 4.39Å; F287-E293 HydrophobicContact CB-CB 3.76Å; F287-E293 HydrophobicContact CD1-CB 4.1Å; F287-E293 HydrophobicContact CD2-CB 3.99Å; F287-E293 HydrophobicContact CG-CB 3.69Å; G291-E293 WeakPolarHBondContact CA-OE2 3.45Å; E293-L297 PolarHBondContact O-N 3.45Å
294	D	96.1	Very high	94.7	Very high	16 Å²	16	20 Å²	20	9%	0.086	11%	0.106	C	C	.	.	H	α-helix	trans	-73.1	-38.1	172.8	57	-32.3	0	0	0	111.9	G267 D296 L297 W298	G267-D294 WeakPolarHBondContact CA-OD2 3.05Å; G267-D294 PolarHBondContact N-OD2 2.82Å; D294-D296 VanDerWaalsContact C-N 3.34Å; D294-L297 WeakPolarHBondContact O-CB 3.37Å; D294-L297 PolarHBondContact O-N 2.8Å; D294-W298 PolarHBondContact O-N 3.19Å
295	D	96.2	Very high	94.7	Very high	35 Å²	35	27.2 Å²	27.2	19%	0.187	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-41.1	169.7	-68.6	-38.1	0	0	0	111.8	Y262 W298 N299 L338	Y262-D295 VanDerWaalsContact CE2-OD1 3.29Å; Y262-D295 WeakPolarHBondContact CE2-OD1 3.44Å; Y262-D295 PolarHBondContact OH-OD1 3.33Å; Y262-D295 VanDerWaalsContact OH-OD1 3.08Å; D295-W298 WeakPolarHBondContact O-CB 3.45Å; D295-W298 PolarHBondContact O-N 2.96Å; D295-N299 PolarHBondContact O-N 2.83Å; D295-N299 PolarHBondContact O-ND2 2.83Å; D295-L338 HydrophobicContact CB-CD1 4.28Å; D295-L338 HydrophobicContact CB-CD2 3.66Å
296	D	97.6	Very high	94.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.9	-39	174.9	-165.3	88.5	0	0	0	110.9	P284 F287 G292 D294 N299 R300 L338 S341 R344	P284-D296 WeakPolarHBondContact CB-OD2 3.18Å; P284-D296 HydrophobicContact CG-CB 3.93Å; P284-D296 VanDerWaalsContact CG-OD2 3.3Å; P284-D296 WeakPolarHBondContact CG-OD2 3.29Å; F287-D296 HydrophobicContact CE2-CB 3.77Å; F287-D296 HydrophobicContact CZ-CB 3.83Å; G292-D296 PolarHBondContact O-N 3.26Å; G292-D296 VanDerWaalsContact O-N 3.13Å; D294-D296 VanDerWaalsContact C-N 3.34Å; D296-N299 WeakPolarHBondContact O-CB 3.45Å; D296-N299 PolarHBondContact O-N 3.35Å; D296-R300 VanDerWaalsContact O-CG 3.23Å; D296-R300 WeakPolarHBondContact O-CG 3.31Å; D296-R300 PolarHBondContact O-N 2.83Å; D296-R300 IonicContact OD2-CZ 3.45Å; D296-R300 IonicContact OD2-NE 3.61Å; D296-R300 PolarHBondContact OD2-NE 2.88Å; D296-R300 IonicContact OD2-NH2 2.83Å; D296-R300 PolarHBondContact OD2-NH2 3.44Å; D296-L338 HydrophobicContact CB-CD2 3.97Å; D296-S341 VanDerWaalsContact CG-OG 3.23Å; D296-S341 WeakPolarHBondContact OD1-CB 3.21Å; D296-S341 PolarHBondContact OD1-OG 3.01Å; D296-R344 IonicContact OD1-NH2 3.57Å; D296-R344 PolarHBondContact OD1-NH2 3.28Å; D296-R344 VanDerWaalsContact OD1-NH2 3.15Å; D296-R344 IonicContact OD2-NH2 2.78Å
297	L	98.3	Very high	94.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-44.9	172.5	-176.1	73.1	0	0	0	111.8	F266 L272 I280 F283 E293 D294 N299 R300 V301	F266-L297 HydrophobicContact CD1-CB 4.38Å; F266-L297 HydrophobicContact CD1-CD2 3.58Å; F266-L297 HydrophobicContact CD1-CG 3.93Å; F266-L297 HydrophobicContact CE1-CD2 3.51Å; F266-L297 HydrophobicContact CE1-CG 3.92Å; F266-L297 HydrophobicContact CZ-CD2 4.47Å; L272-L297 HydrophobicContact CD1-CD2 4.3Å; I280-L297 HydrophobicContact CD1-CD1 3.67Å; F283-L297 HydrophobicContact CD1-CB 4.12Å; F283-L297 HydrophobicContact CD1-CD1 4.06Å; F283-L297 HydrophobicContact CD1-CD2 4.35Å; F283-L297 HydrophobicContact CD1-CG 4.4Å; F283-L297 HydrophobicContact CD2-CD1 4.31Å; F283-L297 HydrophobicContact CE1-CB 3.82Å; F283-L297 HydrophobicContact CE1-CD1 3.95Å; F283-L297 HydrophobicContact CE1-CD2 3.44Å; F283-L297 VanDerWaalsContact CE1-CD2 3.44Å; F283-L297 HydrophobicContact CE1-CG 3.93Å; F283-L297 HydrophobicContact CE2-CD1 4.16Å; F283-L297 HydrophobicContact CE2-CD2 4.1Å; F283-L297 HydrophobicContact CG-CD1 4.24Å; F283-L297 HydrophobicContact CZ-CB 4.5Å; F283-L297 HydrophobicContact CZ-CD1 4Å; F283-L297 HydrophobicContact CZ-CD2 3.28Å; F283-L297 HydrophobicContact CZ-CG 4.11Å; E293-L297 PolarHBondContact O-N 3.45Å; D294-L297 WeakPolarHBondContact O-CB 3.37Å; D294-L297 PolarHBondContact O-N 2.8Å; L297-N299 VanDerWaalsContact C-N 3.33Å; L297-N299 PolarHBondContact O-N 3.48Å; L297-R300 PolarHBondContact O-N 3.18Å; L297-V301 WeakPolarHBondContact O-CG2 3.05Å; L297-V301 PolarHBondContact O-N 3.02Å
298	W	98.1	Very high	95.1	Very high	36 Å²	36	35.4 Å²	35.4	14%	0.136	19%	0.19	C	C	.	.	H	α-helix	trans	-56	-49.5	174.9	174.8	-85.8	0	0	0	111	N263 E264 F266 D294 D295 R300 V301 Q302 V308	N263-W298 WeakPolarHBondContact O-CH2 3.49Å; E264-W298 HydrophobicContact CB-CD2 4.11Å; E264-W298 HydrophobicContact CB-CG 4.05Å; E264-W298 HydrophobicContact CG-CZ2 4.46Å; F266-W298 HydrophobicContact CB-CB 4.26Å; F266-W298 HydrophobicContact CB-CE3 4.1Å; F266-W298 HydrophobicContact CD1-CB 4.42Å; F266-W298 HydrophobicContact CG-CE3 4.26Å; D294-W298 PolarHBondContact O-N 3.19Å; D295-W298 WeakPolarHBondContact O-CB 3.45Å; D295-W298 PolarHBondContact O-N 2.96Å; W298-R300 PolarHBondContact O-N 2.78Å; W298-V301 WeakPolarHBondContact O-CB 3.49Å; W298-V301 PolarHBondContact O-N 2.87Å; W298-Q302 WeakPolarHBondContact O-CG 3.18Å; W298-Q302 PolarHBondContact O-N 3.27Å; W298-V308 HydrophobicContact CD2-CG2 4.43Å; W298-V308 HydrophobicContact CE3-CB 4.1Å; W298-V308 HydrophobicContact CE3-CG1 4.41Å; W298-V308 HydrophobicContact CE3-CG2 3.61Å; W298-V308 HydrophobicContact CH2-CB 3.99Å; W298-V308 HydrophobicContact CH2-CG2 4.21Å; W298-V308 HydrophobicContact CZ3-CB 3.45Å; W298-V308 VanDerWaalsContact CZ3-CB 3.45Å; W298-V308 HydrophobicContact CZ3-CG1 3.79Å; W298-V308 HydrophobicContact CZ3-CG2 3.5Å; W298-V308 VanDerWaalsContact CZ3-CG2 3.5Å
299	N	98.1	Very high	95.4	Very high	47 Å²	47	36.2 Å²	36.2	25%	0.251	20%	0.198	S	C	.	.	H	α-helix	trans	-57.7	-47.5	177.4	-73.5	-27.6	0	0	0	112	D295 D296 L297 V301 Q302 F303	D295-N299 PolarHBondContact O-N 2.83Å; D295-N299 PolarHBondContact O-ND2 2.83Å; D296-N299 WeakPolarHBondContact O-CB 3.45Å; D296-N299 PolarHBondContact O-N 3.35Å; L297-N299 VanDerWaalsContact C-N 3.33Å; L297-N299 PolarHBondContact O-N 3.48Å; N299-V301 VanDerWaalsContact C-N 3.29Å; N299-V301 PolarHBondContact O-N 3.1Å; N299-Q302 PolarHBondContact O-N 3.2Å; N299-Q302 VanDerWaalsContact O-N 3.12Å; N299-F303 HydrophobicContact CB-CD2 4.49Å; N299-F303 HydrophobicContact CB-CE2 3.74Å; N299-F303 HydrophobicContact CB-CZ 3.76Å; N299-F303 WeakPolarHBondContact O-CD1 3.44Å; N299-F303 WeakPolarHBondContact O-CD2 3.48Å; N299-F303 WeakPolarHBondContact O-CG 3.42Å; N299-F303 PolarHBondContact O-N 3.31Å
300	R	98.4	Very high	95.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-38.8	177.4	-72.4	178.9	-174.9	-123	-9.6	113.1	I280 G282 D296 L297 W298 A304 Q345 D348	I280-R300 HydrophobicContact CB-CB 4.25Å; I280-R300 HydrophobicContact CD1-CB 4.31Å; G282-R300 WeakPolarHBondContact O-CD 3.45Å; G282-R300 PolarHBondContact O-NH1 3.42Å; G282-R300 VanDerWaalsContact O-NH1 3.07Å; D296-R300 VanDerWaalsContact O-CG 3.23Å; D296-R300 WeakPolarHBondContact O-CG 3.31Å; D296-R300 PolarHBondContact O-N 2.83Å; D296-R300 IonicContact OD2-CZ 3.45Å; D296-R300 IonicContact OD2-NE 3.61Å; D296-R300 PolarHBondContact OD2-NE 2.88Å; D296-R300 IonicContact OD2-NH2 2.83Å; D296-R300 PolarHBondContact OD2-NH2 3.44Å; L297-R300 PolarHBondContact O-N 3.18Å; W298-R300 PolarHBondContact O-N 2.78Å; R300-A304 PolarHBondContact O-N 3.18Å; R300-Q345 HydrophobicContact CG-CB 4.3Å; R300-Q345 HydrophobicContact CG-CG 3.85Å; R300-D348 VanDerWaalsContact CZ-O 3.28Å; R300-D348 PolarHBondContact NH1-O 3.36Å; R300-D348 PolarHBondContact NH2-O 3.49Å; R300-D348 IonicContact NH2-OD2 3.86Å
301	V	98.1	Very high	96.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-46.6	174.7	163.3	0	0	0	0	110.6	P246 F266 L272 I280 L297 W298 N299 A304 Y306 V308	P246-V301 HydrophobicContact CB-CG1 4.2Å; P246-V301 HydrophobicContact CB-CG2 4.4Å; P246-V301 HydrophobicContact CG-CG1 3.88Å; P246-V301 HydrophobicContact CG-CG2 4.22Å; F266-V301 HydrophobicContact CE1-CG2 4.23Å; L272-V301 HydrophobicContact CD2-CG2 4.03Å; I280-V301 HydrophobicContact CD1-CG2 4.15Å; L297-V301 WeakPolarHBondContact O-CG2 3.05Å; L297-V301 PolarHBondContact O-N 3.02Å; W298-V301 WeakPolarHBondContact O-CB 3.49Å; W298-V301 PolarHBondContact O-N 2.87Å; N299-V301 VanDerWaalsContact C-N 3.29Å; N299-V301 PolarHBondContact O-N 3.1Å; V301-A304 PolarHBondContact O-N 2.83Å; V301-Y306 PolarHBondContact O-N 3.36Å; V301-Y306 VanDerWaalsContact O-N 3.13Å; V301-V308 HydrophobicContact CG1-CG2 3.8Å
302	Q	97.9	Very high	96.6	Very high	71 Å²	71	44.7 Å²	44.7	33%	0.332	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-41.9	176.7	-65.9	-51.9	-59.8	0	0	112.3	W298 N299 A304 N305 Y306	W298-Q302 WeakPolarHBondContact O-CG 3.18Å; W298-Q302 PolarHBondContact O-N 3.27Å; N299-Q302 PolarHBondContact O-N 3.2Å; N299-Q302 VanDerWaalsContact O-N 3.12Å; Q302-A304 PolarHBondContact O-N 3.13Å; Q302-N305 WeakPolarHBondContact O-CA 3.42Å; Q302-N305 PolarHBondContact O-N 3.23Å; Q302-Y306 PolarHBondContact NE2-O 3.1Å
303	F	97.6	Very high	96.6	Very high	80 Å²	80	46.9 Å²	46.9	35%	0.351	25%	0.253	S	S	.	.	H	α-helix	trans	-63.1	-24.9	177.6	-58.6	-27.9	0	0	0	113.1	N299 N305 K342	N299-F303 HydrophobicContact CB-CD2 4.49Å; N299-F303 HydrophobicContact CB-CE2 3.74Å; N299-F303 HydrophobicContact CB-CZ 3.76Å; N299-F303 WeakPolarHBondContact O-CD1 3.44Å; N299-F303 WeakPolarHBondContact O-CD2 3.48Å; N299-F303 WeakPolarHBondContact O-CG 3.42Å; N299-F303 PolarHBondContact O-N 3.31Å; F303-N305 VanDerWaalsContact C-N 3.29Å; F303-K342 HydrophobicContact CD2-CB 4.12Å; F303-K342 HydrophobicContact CD2-CG 4.15Å; F303-K342 HydrophobicContact CE1-CB 4.43Å; F303-K342 HydrophobicContact CE1-CD 4.42Å; F303-K342 HydrophobicContact CE2-CB 3.62Å; F303-K342 HydrophobicContact CE2-CG 4.13Å; F303-K342 HydrophobicContact CG-CG 4.39Å; F303-K342 HydrophobicContact CZ-CB 3.8Å; F303-K342 HydrophobicContact CZ-CG 4.33Å
304	A	97.6	Very high	96.4	Very high	25 Å²	25	50.2 Å²	50.2	21%	0.207	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	10.4	173.4	0	0	0	0	0	113.7	I280 R300 V301 Q302 Y306	I280-A304 HydrophobicContact CG2-CB 3.67Å; R300-A304 PolarHBondContact O-N 3.18Å; V301-A304 PolarHBondContact O-N 2.83Å; Q302-A304 PolarHBondContact O-N 3.13Å; A304-Y306 VanDerWaalsContact C-N 3.28Å; A304-Y306 HydrophobicContact CB-CD2 3.66Å; A304-Y306 HydrophobicContact CB-CE2 3.72Å; A304-Y306 PolarHBondContact O-N 3.41Å
305	N	97.8	Very high	96.3	Very high	151 Å²	151	52 Å²	52	81%	0.807	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	33.8	-178.8	-60.4	-30.7	0	0	0	114	Q302 F303	Q302-N305 WeakPolarHBondContact O-CA 3.42Å; Q302-N305 PolarHBondContact O-N 3.23Å; F303-N305 VanDerWaalsContact C-N 3.29Å
306	Y	98	Very high	96.3	Very high	64 Å²	64	50.3 Å²	50.3	25%	0.251	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-98.9	145.3	170.9	-63.6	-54.2	0	0	0	110.5	P246 Q276 R279 I280 V301 Q302 A304	P246-Y306 HydrophobicContact CG-CG 4.39Å; Q276-Y306 HydrophobicContact CB-CE2 4.12Å; Q276-Y306 HydrophobicContact CG-CD2 4.39Å; Q276-Y306 HydrophobicContact CG-CE1 4.08Å; Q276-Y306 HydrophobicContact CG-CE2 3.9Å; R279-Y306 HydrophobicContact CG-CE2 4.33Å; I280-Y306 HydrophobicContact CG2-CE2 4.47Å; V301-Y306 PolarHBondContact O-N 3.36Å; V301-Y306 VanDerWaalsContact O-N 3.13Å; Q302-Y306 PolarHBondContact NE2-O 3.1Å; A304-Y306 VanDerWaalsContact C-N 3.28Å; A304-Y306 HydrophobicContact CB-CD2 3.66Å; A304-Y306 HydrophobicContact CB-CE2 3.72Å; A304-Y306 PolarHBondContact O-N 3.41Å
307	S	96.6	Very high	96.3	Very high	99 Å²	99	53.1 Å²	53.1	69%	0.692	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-102.8	136	173.3	-56	0	0	0	0	109.8
308	V	97.7	Very high	96.3	Very high	26 Å²	26	53.1 Å²	53.1	16%	0.158	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-81.2	124.1	177	176.4	0	0	0	0	109.4	P246 H248 F266 W298 V301	P246-V308 HydrophobicContact CB-CG2 4.48Å; P246-V308 WeakPolarHBondContact O-CA 3.33Å; H248-V308 HydrophobicContact CB-CG1 3.85Å; F266-V308 HydrophobicContact CD2-CG1 4.04Å; F266-V308 HydrophobicContact CE1-CG2 4.31Å; F266-V308 HydrophobicContact CE2-CG1 3.69Å; F266-V308 HydrophobicContact CE2-CG2 4.34Å; F266-V308 HydrophobicContact CZ-CG1 4.25Å; F266-V308 HydrophobicContact CZ-CG2 4.16Å; W298-V308 HydrophobicContact CD2-CG2 4.43Å; W298-V308 HydrophobicContact CE3-CB 4.1Å; W298-V308 HydrophobicContact CE3-CG1 4.41Å; W298-V308 HydrophobicContact CE3-CG2 3.61Å; W298-V308 HydrophobicContact CH2-CB 3.99Å; W298-V308 HydrophobicContact CH2-CG2 4.21Å; W298-V308 HydrophobicContact CZ3-CB 3.45Å; W298-V308 VanDerWaalsContact CZ3-CB 3.45Å; W298-V308 HydrophobicContact CZ3-CG1 3.79Å; W298-V308 HydrophobicContact CZ3-CG2 3.5Å; W298-V308 VanDerWaalsContact CZ3-CG2 3.5Å; V301-V308 HydrophobicContact CG1-CG2 3.8Å
309	S	97.9	Very high	96.2	Very high	30 Å²	30	53.9 Å²	53.9	21%	0.21	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-87	156.1	171.1	77.8	0	0	0	0	111.6	D244 P246 R247 H248	D244-S309 WeakPolarHBondContact CB-OG 3.17Å; D244-S309 WeakPolarHBondContact O-CB 3.26Å; D244-S309 PolarHBondContact O-OG 3.27Å; P246-S309 PolarHBondContact O-N 3.31Å; R247-S309 WeakPolarHBondContact CB-OG 3.28Å; R247-S309 WeakPolarHBondContact CG-OG 3.17Å; H248-S309 PolarHBondContact N-O 3.1Å
310	R	97.2	Very high	96	Very high	64 Å²	64	52.1 Å²	52.1	24%	0.242	28%	0.28	C	S	.	.			trans	-137.3	139.4	177.2	-78.1	177.8	178.6	144	-1.7	109.7	H248 V251 L260 N263 F265	H248-R310 HydrophobicContact CB-CG 3.89Å; H248-R310 PolarHBondContact ND1-NE 3.39Å; V251-R310 HydrophobicContact CG2-CB 3.87Å; V251-R310 HydrophobicContact CG2-CG 3.75Å; L260-R310 VanDerWaalsContact CD2-NH1 3.3Å; N263-R310 VanDerWaalsContact O-CZ 3.29Å; N263-R310 PolarHBondContact O-NH1 2.8Å; N263-R310 PolarHBondContact O-NH2 3.37Å; F265-R310 PolarHBondContact O-NH2 3.23Å
311	P	94.7	Very high	95.7	Very high	12 Å²	12	52.5 Å²	52.5	8%	0.078	28%	0.282	C	S	.	.			trans	-62	144.4	171	28.1	-36.2	0	0	0	111.1	H248 V251 L315 G316	H248-P311 WeakPolarHBondContact O-CD 3.35Å; V251-P311 HydrophobicContact CG2-CG 3.85Å; P311-L315 HydrophobicContact CB-CB 3.87Å; P311-G316 VanDerWaalsContact CG-CA 3.45Å
312	H	89.2	Confident	95	Very high	161 Å²	161	56 Å²	56	75%	0.745	30%	0.304	S	S	*	.			trans	-77.4	150.9	-179.3	-62.7	-77.8	0	0	0	112.7	D314 L315	H312-D314 PolarHBondContact O-N 3.18Å; H312-L315 WeakPolarHBondContact O-CB 3.49Å; H312-L315 WeakPolarHBondContact O-CG 3.32Å; H312-L315 PolarHBondContact O-N 3.11Å
313	G	90	Very high	93.7	Very high	49 Å²	49	57.8 Å²	57.8	51%	0.505	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	-126.5	169	0	0	0	0	0	113	K252	K252-G313 WeakPolarHBondContact CE-O 3.28Å; K252-G313 PolarHBondContact NZ-O 2.78Å
314	D	91.9	Very high	92	Very high	88 Å²	88	55.2 Å²	55.2	47%	0.471	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	1.2	-175.2	-73.8	-9.3	0	0	0	114	K252 H312 G316 R317	K252-D314 IonicContact NZ-OD1 3.24Å; K252-D314 PolarHBondContact NZ-OD1 2.69Å; K252-D314 VanDerWaalsContact NZ-OD1 3.08Å; H312-D314 PolarHBondContact O-N 3.18Å; D314-G316 VanDerWaalsContact C-N 3.25Å; D314-G316 PolarHBondContact O-N 2.95Å; D314-R317 HydrophobicContact CB-CG 4.24Å; D314-R317 WeakPolarHBondContact O-CB 3.46Å; D314-R317 WeakPolarHBondContact O-CG 3.48Å; D314-R317 PolarHBondContact O-N 2.95Å
315	L	94.3	Very high	90.1	Very high	53 Å²	53	55.9 Å²	55.9	28%	0.277	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-34.3	174.9	-64.4	178.5	0	0	0	111.6	R237 N238 P311 H312 R317	R237-L315 HydrophobicContact CB-CD2 3.72Å; N238-L315 VanDerWaalsContact CB-O 3.3Å; N238-L315 WeakPolarHBondContact CB-O 3.37Å; N238-L315 PolarHBondContact ND2-O 2.92Å; P311-L315 HydrophobicContact CB-CB 3.87Å; H312-L315 WeakPolarHBondContact O-CB 3.49Å; H312-L315 WeakPolarHBondContact O-CG 3.32Å; H312-L315 PolarHBondContact O-N 3.11Å; L315-R317 PolarHBondContact O-N 3.38Å
316	G	95.9	Very high	88.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	15.5	180	0	0	0	0	0	115.2	F249 V251 K252 P311 D314	F249-G316 WeakPolarHBondContact O-CA 3.41Å; V251-G316 PolarHBondContact N-O 3.14Å; K252-G316 PolarHBondContact N-O 2.82Å; P311-G316 VanDerWaalsContact CG-CA 3.45Å; D314-G316 VanDerWaalsContact C-N 3.25Å; D314-G316 PolarHBondContact O-N 2.95Å
317	R	97.6	Very high	86.3	Confident	60 Å²	60	58.5 Å²	58.5	23%	0.226	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.5	-178.4	-68.6	177	64.7	134.9	0.1	112.8	E234 K252 Y258 D314 L315	E234-R317 HydrophobicContact CB-CB 4.14Å; E234-R317 HydrophobicContact CG-CB 4.38Å; E234-R317 PolarHBondContact N-O 3.26Å; E234-R317 VanDerWaalsContact OE1-CB 3.23Å; E234-R317 WeakPolarHBondContact OE1-CB 2.97Å; E234-R317 IonicContact OE1-CZ 3.72Å; E234-R317 IonicContact OE1-NE 3.26Å; E234-R317 PolarHBondContact OE1-NE 3.34Å; E234-R317 IonicContact OE1-NH2 3.87Å; K252-R317 HydrophobicContact CB-CB 4.49Å; K252-R317 HydrophobicContact CB-CG 3.88Å; K252-R317 HydrophobicContact CD-CG 3.9Å; K252-R317 WeakPolarHBondContact O-CA 3.43Å; Y258-R317 HydrophobicContact CD1-CB 4.14Å; Y258-R317 HydrophobicContact CD1-CG 3.91Å; Y258-R317 HydrophobicContact CE1-CB 4.14Å; Y258-R317 HydrophobicContact CE1-CG 4.33Å; D314-R317 HydrophobicContact CB-CG 4.24Å; D314-R317 WeakPolarHBondContact O-CB 3.46Å; D314-R317 WeakPolarHBondContact O-CG 3.48Å; D314-R317 PolarHBondContact O-N 2.95Å; L315-R317 PolarHBondContact O-N 3.38Å
318	Y	97.9	Very high	84.9	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	143.1	-179	-79.4	-110.3	0	0	0	109.7	H231 L232 M233 N238 Y240 F249 A250 K252 D254 V269	H231-Y318 HydrophobicContact CB-CD1 3.93Å; L232-Y318 VanDerWaalsContact C-CD1 3.47Å; L232-Y318 CarbonylContact O-C 3.48Å; L232-Y318 VanDerWaalsContact O-CA 3.25Å; L232-Y318 WeakPolarHBondContact O-CA 3.33Å; M233-Y318 HydrophobicContact CB-CD1 4.06Å; M233-Y318 HydrophobicContact CB-CE1 3.56Å; M233-Y318 HydrophobicContact CB-CE2 4.14Å; N238-Y318 VanDerWaalsContact ND2-CE2 3.34Å; N238-Y318 WeakPolarHBondContact ND2-CE2 3.42Å; N238-Y318 PolarHBondContact ND2-OH 3.19Å; Y240-Y318 WeakPolarHBondContact CE1-OH 3.38Å; Y240-Y318 WeakPolarHBondContact OH-CE1 3.42Å; Y240-Y318 PolarHBondContact OH-OH 3.26Å; F249-Y318 HydrophobicContact CB-CE2 4.45Å; F249-Y318 WeakPolarHBondContact CB-OH 3.3Å; F249-Y318 VanDerWaalsContact O-CE2 3.25Å; F249-Y318 WeakPolarHBondContact O-CE2 3.42Å; A250-Y318 HydrophobicContact CB-CD1 4.35Å; A250-Y318 HydrophobicContact CB-CD2 3.94Å; A250-Y318 HydrophobicContact CB-CE2 4.14Å; A250-Y318 HydrophobicContact CB-CG 4.07Å; K252-Y318 PolarHBondContact O-N 3.27Å; D254-Y318 PolarHBondContact N-O 3.26Å; V269-Y318 HydrophobicContact CB-CE1 4.45Å; V269-Y318 HydrophobicContact CG2-CD1 4.44Å; V269-Y318 HydrophobicContact CG2-CE1 3.91Å
319	M	96.6	Very high	83.7	Confident	52 Å²	52	58 Å²	58	26%	0.256	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.5	165.7	-61.5	-175.5	69.2	0	0	110.6	V120 M122 L232 E234 D254	V120-M319 HydrophobicContact CB-SD 3.74Å; V120-M319 HydrophobicContact CG1-CB 4.36Å; V120-M319 HydrophobicContact CG1-SD 4.16Å; V120-M319 HydrophobicContact CG2-CG 4.37Å; V120-M319 HydrophobicContact CG2-SD 3.94Å; M122-M319 HydrophobicContact CE-CB 3.31Å; M122-M319 HydrophobicContact CE-CE 3.83Å; M122-M319 HydrophobicContact CE-CG 4.37Å; M122-M319 HydrophobicContact CE-SD 4.31Å; M122-M319 HydrophobicContact SD-CE 4.45Å; L232-M319 PolarHBondContact N-O 2.9Å; L232-M319 PolarHBondContact O-N 3.06Å; E234-M319 HydrophobicContact CG-CG 3.79Å; D254-M319 VanDerWaalsContact CG-CA 3.5Å; D254-M319 WeakPolarHBondContact OD2-CA 3.43Å
320	S	93.9	Very high	82.7	Confident	9 Å²	9	58.8 Å²	58.8	6%	0.063	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.7	179.7	-48.4	0	0	0	0	108.4	D230 H231 D254	D230-S320 CarbonylContact O-C 3.6Å; D230-S320 WeakPolarHBondContact O-CA 3.41Å; H231-S320 PolarHBondContact CE1-OG 3.07Å; H231-S320 PolarHBondContact ND1-OG 2.82Å; D254-S320 WeakPolarHBondContact OD1-CB 3.34Å; D254-S320 PolarHBondContact OD1-N 3.49Å; D254-S320 PolarHBondContact OD1-OG 3.31Å; D254-S320 PolarHBondContact OD2-N 3.35Å
321	I	92.3	Very high	82	Confident	9 Å²	9	57.8 Å²	57.8	5%	0.046	32%	0.315	C	S	.	.			trans	-57.2	135.7	174.4	-56.5	176.3	0	0	0	108.1	H170 I173 D230 L232 H324	H170-I321 HydrophobicContact CB-CD1 4.05Å; I173-I321 HydrophobicContact CB-CD1 3.93Å; I173-I321 HydrophobicContact CD1-CD1 4.23Å; I173-I321 HydrophobicContact CD1-CG2 4.43Å; I173-I321 HydrophobicContact CG2-CD1 3.77Å; I173-I321 HydrophobicContact CG2-CG1 4.43Å; D230-I321 HydrophobicContact CB-CB 4.27Å; D230-I321 HydrophobicContact CB-CD1 4.41Å; D230-I321 HydrophobicContact CB-CG1 4.47Å; D230-I321 PolarHBondContact O-N 3.12Å; L232-I321 HydrophobicContact CD1-CD1 4.24Å; L232-I321 HydrophobicContact CD1-CG1 3.92Å; L232-I321 HydrophobicContact CG-CD1 4.46Å; L232-I321 HydrophobicContact CG-CG1 4.22Å; I321-H324 PolarHBondContact N-NE2 3.27Å; I321-H324 PolarHBondContact O-CD2 2.93Å; I321-H324 PolarHBondContact O-CE1 2.88Å; I321-H324 PolarHBondContact O-ND1 3.45Å; I321-H324 PolarHBondContact O-NE2 3.28Å
322	P	83	Confident	81.2	Confident	73 Å²	73	63.2 Å²	63.2	47%	0.474	34%	0.342	S	S	.	.	S	Bend	trans	-59.6	163.5	178.9	-27.3	36.3	0	0	0	113.4	H170	H170-P322 PolarHBondContact NE2-O 3.17Å
323	H	69.2	Low	80.9	Confident	108 Å²	108	57 Å²	57	50%	0.5	32%	0.321	S	S	.	.			trans	78.9	27.2	175.6	-49.2	-49.7	0	0	0	117.8	H325 R326	H323-H325 PolarHBondContact O-N 2.81Å; H323-R326 PolarHBondContact CE1-NH2 3.5Å; H323-R326 PolarHBondContact ND1-NH2 2.98Å
324	H	61.8	Low	80.6	Confident	26 Å²	26	55.7 Å²	55.7	12%	0.12	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	119.8	171.2	-67	-16.6	0	0	0	112.3	R167 H170 D230 I321	R167-H324 PolarHBondContact NH1-ND1 2.91Å; R167-H324 VanDerWaalsContact NH1-ND1 3.11Å; H170-H324 AromaticContact CE1-CE1 3.71Å; H170-H324 AromaticContact CE1-ND1 3.76Å; H170-H324 AromaticContact ND1-CE1 3.99Å; D230-H324 WeakPolarHBondContact CB-CE1 3.32Å; D230-H324 WeakPolarHBondContact CB-NE2 3.25Å; D230-H324 PolarHBondContact O-NE2 3.39Å; D230-H324 IonicContact OD1-CE1 2.8Å; D230-H324 IonicContact OD1-NE2 3.7Å; D230-H324 IonicContact OD2-CD2 3.98Å; D230-H324 IonicContact OD2-CE1 3.71Å; D230-H324 PolarHBondContact OD2-CE1 2.93Å; D230-H324 IonicContact OD2-CG 2.73Å; D230-H324 IonicContact OD2-ND1 3.15Å; D230-H324 PolarHBondContact OD2-ND1 2.84Å; D230-H324 IonicContact OD2-NE2 2.74Å; D230-H324 PolarHBondContact OD2-NE2 3.4Å; I321-H324 PolarHBondContact N-NE2 3.27Å; I321-H324 PolarHBondContact O-CD2 2.93Å; I321-H324 PolarHBondContact O-CE1 2.88Å; I321-H324 PolarHBondContact O-ND1 3.45Å; I321-H324 PolarHBondContact O-NE2 3.28Å
325	H	58.3	Low	80.5	Confident	39 Å²	39	58.6 Å²	58.6	18%	0.181	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	27.6	167.9	-42.4	-66.5	0	0	0	117.1	W290 H323 G327 E328	W290-H325 AromaticContact CD1-CE1 3.46Å; W290-H325 VanDerWaalsContact CD1-CE1 3.46Å; W290-H325 AromaticContact CD1-CG 3.84Å; W290-H325 AromaticContact CD1-ND1 3.46Å; W290-H325 AromaticContact CD1-NE2 3.82Å; W290-H325 AromaticContact NE1-CD2 3.61Å; W290-H325 AromaticContact NE1-CE1 3.39Å; W290-H325 PolarHBondContact NE1-CE1 3.02Å; W290-H325 AromaticContact NE1-CG 3.88Å; W290-H325 AromaticContact NE1-ND1 3.75Å; W290-H325 AromaticContact NE1-NE2 3.27Å; W290-H325 PolarHBondContact NE1-NE2 3.34Å; H323-H325 PolarHBondContact O-N 2.81Å; H325-G327 PolarHBondContact O-N 2.83Å; H325-E328 HydrophobicContact CB-CB 4.21Å; H325-E328 IonicContact CE1-OE2 3.75Å; H325-E328 IonicContact CG-OE2 3.37Å; H325-E328 IonicContact ND1-OE1 3.6Å; H325-E328 IonicContact ND1-OE2 3.53Å; H325-E328 PolarHBondContact ND1-OE2 3.37Å; H325-E328 PolarHBondContact O-N 2.88Å
326	R	57.7	Low	80.2	Confident	201 Å²	201	59 Å²	59	76%	0.758	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	105.5	166.6	-78.5	-174.2	174.8	166.2	0.7	109.7	H323	H323-R326 PolarHBondContact CE1-NH2 3.5Å; H323-R326 PolarHBondContact ND1-NH2 2.98Å
327	G	58.6	Low	80	Confident	69 Å²	69	60.1 Å²	60.1	71%	0.711	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	7.3	175.1	0	0	0	0	0	116.8	H325	H325-G327 PolarHBondContact O-N 2.83Å
328	E	67.9	Low	79.8	Confident	47 Å²	47	58.8 Å²	58.8	22%	0.22	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-82.3	120.3	173.3	-71.8	174.6	-151	0	0	111	P34 R167 H325	P34-E328 WeakPolarHBondContact CG-O 3.37Å; R167-E328 IonicContact NH2-OE1 2.87Å; R167-E328 PolarHBondContact NH2-OE1 3.47Å; H325-E328 HydrophobicContact CB-CB 4.21Å; H325-E328 IonicContact CE1-OE2 3.75Å; H325-E328 IonicContact CG-OE2 3.37Å; H325-E328 IonicContact ND1-OE1 3.6Å; H325-E328 IonicContact ND1-OE2 3.53Å; H325-E328 PolarHBondContact ND1-OE2 3.37Å; H325-E328 PolarHBondContact O-N 2.88Å
329	A	71.4	Confident	79.5	Confident	69 Å²	69	68.6 Å²	68.6	57%	0.57	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-68.9	133.9	178.5	0	0	0	0	0	111.3	W290 F331	W290-A329 PolarHBondContact N-O 3.15Å; A329-F331 PolarHBondContact O-N 3.38Å
330	Q	77.6	Confident	79.3	Confident	46 Å²	46	68.8 Å²	68.8	22%	0.215	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-65.5	131.8	172	-176.2	168	37.9	0	0	110.2	P34 N38 W290 L332 R334	P34-Q330 HydrophobicContact CB-CB 3.95Å; P34-Q330 HydrophobicContact CG-CB 4.36Å; N38-Q330 PolarHBondContact ND2-NE2 2.86Å; N38-Q330 PolarHBondContact OD1-NE2 3.32Å; N38-Q330 VanDerWaalsContact OD1-NE2 3.1Å; W290-Q330 HydrophobicContact CE3-CG 4.39Å; Q330-L332 PolarHBondContact O-N 3.4Å; Q330-L332 VanDerWaalsContact O-N 3.12Å; Q330-R334 VanDerWaalsContact NE2-NH2 3.13Å
331	F	81.8	Confident	79.4	Confident	43 Å²	43	68.4 Å²	68.4	19%	0.189	35%	0.352	C	S	.	.			trans	-82.5	93.9	178.7	-177.5	-124.9	0	0	0	111.1	F287 W288 W290 A329 G333 R334 L337	F287-F331 HydrophobicContact CD1-CD1 4.11Å; F287-F331 HydrophobicContact CD1-CE1 4.37Å; W288-F331 VanDerWaalsContact O-CD2 3.25Å; W288-F331 WeakPolarHBondContact O-CD2 3.46Å; W290-F331 PolarHBondContact O-N 2.73Å; W290-F331 VanDerWaalsContact O-N 3.1Å; A329-F331 PolarHBondContact O-N 3.38Å; F331-G333 VanDerWaalsContact CE1-C 3.45Å; F331-G333 PolarHBondContact O-N 2.88Å; F331-R334 HydrophobicContact CD1-CB 3.73Å; F331-R334 HydrophobicContact CE1-CB 4.29Å; F331-R334 VanDerWaalsContact CE1-N 3.32Å; F331-R334 VanDerWaalsContact O-CB 3.28Å; F331-R334 WeakPolarHBondContact O-CB 3.38Å; F331-R334 WeakPolarHBondContact O-CD 3.38Å; F331-R334 WeakPolarHBondContact O-CG 3.49Å; F331-R334 PolarHBondContact O-N 2.93Å; F331-R334 VanDerWaalsContact O-N 3.14Å; F331-L337 HydrophobicContact CE1-CD1 3.48Å; F331-L337 VanDerWaalsContact CE1-CD1 3.48Å; F331-L337 HydrophobicContact CE1-CG 4.04Å; F331-L337 HydrophobicContact CZ-CD1 4.05Å; F331-L337 HydrophobicContact CZ-CG 4.49Å
332	L	78.9	Confident	79.4	Confident	125 Å²	125	74.2 Å²	74.2	65%	0.654	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.2	-178.3	-62.6	179.4	0	0	0	113.5	Q330 R334	Q330-L332 PolarHBondContact O-N 3.4Å; Q330-L332 VanDerWaalsContact O-N 3.12Å; L332-R334 PolarHBondContact O-N 3.03Å
333	G	81.4	Confident	79.9	Confident	30 Å²	30	75.1 Å²	75.1	31%	0.309	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-8	178.1	0	0	0	0	0	114.9	F331 Y335 S336 L337	F331-G333 VanDerWaalsContact CE1-C 3.45Å; F331-G333 PolarHBondContact O-N 2.88Å; G333-Y335 VanDerWaalsContact C-N 3.29Å; G333-Y335 PolarHBondContact O-N 3.26Å; G333-S336 WeakPolarHBondContact O-CB 3.39Å; G333-S336 PolarHBondContact O-N 3.14Å; G333-S336 VanDerWaalsContact O-N 3.13Å; G333-L337 PolarHBondContact O-N 3.04Å
334	R	85.6	Confident	81.1	Confident	23 Å²	23	70 Å²	70	9%	0.087	35%	0.351	C	S	.	.	H	α-helix	trans	-56.1	-38.5	-174	69	-169.7	-176.9	176.3	9.1	113.9	F287 G291 Q330 F331 L332 S336 L337 L338	F287-R334 HydrophobicContact CD1-CB 4.3Å; F287-R334 HydrophobicContact CE1-CB 3.99Å; G291-R334 WeakPolarHBondContact O-CB 3.39Å; G291-R334 WeakPolarHBondContact O-CD 3.42Å; Q330-R334 VanDerWaalsContact NE2-NH2 3.13Å; F331-R334 HydrophobicContact CD1-CB 3.73Å; F331-R334 HydrophobicContact CE1-CB 4.29Å; F331-R334 VanDerWaalsContact CE1-N 3.32Å; F331-R334 VanDerWaalsContact O-CB 3.28Å; F331-R334 WeakPolarHBondContact O-CB 3.38Å; F331-R334 WeakPolarHBondContact O-CD 3.38Å; F331-R334 WeakPolarHBondContact O-CG 3.49Å; F331-R334 PolarHBondContact O-N 2.93Å; F331-R334 VanDerWaalsContact O-N 3.14Å; L332-R334 PolarHBondContact O-N 3.03Å; R334-S336 VanDerWaalsContact C-N 3.32Å; R334-S336 PolarHBondContact O-N 3.22Å; R334-L337 PolarHBondContact O-N 2.94Å; R334-L338 WeakPolarHBondContact O-CB 3.3Å; R334-L338 WeakPolarHBondContact O-CG 3.33Å; R334-L338 PolarHBondContact O-N 3.11Å
335	Y	88	Confident	82.7	Confident	148 Å²	148	69.9 Å²	69.9	58%	0.58	35%	0.351	S	S	*	.	H	α-helix	trans	-66.2	-36.3	-178.2	-59.8	-69.4	0	0	0	112.2	G333 R339	G333-Y335 VanDerWaalsContact C-N 3.29Å; G333-Y335 PolarHBondContact O-N 3.26Å; Y335-R339 WeakPolarHBondContact O-CB 3.34Å; Y335-R339 PolarHBondContact O-N 3.47Å
336	S	89.2	Confident	84.4	Confident	63 Å²	63	76 Å²	76	44%	0.441	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-42.4	174.5	-172.5	0	0	0	0	111	G333 R334 R339 H340	G333-S336 WeakPolarHBondContact O-CB 3.39Å; G333-S336 PolarHBondContact O-N 3.14Å; G333-S336 VanDerWaalsContact O-N 3.13Å; R334-S336 VanDerWaalsContact C-N 3.32Å; R334-S336 PolarHBondContact O-N 3.22Å; S336-R339 PolarHBondContact O-N 3.31Å; S336-H340 PolarHBondContact O-N 2.87Å; S336-H340 PolarHBondContact O-ND1 3.29Å
337	L	91.4	Very high	86.2	Confident	22 Å²	22	69.1 Å²	69.1	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-63.9	-42.2	176.9	-65.3	-166.2	0	0	0	112.7	A286 F287 F331 G333 R334 H340 S341 R344	A286-L337 HydrophobicContact CB-CD1 3.7Å; A286-L337 HydrophobicContact CB-CD2 4.31Å; A286-L337 WeakPolarHBondContact O-CD1 3.15Å; F287-L337 HydrophobicContact CD1-CD1 4.1Å; F287-L337 HydrophobicContact CD2-CD1 3.92Å; F287-L337 HydrophobicContact CE1-CB 4.05Å; F287-L337 HydrophobicContact CE1-CD1 4.09Å; F287-L337 HydrophobicContact CE2-CB 4.11Å; F287-L337 HydrophobicContact CE2-CD1 3.95Å; F287-L337 HydrophobicContact CG-CD1 4.01Å; F287-L337 HydrophobicContact CZ-CB 3.64Å; F287-L337 HydrophobicContact CZ-CD1 4.02Å; F331-L337 HydrophobicContact CE1-CD1 3.48Å; F331-L337 VanDerWaalsContact CE1-CD1 3.48Å; F331-L337 HydrophobicContact CE1-CG 4.04Å; F331-L337 HydrophobicContact CZ-CD1 4.05Å; F331-L337 HydrophobicContact CZ-CG 4.49Å; G333-L337 PolarHBondContact O-N 3.04Å; R334-L337 PolarHBondContact O-N 2.94Å; L337-H340 CarbonylContact O-C 3.59Å; L337-H340 PolarHBondContact O-N 2.93Å; L337-S341 PolarHBondContact O-N 3.25Å; L337-R344 PolarHBondContact O-NE 3.38Å; L337-R344 PolarHBondContact O-NH2 2.71Å
338	L	92.8	Very high	87.9	Confident	33 Å²	33	65.9 Å²	65.9	17%	0.173	32%	0.323	C	S	.	.	H	α-helix	trans	-65.4	-40.8	178.3	-78.6	170.1	0	0	0	112.1	F287 G292 D295 D296 R334 H340 S341	F287-L338 HydrophobicContact CE1-CG 4.42Å; F287-L338 HydrophobicContact CZ-CD2 4.34Å; F287-L338 HydrophobicContact CZ-CG 4.25Å; G292-L338 WeakPolarHBondContact O-CD2 3.25Å; D295-L338 HydrophobicContact CB-CD1 4.28Å; D295-L338 HydrophobicContact CB-CD2 3.66Å; D296-L338 HydrophobicContact CB-CD2 3.97Å; R334-L338 WeakPolarHBondContact O-CB 3.3Å; R334-L338 WeakPolarHBondContact O-CG 3.33Å; R334-L338 PolarHBondContact O-N 3.11Å; L338-H340 PolarHBondContact O-N 3.12Å; L338-S341 VanDerWaalsContact O-CB 3.24Å; L338-S341 WeakPolarHBondContact O-CB 3.43Å; L338-S341 PolarHBondContact O-N 3.39Å; L338-S341 VanDerWaalsContact O-N 3.13Å
339	R	92.8	Very high	89.3	Confident	205 Å²	205	63.6 Å²	63.6	77%	0.774	31%	0.313	S	S	*	.	H	α-helix	trans	-58.1	-34.4	177.2	-175.2	177	179.9	179.7	-0.4	112.5	Y335 S336	Y335-R339 WeakPolarHBondContact O-CB 3.34Å; Y335-R339 PolarHBondContact O-N 3.47Å; S336-R339 PolarHBondContact O-N 3.31Å
340	H	92.3	Very high	90.6	Very high	56 Å²	56	61 Å²	61	26%	0.259	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	23.4	-179.3	-54	98.3	0	0	0	112.6	S336 L337 L338 K342 E343 R344 Y382	S336-H340 PolarHBondContact O-N 2.87Å; S336-H340 PolarHBondContact O-ND1 3.29Å; L337-H340 CarbonylContact O-C 3.59Å; L337-H340 PolarHBondContact O-N 2.93Å; L338-H340 PolarHBondContact O-N 3.12Å; H340-K342 VanDerWaalsContact C-N 3.28Å; H340-K342 PolarHBondContact O-N 2.98Å; H340-E343 VanDerWaalsContact C-OE2 3.28Å; H340-E343 VanDerWaalsContact CA-OE2 3.26Å; H340-E343 WeakPolarHBondContact CA-OE2 3.07Å; H340-E343 PolarHBondContact O-N 3.25Å; H340-R344 HydrophobicContact CB-CG 4.21Å; H340-R344 VanDerWaalsContact O-CB 3.29Å; H340-R344 WeakPolarHBondContact O-CB 3.21Å; H340-R344 WeakPolarHBondContact O-CG 3.29Å; H340-R344 PolarHBondContact O-N 2.87Å; H340-Y382 HydrophobicContact CB-CD2 3.97Å; H340-Y382 HydrophobicContact CB-CE2 3.42Å; H340-Y382 VanDerWaalsContact CB-CE2 3.42Å; H340-Y382 AromaticContact CD2-CE2 3.59Å; H340-Y382 AromaticContact CG-CE2 3.26Å; H340-Y382 AromaticContact CG-CZ 3.94Å; H340-Y382 AromaticContact ND1-CE2 3.64Å
341	S	94.4	Very high	91.5	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.014	30%	0.303	C	S	.	.	H	α-helix	trans	-55.7	-42.6	-175.7	-176	0	0	0	0	112.3	D296 L337 L338 R344 Q345	D296-S341 VanDerWaalsContact CG-OG 3.23Å; D296-S341 WeakPolarHBondContact OD1-CB 3.21Å; D296-S341 PolarHBondContact OD1-OG 3.01Å; L337-S341 PolarHBondContact O-N 3.25Å; L338-S341 VanDerWaalsContact O-CB 3.24Å; L338-S341 WeakPolarHBondContact O-CB 3.43Å; L338-S341 PolarHBondContact O-N 3.39Å; L338-S341 VanDerWaalsContact O-N 3.13Å; S341-R344 PolarHBondContact O-N 2.97Å; S341-Q345 WeakPolarHBondContact O-CB 3.34Å; S341-Q345 PolarHBondContact O-N 2.94Å
342	K	94.3	Very high	92.1	Very high	130 Å²	130	62.6 Å²	62.6	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-68	-42.4	-175.9	-169.7	174.4	-176.2	175.9	0	112.6	F303 H340	F303-K342 HydrophobicContact CD2-CB 4.12Å; F303-K342 HydrophobicContact CD2-CG 4.15Å; F303-K342 HydrophobicContact CE1-CB 4.43Å; F303-K342 HydrophobicContact CE1-CD 4.42Å; F303-K342 HydrophobicContact CE2-CB 3.62Å; F303-K342 HydrophobicContact CE2-CG 4.13Å; F303-K342 HydrophobicContact CG-CG 4.39Å; F303-K342 HydrophobicContact CZ-CB 3.8Å; F303-K342 HydrophobicContact CZ-CG 4.33Å; H340-K342 VanDerWaalsContact C-N 3.28Å; H340-K342 PolarHBondContact O-N 2.98Å
343	E	93.5	Very high	92.9	Very high	93 Å²	93	57.8 Å²	57.8	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-68	-47.9	177	-62.3	73.3	-158.9	0	0	109.9	H340 Q345	H340-E343 VanDerWaalsContact C-OE2 3.28Å; H340-E343 VanDerWaalsContact CA-OE2 3.26Å; H340-E343 WeakPolarHBondContact CA-OE2 3.07Å; H340-E343 PolarHBondContact O-N 3.25Å; E343-Q345 PolarHBondContact O-N 2.87Å
344	R	93.9	Very high	93.5	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-32.5	-177.7	-68.7	-175.1	-30	98.6	8.3	113.3	A286 D296 L337 H340 S341 K346 V347 D348 Y382	A286-R344 VanDerWaalsContact CB-NH1 3.29Å; D296-R344 IonicContact OD1-NH2 3.57Å; D296-R344 PolarHBondContact OD1-NH2 3.28Å; D296-R344 VanDerWaalsContact OD1-NH2 3.15Å; D296-R344 IonicContact OD2-NH2 2.78Å; L337-R344 PolarHBondContact O-NE 3.38Å; L337-R344 PolarHBondContact O-NH2 2.71Å; H340-R344 HydrophobicContact CB-CG 4.21Å; H340-R344 VanDerWaalsContact O-CB 3.29Å; H340-R344 WeakPolarHBondContact O-CB 3.21Å; H340-R344 WeakPolarHBondContact O-CG 3.29Å; H340-R344 PolarHBondContact O-N 2.87Å; S341-R344 PolarHBondContact O-N 2.97Å; R344-K346 PolarHBondContact O-N 2.78Å; R344-V347 WeakPolarHBondContact O-CG2 3.31Å; R344-V347 PolarHBondContact O-N 3.28Å; R344-D348 HydrophobicContact CB-CB 4.39Å; R344-D348 IonicContact CZ-OD2 3.35Å; R344-D348 IonicContact NH1-OD2 3.76Å; R344-D348 PolarHBondContact NH1-OD2 3.1Å; R344-D348 IonicContact NH2-OD2 3Å; R344-D348 WeakPolarHBondContact O-CB 3.46Å; R344-D348 PolarHBondContact O-N 2.97Å; R344-Y382 VanDerWaalsContact CD-CE1 3.46Å; R344-Y382 HydrophobicContact CG-CD1 3.6Å; R344-Y382 HydrophobicContact CG-CD2 4.48Å; R344-Y382 HydrophobicContact CG-CE1 3.7Å; R344-Y382 HydrophobicContact CG-CG 4Å
345	Q	95.4	Very high	94	Very high	24 Å²	24	61.6 Å²	61.6	11%	0.112	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-32.7	-177.7	-177	178	13.5	0	0	113.4	I280 N281 R300 S341 E343	I280-Q345 WeakPolarHBondContact O-CG 3.14Å; I280-Q345 PolarHBondContact O-NE2 3.46Å; N281-Q345 PolarHBondContact ND2-O 3.43Å; R300-Q345 HydrophobicContact CG-CB 4.3Å; R300-Q345 HydrophobicContact CG-CG 3.85Å; S341-Q345 WeakPolarHBondContact O-CB 3.34Å; S341-Q345 PolarHBondContact O-N 2.94Å; E343-Q345 PolarHBondContact O-N 2.87Å
346	K	93.9	Very high	94.4	Very high	167 Å²	167	59.5 Å²	59.5	73%	0.726	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-25.5	-179.8	-62.4	178.7	-175.4	173.9	0	113.8	R344 N351	R344-K346 PolarHBondContact O-N 2.78Å; K346-N351 PolarHBondContact O-ND2 2.88Å
347	V	94.3	Very high	94.8	Very high	57 Å²	57	58.9 Å²	58.9	35%	0.345	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-14	-171.5	-61.8	0	0	0	0	113.5	R344 N352	R344-V347 WeakPolarHBondContact O-CG2 3.31Å; R344-V347 PolarHBondContact O-N 3.28Å; V347-N352 WeakPolarHBondContact O-CB 3.49Å; V347-N352 PolarHBondContact O-ND2 2.86Å
348	D	95.8	Very high	95.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	-121.7	106.8	-179.2	179	30.1	0	0	0	110.7	P284 N285 A286 R300 R344 V379	P284-D348 WeakPolarHBondContact CA-OD2 3.35Å; P284-D348 WeakPolarHBondContact CB-OD2 3.48Å; N285-D348 WeakPolarHBondContact CA-OD1 3.35Å; N285-D348 VanDerWaalsContact CB-OD1 3.31Å; N285-D348 WeakPolarHBondContact CB-OD1 3.31Å; N285-D348 PolarHBondContact N-OD1 3.49Å; N285-D348 PolarHBondContact N-OD2 3.42Å; A286-D348 WeakPolarHBondContact CB-OD2 3.3Å; A286-D348 PolarHBondContact N-OD2 2.93Å; R300-D348 VanDerWaalsContact CZ-O 3.28Å; R300-D348 PolarHBondContact NH1-O 3.36Å; R300-D348 PolarHBondContact NH2-O 3.49Å; R300-D348 IonicContact NH2-OD2 3.86Å; R344-D348 HydrophobicContact CB-CB 4.39Å; R344-D348 IonicContact CZ-OD2 3.35Å; R344-D348 IonicContact NH1-OD2 3.76Å; R344-D348 PolarHBondContact NH1-OD2 3.1Å; R344-D348 IonicContact NH2-OD2 3Å; R344-D348 WeakPolarHBondContact O-CB 3.46Å; R344-D348 PolarHBondContact O-N 2.97Å; D348-V379 HydrophobicContact CB-CG2 4.39Å
349	G	97.3	Very high	95.4	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	162.5	-132.6	175.7	0	0	0	0	0	114.1	N281 F283 N285 N351 N352 L353	N281-G349 CarbonylContact O-C 3.57Å; N281-G349 VanDerWaalsContact O-CA 3.23Å; N281-G349 WeakPolarHBondContact O-CA 3.37Å; F283-G349 VanDerWaalsContact O-CA 3.24Å; F283-G349 WeakPolarHBondContact O-CA 3.23Å; N285-G349 PolarHBondContact ND2-O 3.25Å; G349-N351 PolarHBondContact O-N 3.47Å; G349-N352 PolarHBondContact N-OD1 3.33Å; G349-N352 PolarHBondContact O-OD1 2.84Å; G349-L353 PolarHBondContact O-N 3.15Å
350	L	97.8	Very high	95.6	Very high	14 Å²	14	59 Å²	59	7%	0.073	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.8	-177.5	-68.6	174	0	0	0	114.5	N209 F212 K213 F277 N281	N209-L350 HydrophobicContact CB-CD2 3.89Å; F212-L350 HydrophobicContact CD1-CD1 3.96Å; F212-L350 HydrophobicContact CD1-CD2 3.56Å; F212-L350 HydrophobicContact CD1-CG 4.42Å; F212-L350 HydrophobicContact CE1-CD1 3.66Å; F212-L350 HydrophobicContact CE1-CD2 4.04Å; F212-L350 HydrophobicContact CE1-CG 4.5Å; K213-L350 WeakPolarHBondContact CE-O 3.29Å; K213-L350 HydrophobicContact CG-CD2 4.37Å; K213-L350 PolarHBondContact NZ-O 2.87Å; F277-L350 HydrophobicContact CD1-CD1 3.99Å; F277-L350 HydrophobicContact CE1-CD1 3.96Å; F277-L350 HydrophobicContact CE1-CD2 3.97Å; F277-L350 HydrophobicContact CE1-CG 4.32Å; N281-L350 PolarHBondContact O-N 2.79Å; N281-L350 PolarHBondContact OD1-N 2.85Å
351	N	96.1	Very high	95.8	Very high	97 Å²	97	63.1 Å²	63.1	52%	0.519	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-28.4	-175.9	63.7	-17.8	0	0	0	114.2	N281 K346 G349	N281-N351 PolarHBondContact ND2-OD1 3.45Å; N281-N351 PolarHBondContact OD1-N 2.95Å; N281-N351 VanDerWaalsContact OD1-N 3.15Å; N281-N351 PolarHBondContact OD1-OD1 2.87Å; K346-N351 PolarHBondContact O-ND2 2.88Å; G349-N351 PolarHBondContact O-N 3.47Å
352	N	94.9	Very high	95.8	Very high	26 Å²	26	64.6 Å²	64.6	14%	0.139	33%	0.334	C	S	.	.	S	Bend	trans	-105.8	7	179	76.5	-31.5	0	0	0	113.4	N285 V347 G349 N354 P378	N285-N352 PolarHBondContact ND2-OD1 2.81Å; V347-N352 WeakPolarHBondContact O-CB 3.49Å; V347-N352 PolarHBondContact O-ND2 2.86Å; G349-N352 PolarHBondContact N-OD1 3.33Å; G349-N352 PolarHBondContact O-OD1 2.84Å; N352-N354 PolarHBondContact O-N 3.49Å; N352-P378 PolarHBondContact ND2-O 2.9Å
353	L	95.3	Very high	95.7	Very high	23 Å²	23	63.7 Å²	63.7	12%	0.12	33%	0.327	C	S	.	.			trans	-75.3	119	-179.3	-177	74.7	0	0	0	111.7	M206 N209 V210 K213 G349 Y355	M206-L353 HydrophobicContact CE-CD1 3.53Å; M206-L353 HydrophobicContact CG-CD1 3.56Å; M206-L353 HydrophobicContact SD-CD1 4.4Å; N209-L353 HydrophobicContact CB-CD1 4.47Å; N209-L353 HydrophobicContact CB-CD2 3.85Å; V210-L353 HydrophobicContact CG2-CD1 4.25Å; V210-L353 HydrophobicContact CG2-CD2 4.16Å; K213-L353 HydrophobicContact CG-CD2 4.11Å; G349-L353 PolarHBondContact O-N 3.15Å; L353-Y355 HydrophobicContact CD1-CD1 4.41Å; L353-Y355 HydrophobicContact CD2-CD1 3.81Å; L353-Y355 HydrophobicContact CD2-CE1 3.55Å; L353-Y355 HydrophobicContact CG-CD1 3.75Å; L353-Y355 HydrophobicContact CG-CE1 3.98Å
354	N	95.3	Very high	95.8	Very high	97 Å²	97	59.3 Å²	59.3	52%	0.519	31%	0.306	S	S	.	.			trans	-120.7	137	170.5	-168	3.5	0	0	0	110.4	N352 L376	N352-N354 PolarHBondContact O-N 3.49Å; N354-L376 HydrophobicContact CB-CD2 4.48Å; N354-L376 WeakPolarHBondContact CB-O 3.24Å; N354-L376 PolarHBondContact N-O 3.14Å; N354-L376 WeakPolarHBondContact O-CB 3.4Å
355	Y	96.2	Very high	95.9	Very high	36 Å²	36	60.1 Å²	60.1	14%	0.141	31%	0.31	C	S	.	.			trans	-168.4	163.2	179.8	64.3	-76.7	0	0	0	110.6	V210 K213 E214 L353 P357 V370	V210-Y355 HydrophobicContact CB-CE2 4.47Å; V210-Y355 HydrophobicContact CG1-CD2 3.96Å; V210-Y355 HydrophobicContact CG1-CE2 3.76Å; V210-Y355 HydrophobicContact CG2-CD1 3.95Å; V210-Y355 HydrophobicContact CG2-CD2 4.07Å; V210-Y355 HydrophobicContact CG2-CE1 4.21Å; V210-Y355 HydrophobicContact CG2-CE2 4.33Å; V210-Y355 HydrophobicContact CG2-CG 3.88Å; K213-Y355 HydrophobicContact CB-CE1 4.41Å; K213-Y355 WeakPolarHBondContact CB-OH 3.47Å; E214-Y355 HydrophobicContact CG-CE2 4.29Å; E214-Y355 WeakPolarHBondContact OE1-CE2 3.08Å; E214-Y355 VanDerWaalsContact OE1-CZ 3.27Å; E214-Y355 PolarHBondContact OE1-OH 2.87Å; L353-Y355 HydrophobicContact CD1-CD1 4.41Å; L353-Y355 HydrophobicContact CD2-CD1 3.81Å; L353-Y355 HydrophobicContact CD2-CE1 3.55Å; L353-Y355 HydrophobicContact CG-CD1 3.75Å; L353-Y355 HydrophobicContact CG-CE1 3.98Å; Y355-P357 HydrophobicContact CD2-CB 4.19Å; Y355-P357 HydrophobicContact CD2-CG 4.2Å; Y355-P357 HydrophobicContact CE2-CB 4.06Å; Y355-P357 HydrophobicContact CE2-CG 3.86Å; Y355-V370 HydrophobicContact CD2-CG1 3.77Å
356	S	96.5	Very high	96.1	Very high	105 Å²	105	59.1 Å²	59.1	73%	0.734	31%	0.305	S	S	*	.			trans	-125.1	108	173.9	-60.4	0	0	0	0	109.3
357	P	97.6	Very high	96.3	Very high	50 Å²	50	52.4 Å²	52.4	33%	0.325	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	142.4	-177	33.8	-33.9	0	0	0	112.6	Y355 I359 I368 V370	Y355-P357 HydrophobicContact CD2-CB 4.19Å; Y355-P357 HydrophobicContact CD2-CG 4.2Å; Y355-P357 HydrophobicContact CE2-CB 4.06Å; Y355-P357 HydrophobicContact CE2-CG 3.86Å; P357-I359 HydrophobicContact CB-CG1 4.15Å; P357-I359 HydrophobicContact CG-CD1 4.5Å; P357-I368 HydrophobicContact CB-CG2 3.9Å; P357-V370 HydrophobicContact CB-CG1 3.99Å
358	L	98.2	Very high	96.5	Very high	125 Å²	125	49.7 Å²	49.7	65%	0.654	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	118.6	159.1	178	65.7	0	0	0	108	T369	L358-T369 PolarHBondContact N-O 3.46Å; L358-T369 PolarHBondContact O-N 2.92Å
359	I	98	Very high	96.6	Very high	71 Å²	71	51.5 Å²	51.5	36%	0.364	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.5	-174.2	-55.2	176.1	0	0	0	109.6	E214 P357 T366 N367 I368	E214-I359 WeakPolarHBondContact OE2-CD1 3.23Å; P357-I359 HydrophobicContact CB-CG1 4.15Å; P357-I359 HydrophobicContact CG-CD1 4.5Å; I359-T366 HydrophobicContact CG2-CG2 3.7Å; I359-N367 WeakPolarHBondContact CA-O 3.34Å; I359-I368 HydrophobicContact CG1-CG1 4.42Å
360	S	97.5	Very high	96.6	Very high	66 Å²	66	51.6 Å²	51.6	46%	0.462	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.2	168	69.4	0	0	0	0	110	T366 N367	S360-T366 CarbonylContact O-C 3.57Å; S360-N367 PolarHBondContact N-O 2.87Å; S360-N367 PolarHBondContact O-N 2.97Å; S360-N367 WeakPolarHBondContact OG-CB 3.3Å
361	R	96.6	Very high	96.5	Very high	142 Å²	142	54.9 Å²	54.9	54%	0.536	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	113.9	-177	-66.7	-175	177.6	121.7	-7.5	109.3	D218 T366	D218-R361 IonicContact OD1-NH2 3.16Å; D218-R361 PolarHBondContact OD1-NH2 3.18Å; R361-T366 HydrophobicContact CG-CG2 4.05Å
362	S	93.4	Very high	96.4	Very high	34 Å²	34	50.7 Å²	50.7	24%	0.238	27%	0.274	C	S	.	.			trans	-92.7	-177	170	73.9	0	0	0	0	110	G144 L364 F365	G144-S362 PolarHBondContact N-O 3.04Å; S362-L364 PolarHBondContact OG-N 2.94Å; S362-F365 PolarHBondContact N-O 3.38Å; S362-F365 PolarHBondContact OG-N 3.44Å; S362-F365 PolarHBondContact OG-O 2.93Å
363	R	91.9	Very high	96.3	Very high	111 Å²	111	51 Å²	51	42%	0.419	28%	0.278	S	S	.	.	S	Bend	trans	-69.9	-37.8	173.3	-69.5	-67.6	-173	144.1	1	112.5	E131 L135 G145	E131-R363 HydrophobicContact CG-CB 4.22Å; E131-R363 VanDerWaalsContact OE1-CB 3.28Å; E131-R363 WeakPolarHBondContact OE1-CB 3.47Å; E131-R363 WeakPolarHBondContact OE1-CG 3.29Å; L135-R363 HydrophobicContact CD1-CB 4.3Å; L135-R363 HydrophobicContact CD1-CG 4.21Å; G145-R363 WeakPolarHBondContact CA-O 2.95Å; G145-R363 PolarHBondContact N-O 2.85Å
364	L	95.1	Very high	95.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-91.2	-21.9	-172.3	-63.6	-172.3	0	0	0	114.6	L127 V130 E131 L134 M141 G145 L175 L191 S362	L127-L364 HydrophobicContact CD1-CD1 4.35Å; V130-L364 HydrophobicContact CG1-CD1 3.98Å; E131-L364 HydrophobicContact CB-CD1 3.89Å; E131-L364 HydrophobicContact CB-CG 4.12Å; E131-L364 HydrophobicContact CG-CD1 4.47Å; E131-L364 HydrophobicContact CG-CG 4.15Å; L134-L364 HydrophobicContact CB-CD2 4.31Å; L134-L364 HydrophobicContact CD1-CD1 4.09Å; L134-L364 HydrophobicContact CD1-CD2 3.84Å; M141-L364 HydrophobicContact CE-CD2 4.44Å; G145-L364 WeakPolarHBondContact CA-O 3.49Å; L175-L364 HydrophobicContact CB-CD1 4.45Å; L175-L364 HydrophobicContact CD1-CB 4.2Å; L175-L364 HydrophobicContact CD1-CD1 4.05Å; L191-L364 WeakPolarHBondContact CD1-O 3.42Å; S362-L364 PolarHBondContact OG-N 2.94Å
365	F	97.4	Very high	95.4	Very high	17 Å²	17	60.8 Å²	60.8	8%	0.075	31%	0.311	C	S	.	.			trans	-161.8	166.7	179.9	59.6	-85.9	0	0	0	112.6	L127 G144 L171 L175 L191 V193 S362 N367	L127-F365 HydrophobicContact CD1-CE1 4.16Å; L127-F365 HydrophobicContact CD2-CE1 3.98Å; L127-F365 HydrophobicContact CD2-CZ 4.16Å; G144-F365 VanDerWaalsContact C-C 3.41Å; G144-F365 CarbonylContact O-C 3.52Å; L171-F365 HydrophobicContact CD2-CE1 4.13Å; L171-F365 HydrophobicContact CD2-CE2 4.46Å; L171-F365 HydrophobicContact CD2-CZ 3.93Å; L175-F365 HydrophobicContact CD1-CD1 3.72Å; L175-F365 HydrophobicContact CD1-CE1 3.89Å; L191-F365 HydrophobicContact CB-CB 3.85Å; L191-F365 CarbonylContact O-C 3.45Å; L191-F365 WeakPolarHBondContact O-CA 3.5Å; L191-F365 WeakPolarHBondContact O-CB 3.29Å; V193-F365 HydrophobicContact CB-CD2 3.67Å; V193-F365 HydrophobicContact CB-CE2 3.97Å; V193-F365 HydrophobicContact CB-CG 4.46Å; V193-F365 HydrophobicContact CG2-CB 4.02Å; V193-F365 HydrophobicContact CG2-CD1 4.41Å; V193-F365 HydrophobicContact CG2-CD2 3.38Å; V193-F365 HydrophobicContact CG2-CE2 3.87Å; V193-F365 HydrophobicContact CG2-CG 3.69Å; S362-F365 PolarHBondContact N-O 3.38Å; S362-F365 PolarHBondContact OG-N 3.44Å; S362-F365 PolarHBondContact OG-O 2.93Å; F365-N367 HydrophobicContact CD2-CB 4.29Å; F365-N367 HydrophobicContact CE2-CB 3.92Å
366	T	98.6	Very high	94.7	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.6	165.1	-61.1	0	0	0	0	108.6	G144 L191 Y192 V193 I359 S360 R361 I368	G144-T366 WeakPolarHBondContact CA-OG1 3.41Å; G144-T366 PolarHBondContact O-N 2.96Å; G144-T366 PolarHBondContact O-OG1 3.24Å; G144-T366 VanDerWaalsContact O-OG1 3.14Å; L191-T366 PolarHBondContact O-N 3.26Å; Y192-T366 WeakPolarHBondContact CA-O 3.41Å; Y192-T366 HydrophobicContact CD1-CG2 4.12Å; Y192-T366 HydrophobicContact CE1-CG2 4.3Å; V193-T366 PolarHBondContact N-O 3.43Å; I359-T366 HydrophobicContact CG2-CG2 3.7Å; S360-T366 CarbonylContact O-C 3.57Å; R361-T366 HydrophobicContact CG-CG2 4.05Å; T366-I368 HydrophobicContact CG2-CG1 4.19Å
367	N	98.4	Very high	93.9	Very high	26 Å²	26	56.4 Å²	56.4	14%	0.139	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.6	171.4	-164.8	10.3	0	0	0	109.7	V193 E195 I359 S360 F365	V193-N367 CarbonylContact O-C 3.59Å; V193-N367 WeakPolarHBondContact O-CA 3.48Å; V193-N367 PolarHBondContact O-OD1 3.08Å; E195-N367 PolarHBondContact OE2-ND2 3.14Å; I359-N367 WeakPolarHBondContact CA-O 3.34Å; S360-N367 PolarHBondContact N-O 2.87Å; S360-N367 PolarHBondContact O-N 2.97Å; S360-N367 WeakPolarHBondContact OG-CB 3.3Å; F365-N367 HydrophobicContact CD2-CB 4.29Å; F365-N367 HydrophobicContact CE2-CB 3.92Å
368	I	98.6	Very high	92.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	98.2	176.3	-58.7	163.2	0	0	0	106.7	Y192 V193 I194 E195 V210 E214 P357 I359 T366 V370	Y192-I368 HydrophobicContact CD1-CD1 3.89Å; V193-I368 PolarHBondContact O-N 3.48Å; I194-I368 CarbonylContact C-O 3.5Å; I194-I368 WeakPolarHBondContact CA-O 3.41Å; I194-I368 HydrophobicContact CG1-CD1 4.3Å; I194-I368 HydrophobicContact CG2-CB 4.5Å; I194-I368 HydrophobicContact CG2-CG2 4.49Å; E195-I368 PolarHBondContact N-O 3.45Å; V210-I368 HydrophobicContact CG1-CG2 4.04Å; E214-I368 HydrophobicContact CB-CD1 3.51Å; E214-I368 HydrophobicContact CB-CG1 4.44Å; E214-I368 HydrophobicContact CG-CD1 3.9Å; E214-I368 HydrophobicContact CG-CG1 4.47Å; E214-I368 HydrophobicContact CG-CG2 4.02Å; P357-I368 HydrophobicContact CB-CG2 3.9Å; I359-I368 HydrophobicContact CG1-CG1 4.42Å; T366-I368 HydrophobicContact CG2-CG1 4.19Å; I368-V370 HydrophobicContact CG2-CG1 4.26Å
369	T	98.3	Very high	91.3	Very high	38 Å²	38	54.5 Å²	54.5	23%	0.233	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127.4	177.5	-48.9	0	0	0	0	109.7	E195 L358	E195-T369 HydrophobicContact CB-CG2 4.43Å; E195-T369 HydrophobicContact CG-CG2 4.32Å; E195-T369 CarbonylContact O-C 3.6Å; E195-T369 WeakPolarHBondContact O-CA 3.41Å; E195-T369 PolarHBondContact OE2-OG1 2.76Å; L358-T369 PolarHBondContact N-O 3.46Å; L358-T369 PolarHBondContact O-N 2.92Å
370	V	97.8	Very high	89.5	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.2	179.5	-74.7	0	0	0	0	111.8	I194 E195 G197 L207 V210 Y355 P357 I368 L372	I194-V370 HydrophobicContact CG2-CG2 4.22Å; E195-V370 PolarHBondContact O-N 2.98Å; G197-V370 PolarHBondContact N-O 3.35Å; L207-V370 HydrophobicContact CD2-CG2 3.71Å; V210-V370 HydrophobicContact CG1-CG1 3.89Å; V210-V370 HydrophobicContact CG1-CG2 4.25Å; Y355-V370 HydrophobicContact CD2-CG1 3.77Å; P357-V370 HydrophobicContact CB-CG1 3.99Å; I368-V370 HydrophobicContact CG2-CG1 4.26Å; V370-L372 HydrophobicContact CB-CD2 4.08Å; V370-L372 HydrophobicContact CB-CG 4.42Å; V370-L372 HydrophobicContact CG2-CD1 4.29Å; V370-L372 HydrophobicContact CG2-CD2 3.95Å; V370-L372 HydrophobicContact CG2-CG 3.96Å
371	S	95.2	Very high	87.6	Confident	84 Å²	84	59.1 Å²	59.1	59%	0.587	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	107.7	169.5	-66.4	0	0	0	0	109.3	L376	S371-L376 VanDerWaalsContact O-CD1 3.31Å; S371-L376 WeakPolarHBondContact O-CD1 3.44Å
372	L	93.7	Very high	85.6	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	31%	0.307	C	S	.	.			trans	-99.5	147.3	-177.9	-56.2	-178.4	0	0	0	111.2	Q196 M206 L207 V210 W288 V370	Q196-L372 HydrophobicContact CG-CD1 4.43Å; Q196-L372 HydrophobicContact CG-CG 4.47Å; M206-L372 HydrophobicContact CB-CD1 4.18Å; M206-L372 HydrophobicContact CE-CD2 3.92Å; M206-L372 HydrophobicContact CG-CD1 3.94Å; M206-L372 HydrophobicContact SD-CB 4.23Å; M206-L372 HydrophobicContact SD-CD1 3.91Å; M206-L372 HydrophobicContact SD-CD2 4.2Å; M206-L372 HydrophobicContact SD-CG 4.35Å; L207-L372 HydrophobicContact CD2-CD1 3.6Å; L207-L372 HydrophobicContact CG-CD1 3.98Å; V210-L372 HydrophobicContact CG2-CD2 4.38Å; W288-L372 HydrophobicContact CH2-CB 3.75Å; W288-L372 HydrophobicContact CZ3-CB 4.34Å; V370-L372 HydrophobicContact CB-CD2 4.08Å; V370-L372 HydrophobicContact CB-CG 4.42Å; V370-L372 HydrophobicContact CG2-CD1 4.29Å; V370-L372 HydrophobicContact CG2-CD2 3.95Å; V370-L372 HydrophobicContact CG2-CG 3.96Å
373	S	91.8	Very high	85.2	Confident	32 Å²	32	60.4 Å²	60.4	22%	0.224	31%	0.311	C	S	.	.			trans	-147.8	161.6	169.6	73.6	0	0	0	0	110.5	W288 K375 L376	W288-S373 VanDerWaalsContact CH2-CA 3.45Å; W288-S373 WeakPolarHBondContact CZ2-O 3.2Å; S373-K375 PolarHBondContact O-N 3.19Å; S373-K375 VanDerWaalsContact O-N 3.1Å; S373-L376 WeakPolarHBondContact O-CB 3.44Å; S373-L376 PolarHBondContact O-N 2.92Å
374	R	88	Confident	84.9	Confident	139 Å²	139	57.7 Å²	57.7	53%	0.525	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-56.2	-29.5	178.5	-63.5	-177.1	-177.4	118.5	-0.4	113.5	W288 L376 A377	W288-R374 HydrophobicContact CD2-CG 3.96Å; W288-R374 HydrophobicContact CG-CG 4.1Å; W288-R374 HydrophobicContact CZ2-CG 4.22Å; R374-L376 PolarHBondContact O-N 3.21Å; R374-A377 CarbonylContact O-C 3.6Å; R374-A377 PolarHBondContact O-N 3.15Å
375	K	85.6	Confident	84.3	Confident	187 Å²	187	60.9 Å²	60.9	81%	0.813	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-71.2	-19.3	179.3	-62.8	-178.6	-179	178.7	0	113.2	S373 A377	S373-K375 PolarHBondContact O-N 3.19Å; S373-K375 VanDerWaalsContact O-N 3.1Å; K375-A377 VanDerWaalsContact C-N 3.34Å
376	L	81.2	Confident	83.5	Confident	44 Å²	44	63.5 Å²	63.5	23%	0.23	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-86	-7	-177.5	-70.6	178.6	0	0	0	113.4	M206 N354 S371 S373 R374	M206-L376 HydrophobicContact CE-CB 4.11Å; N354-L376 HydrophobicContact CB-CD2 4.48Å; N354-L376 WeakPolarHBondContact CB-O 3.24Å; N354-L376 PolarHBondContact N-O 3.14Å; N354-L376 WeakPolarHBondContact O-CB 3.4Å; S371-L376 VanDerWaalsContact O-CD1 3.31Å; S371-L376 WeakPolarHBondContact O-CD1 3.44Å; S373-L376 WeakPolarHBondContact O-CB 3.44Å; S373-L376 PolarHBondContact O-N 2.92Å; R374-L376 PolarHBondContact O-N 3.21Å
377	A	78.2	Confident	82.6	Confident	6 Å²	6	67.3 Å²	67.3	5%	0.05	36%	0.357	C	S	.	.	S	Bend	trans	-139	74.4	165.1	0	0	0	0	0	108.5	M206 N285 R374 K375 V379	M206-A377 HydrophobicContact CE-CB 3.86Å; M206-A377 HydrophobicContact SD-CB 4.47Å; N285-A377 HydrophobicContact CB-CB 3.38Å; R374-A377 CarbonylContact O-C 3.6Å; R374-A377 PolarHBondContact O-N 3.15Å; K375-A377 VanDerWaalsContact C-N 3.34Å; A377-V379 PolarHBondContact O-N 2.76Å
378	P	74.4	Confident	81.5	Confident	86 Å²	86	70 Å²	70	56%	0.558	37%	0.371	S	S	*	.			trans	-61.7	124.4	179.2	27.1	-31.7	0	0	0	108.3	N352	N352-P378 PolarHBondContact ND2-O 2.9Å
379	V	67.8	Low	80.3	Confident	49 Å²	49	75 Å²	75	30%	0.297	40%	0.398	S	S	.	.			trans	-91.3	109.9	168.4	-173.2	0	0	0	0	104.7	A286 D348 A377 Y382	A286-V379 HydrophobicContact CB-CG2 3.91Å; D348-V379 HydrophobicContact CB-CG2 4.39Å; A377-V379 PolarHBondContact O-N 2.76Å; V379-Y382 HydrophobicContact CG1-CD1 4.18Å; V379-Y382 HydrophobicContact CG1-CE1 4.42Å
380	A	59.7	Low	78.9	Confident	65 Å²	65	77.8 Å²	77.8	54%	0.537	41%	0.41	S	S	.	.			trans	-60.1	146.9	170	0	0	0	0	0	108.9	Y382	A380-Y382 PolarHBondContact O-N 2.94Å
381	D	57.9	Low	77.3	Confident	169 Å²	169	84.2 Å²	84.2	90%	0.904	44%	0.443	S	S	*	.			trans	-53.6	130.3	171.9	-65.4	-37.7	0	0	0	108.7
382	Y	54.6	Low	75.7	Confident	141 Å²	141	84.2 Å²	84.2	55%	0.553	43%	0.43	S	S	*	.			trans	-107.5	0	-173.2	49.5	-97.9	0	0	0	112.2	H340 R344 V379 A380	H340-Y382 HydrophobicContact CB-CD2 3.97Å; H340-Y382 HydrophobicContact CB-CE2 3.42Å; H340-Y382 VanDerWaalsContact CB-CE2 3.42Å; H340-Y382 AromaticContact CD2-CE2 3.59Å; H340-Y382 AromaticContact CG-CE2 3.26Å; H340-Y382 AromaticContact CG-CZ 3.94Å; H340-Y382 AromaticContact ND1-CE2 3.64Å; R344-Y382 VanDerWaalsContact CD-CE1 3.46Å; R344-Y382 HydrophobicContact CG-CD1 3.6Å; R344-Y382 HydrophobicContact CG-CD2 4.48Å; R344-Y382 HydrophobicContact CG-CE1 3.7Å; R344-Y382 HydrophobicContact CG-CG 4Å; V379-Y382 HydrophobicContact CG1-CD1 4.18Å; V379-Y382 HydrophobicContact CG1-CE1 4.42Å; A380-Y382 PolarHBondContact O-N 2.94Å

Retrieved 382 of 382 residues in 167.9 ms (Link to these results)

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