A0A061I809_CRIGR Loading...

Protein phosphatase 1M

AlphaFold DB , UniProt , Accession A0A061I809, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Ppm1m, Length 461 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	40	Very low	44.2	Very low	164 Å²	164	91 Å²	91	81%	0.808	43%	0.433	S	S	*	.				0	125.8	0	-64.7	175.6	-150.3	0	0	109	W5 I362	M1-W5 HydrophobicContact SD-CE3 4.44Å; M1-W5 HydrophobicContact SD-CZ3 3.95Å; M1-I362 HydrophobicContact CE-CG1 4.12Å
2	S	34.8	Very low	44.4	Very low	87 Å²	87	92 Å²	92	61%	0.608	45%	0.453	S	S	*	.			trans	-73.3	141.9	177.5	168.8	0	0	0	0	110.8	G4 W5 F6	S2-G4 PolarHBondContact O-N 3.3Å; S2-G4 PolarHBondContact OG-N 2.91Å; S2-W5 WeakPolarHBondContact O-CB 3.35Å; S2-W5 PolarHBondContact O-N 2.74Å; S2-F6 PolarHBondContact O-N 3.19Å
3	A	37	Very low	44.5	Very low	61 Å²	61	92 Å²	92	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-53.8	-25.7	173.3	0	0	0	0	0	113	R7	A3-R7 PolarHBondContact O-N 3.31Å
4	G	36.1	Very low	44.8	Very low	25 Å²	25	88.6 Å²	88.6	26%	0.258	49%	0.489	S	S	.	.	H	α-helix	trans	-78.4	-17.9	176.1	0	0	0	0	0	115.2	S2 R8	S2-G4 PolarHBondContact O-N 3.3Å; S2-G4 PolarHBondContact OG-N 2.91Å; G4-R8 PolarHBondContact O-NE 2.93Å
5	W	48.4	Very low	44.8	Very low	99 Å²	99	91.7 Å²	91.7	38%	0.375	51%	0.514	S	S	.	.	H	α-helix	trans	-80.2	-44.2	171.4	-179.8	90.8	0	0	0	110.3	M1 S2 R8 R9 F10	M1-W5 HydrophobicContact SD-CE3 4.44Å; M1-W5 HydrophobicContact SD-CZ3 3.95Å; S2-W5 WeakPolarHBondContact O-CB 3.35Å; S2-W5 PolarHBondContact O-N 2.74Å; W5-R8 PolarHBondContact O-N 3.35Å; W5-R9 VanDerWaalsContact CZ2-NH1 3.31Å; W5-R9 PolarHBondContact O-N 2.72Å; W5-F10 HydrophobicContact CH2-CE2 4.3Å; W5-F10 HydrophobicContact CZ3-CE2 4.01Å
6	F	44.2	Very low	45	Very low	21 Å²	21	95.3 Å²	95.3	9%	0.092	53%	0.531	C	S	.	.	H	α-helix	trans	-62.3	-47.3	178.9	-167.1	-88.6	0	0	0	112.3	S2 R8 R9 F10 L11 L267 Y271 L274 P357	S2-F6 PolarHBondContact O-N 3.19Å; F6-R8 PolarHBondContact O-N 3.39Å; F6-R9 PolarHBondContact O-N 2.8Å; F6-F10 AromaticContact CD2-CD2 3.87Å; F6-F10 HydrophobicContact CD2-CD2 3.87Å; F6-F10 HydrophobicContact CD2-CE2 4.4Å; F6-F10 HydrophobicContact CE1-CB 4.3Å; F6-F10 AromaticContact CE2-CD2 3.91Å; F6-F10 HydrophobicContact CE2-CD2 3.91Å; F6-F10 HydrophobicContact CE2-CE2 4.47Å; F6-F10 HydrophobicContact CG-CD2 4.29Å; F6-F10 HydrophobicContact CZ-CB 4.34Å; F6-F10 HydrophobicContact CZ-CD2 4.34Å; F6-F10 PolarHBondContact O-N 3.17Å; F6-L11 HydrophobicContact CD1-CD1 4.45Å; F6-L267 HydrophobicContact CE1-CD1 4.12Å; F6-L267 HydrophobicContact CE2-CD1 3.81Å; F6-L267 HydrophobicContact CZ-CD1 3.52Å; F6-L267 HydrophobicContact CZ-CD2 4.09Å; F6-L267 HydrophobicContact CZ-CG 4.25Å; F6-Y271 AromaticContact CD1-CD2 3.96Å; F6-Y271 HydrophobicContact CD1-CD2 3.96Å; F6-Y271 HydrophobicContact CD1-CE1 4.12Å; F6-Y271 AromaticContact CD1-CE2 3.52Å; F6-Y271 HydrophobicContact CD1-CE2 3.52Å; F6-Y271 HydrophobicContact CD1-CG 4.42Å; F6-Y271 AromaticContact CD1-CZ 3.6Å; F6-Y271 AromaticContact CE1-CD2 3.62Å; F6-Y271 HydrophobicContact CE1-CD2 3.62Å; F6-Y271 AromaticContact CE1-CE2 3.67Å; F6-Y271 HydrophobicContact CE1-CE2 3.67Å; F6-Y271 HydrophobicContact CE1-CG 4.05Å; F6-Y271 HydrophobicContact CG-CE2 4.17Å; F6-Y271 HydrophobicContact CZ-CD2 4.32Å; F6-Y271 HydrophobicContact CZ-CE2 4.42Å; F6-L274 HydrophobicContact CE1-CD1 4.12Å; F6-L274 HydrophobicContact CZ-CD1 4.05Å; F6-P357 HydrophobicContact CZ-CB 4.02Å
7	R	47.1	Very low	44.9	Very low	165 Å²	165	96.4 Å²	96.4	62%	0.623	54%	0.544	S	S	*	.	H	α-helix	trans	-57.6	-43.7	176	-90.4	-175.3	-165.7	-135.3	2.3	113.1	A3 R9 L11	A3-R7 PolarHBondContact O-N 3.31Å; R7-R9 VanDerWaalsContact C-N 3.26Å; R7-R9 PolarHBondContact O-N 2.92Å; R7-L11 HydrophobicContact CG-CD1 3.78Å; R7-L11 PolarHBondContact O-N 2.74Å; R7-L11 VanDerWaalsContact O-O 3.06Å
8	R	51.5	Low	44.8	Very low	220 Å²	220	100.9 Å²	100.9	83%	0.83	56%	0.56	S	S	*	*	H	α-helix	trans	-67.7	-26.7	-177.5	-88.4	-175.8	-93.2	-139.5	-0.1	113.5	G4 W5 F6	G4-R8 PolarHBondContact O-NE 2.93Å; W5-R8 PolarHBondContact O-N 3.35Å; F6-R8 PolarHBondContact O-N 3.39Å
9	R	49.7	Very low	44.9	Very low	93 Å²	93	102.1 Å²	102.1	35%	0.351	57%	0.572	S	S	.	*	H	α-helix	trans	-99.6	-33	-172.5	-166.3	169.9	-177.3	173.4	3.6	113.5	W5 F6 R7 D203	W5-R9 VanDerWaalsContact CZ2-NH1 3.31Å; W5-R9 PolarHBondContact O-N 2.72Å; F6-R9 PolarHBondContact O-N 2.8Å; R7-R9 VanDerWaalsContact C-N 3.26Å; R7-R9 PolarHBondContact O-N 2.92Å; R9-D203 IonicContact CZ-OD1 3.39Å; R9-D203 IonicContact NH1-OD1 2.83Å; R9-D203 IonicContact NH2-OD1 2.77Å; R9-D203 PolarHBondContact NH2-OD1 3.11Å; R9-D203 IonicContact NH2-OD2 3.14Å
10	F	47.9	Very low	45.2	Very low	34 Å²	34	108.8 Å²	108.8	15%	0.149	59%	0.588	C	S	.	*	H	α-helix	trans	-124.9	-10.9	-167.6	-61.7	-67.4	0	0	0	115.4	W5 F6 K356 P357	W5-F10 HydrophobicContact CH2-CE2 4.3Å; W5-F10 HydrophobicContact CZ3-CE2 4.01Å; F6-F10 AromaticContact CD2-CD2 3.87Å; F6-F10 HydrophobicContact CD2-CD2 3.87Å; F6-F10 HydrophobicContact CD2-CE2 4.4Å; F6-F10 HydrophobicContact CE1-CB 4.3Å; F6-F10 AromaticContact CE2-CD2 3.91Å; F6-F10 HydrophobicContact CE2-CD2 3.91Å; F6-F10 HydrophobicContact CE2-CE2 4.47Å; F6-F10 HydrophobicContact CG-CD2 4.29Å; F6-F10 HydrophobicContact CZ-CB 4.34Å; F6-F10 HydrophobicContact CZ-CD2 4.34Å; F6-F10 PolarHBondContact O-N 3.17Å; F10-K356 HydrophobicContact CE1-CB 4.19Å; F10-K356 HydrophobicContact CE1-CG 3.98Å; F10-K356 HydrophobicContact CZ-CG 4.48Å; F10-P357 HydrophobicContact CB-CG 4.16Å; F10-P357 HydrophobicContact CD1-CG 4.06Å; F10-P357 HydrophobicContact CG-CG 4.3Å
11	L	49.4	Very low	45.3	Very low	32 Å²	32	109.6 Å²	109.6	17%	0.168	60%	0.599	C	S	.	*	S	Bend	trans	-114.2	113	178.8	-67.5	170.5	0	0	0	109.3	F6 R7 G13 Y271 E273 L274	F6-L11 HydrophobicContact CD1-CD1 4.45Å; R7-L11 HydrophobicContact CG-CD1 3.78Å; R7-L11 PolarHBondContact O-N 2.74Å; R7-L11 VanDerWaalsContact O-O 3.06Å; L11-G13 PolarHBondContact O-N 3.06Å; L11-G13 VanDerWaalsContact O-N 3.09Å; L11-Y271 HydrophobicContact CD1-CD1 3.59Å; L11-Y271 HydrophobicContact CD1-CE1 3.9Å; L11-Y271 HydrophobicContact CD1-CG 4.36Å; L11-E273 WeakPolarHBondContact CD1-OE1 3.33Å; L11-E273 HydrophobicContact CD2-CG 3.46Å; L11-E273 VanDerWaalsContact CD2-CG 3.46Å; L11-E273 VanDerWaalsContact CD2-OE1 3.23Å; L11-E273 WeakPolarHBondContact CD2-OE1 3.41Å; L11-L274 HydrophobicContact CD2-CD2 3.64Å; L11-L274 HydrophobicContact CD2-CG 4.25Å
12	P	46.2	Very low	46.1	Very low	103 Å²	103	106.1 Å²	106.1	67%	0.669	60%	0.597	S	S	*	*			trans	-67.8	112.7	-179.4	25.2	-29.8	0	0	0	109.6	G14	P12-G14 PolarHBondContact O-N 3.48Å
13	G	45.6	Very low	47.4	Very low	92 Å²	92	104.3 Å²	104.3	95%	0.948	59%	0.592	S	S	*	*			trans	-82	9.5	176.7	0	0	0	0	0	114.7	L11	L11-G13 PolarHBondContact O-N 3.06Å; L11-G13 VanDerWaalsContact O-N 3.09Å
14	G	49.5	Very low	48.8	Very low	45 Å²	45	108 Å²	108	46%	0.464	61%	0.61	S	S	.	*	S	Bend	trans	-171.2	174.8	-177.2	0	0	0	0	0	111.9	P12 L16	P12-G14 PolarHBondContact O-N 3.48Å; G14-L16 PolarHBondContact O-N 3.41Å
15	P	44	Very low	50.7	Low	134 Å²	134	115.7 Å²	115.7	87%	0.87	63%	0.631	S	S	*	*	S	Bend	trans	-53.7	136.5	173.4	23	-32	0	0	0	109.8
16	L	48	Very low	52.4	Low	149 Å²	149	113.2 Å²	113.2	78%	0.78	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-52	131.4	178.8	-74	163.5	0	0	0	108.9	G14 E18	G14-L16 PolarHBondContact O-N 3.41Å; L16-E18 PolarHBondContact O-N 2.79Å
17	P	44.3	Very low	54.5	Low	115 Å²	115	117.4 Å²	117.4	75%	0.747	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-56.4	138.4	173.8	22.1	-29.9	0	0	0	109
18	E	43.1	Very low	56.6	Low	178 Å²	178	113.6 Å²	113.6	83%	0.832	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-51.1	139.3	173.3	-72	-168	162.9	0	0	109.5	L16 R20	L16-E18 PolarHBondContact O-N 2.79Å; E18-R20 PolarHBondContact O-N 3.39Å
19	P	46.9	Very low	58.5	Low	123 Å²	123	104.4 Å²	104.4	80%	0.799	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-54.8	118.4	179.5	21.2	-31	0	0	0	108.5
20	R	50.2	Low	60.6	Low	236 Å²	236	104.5 Å²	104.5	89%	0.891	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-52.2	136	172.5	-80.7	-178.2	170.8	-179.6	-2.7	107.8	E18 A22	E18-R20 PolarHBondContact O-N 3.39Å; R20-A22 PolarHBondContact O-N 3.05Å; R20-A22 VanDerWaalsContact O-N 3.15Å
21	P	48.4	Very low	62.7	Low	125 Å²	125	105.4 Å²	105.4	81%	0.812	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-53.3	128.1	174.9	21.6	-31	0	0	0	108.1	G23	P21-G23 PolarHBondContact O-N 3.1Å
22	A	56.5	Low	64.6	Low	92 Å²	92	105.6 Å²	105.6	76%	0.76	64%	0.642	S	S	*	*			trans	-58.4	109.5	-177.5	0	0	0	0	0	108.3	R20	R20-A22 PolarHBondContact O-N 3.05Å; R20-A22 VanDerWaalsContact O-N 3.15Å
23	G	60.9	Low	66.7	Low	49 Å²	49	102 Å²	102	51%	0.505	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-57.1	163.6	162	0	0	0	0	0	109.5	P21 R25	P21-G23 PolarHBondContact O-N 3.1Å; G23-R25 PolarHBondContact O-N 3.07Å
24	P	67	Low	69	Low	137 Å²	137	97.7 Å²	97.7	89%	0.89	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-53.1	121.5	174.8	22	-31	0	0	0	109.2
25	R	75.3	Confident	70.9	Confident	187 Å²	187	102.3 Å²	102.3	71%	0.706	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-59.6	140.5	178.2	-70.3	-175.6	177.4	-172.8	-2.3	109.3	G23 A211	G23-R25 PolarHBondContact O-N 3.07Å; R25-A211 WeakPolarHBondContact CA-O 3.3Å
26	S	84.6	Confident	73.1	Confident	48 Å²	48	96.6 Å²	96.6	34%	0.336	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-66	160.4	169.8	61.8	0	0	0	0	109.9	A211 S212	S26-A211 PolarHBondContact N-O 3.41Å; S26-A211 PolarHBondContact OG-O 3.15Å; S26-S212 WeakPolarHBondContact OG-CA 3.43Å; S26-S212 PolarHBondContact OG-N 3.44Å; S26-S212 VanDerWaalsContact OG-N 3.16Å
27	S	88.4	Confident	75	Confident	108 Å²	108	90 Å²	90	76%	0.755	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-62.1	140.7	174.6	-57.6	0	0	0	0	110.4
28	P	91.1	Very high	76.7	Confident	86 Å²	86	89.6 Å²	89.6	56%	0.558	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-55.5	144.7	173.8	-25	34.2	0	0	0	111.8	P30	P28-P30 VanDerWaalsContact O-CD 3.25Å; P28-P30 WeakPolarHBondContact O-CD 3.13Å; P28-P30 VanDerWaalsContact O-N 3.15Å
29	V	92.3	Very high	77.6	Confident	27 Å²	27	84.7 Å²	84.7	16%	0.164	48%	0.481	C	S	.	.			trans	-59.6	113.3	170.6	-178.8	0	0	0	0	108.1	A133 I136 L137	V29-A133 HydrophobicContact CB-CB 4.18Å; V29-I136 HydrophobicContact CG1-CB 4.19Å; V29-I136 HydrophobicContact CG1-CG2 3.51Å; V29-L137 HydrophobicContact CG1-CG 4.45Å; V29-L137 HydrophobicContact CG2-CD1 4.08Å; V29-L137 HydrophobicContact CG2-CD2 4.01Å; V29-L137 HydrophobicContact CG2-CG 4.07Å
30	P	92.1	Very high	78	Confident	95 Å²	95	81.5 Å²	81.5	62%	0.617	46%	0.462	S	S	*	.			trans	-72.2	139.4	-177.9	29.4	-33.7	0	0	0	110.1	P28 H32	P28-P30 VanDerWaalsContact O-CD 3.25Å; P28-P30 WeakPolarHBondContact O-CD 3.13Å; P28-P30 VanDerWaalsContact O-N 3.15Å; P30-H32 PolarHBondContact O-N 2.76Å
31	Y	92.3	Very high	77.9	Confident	52 Å²	52	74.2 Å²	74.2	20%	0.204	46%	0.46	C	S	.	.			trans	-62.1	137.1	173.9	175.3	-106	0	0	0	111.2	F84 N85 P132 I136	Y31-F84 AromaticContact CD1-CD1 3.43Å; Y31-F84 HydrophobicContact CD1-CD1 3.43Å; Y31-F84 VanDerWaalsContact CD1-CD1 3.43Å; Y31-F84 AromaticContact CD1-CE1 3.89Å; Y31-F84 HydrophobicContact CD1-CE1 3.89Å; Y31-F84 HydrophobicContact CD1-CG 4.22Å; Y31-F84 HydrophobicContact CD2-CB 3.94Å; Y31-F84 HydrophobicContact CD2-CD1 4.15Å; Y31-F84 HydrophobicContact CD2-CG 4.11Å; Y31-F84 HydrophobicContact CE1-CB 4.36Å; Y31-F84 AromaticContact CE1-CD1 3.57Å; Y31-F84 HydrophobicContact CE1-CD1 3.57Å; Y31-F84 HydrophobicContact CE1-CE1 4.35Å; Y31-F84 HydrophobicContact CE1-CG 4.34Å; Y31-F84 HydrophobicContact CE2-CB 3.69Å; Y31-F84 HydrophobicContact CE2-CD1 4.29Å; Y31-F84 HydrophobicContact CE2-CG 4.27Å; Y31-F84 HydrophobicContact CG-CB 4.37Å; Y31-F84 AromaticContact CG-CD1 3.71Å; Y31-F84 HydrophobicContact CG-CD1 3.71Å; Y31-F84 HydrophobicContact CG-CE1 4.24Å; Y31-F84 HydrophobicContact CG-CG 4.07Å; Y31-F84 AromaticContact CZ-CD1 3.99Å; Y31-N85 WeakPolarHBondContact CE2-O 3.48Å; Y31-N85 PolarHBondContact OH-N 3.5Å; Y31-P132 HydrophobicContact CD2-CB 3.93Å; Y31-P132 HydrophobicContact CD2-CG 3.76Å; Y31-P132 HydrophobicContact CE2-CB 4.25Å; Y31-P132 HydrophobicContact CE2-CG 4.45Å; Y31-I136 HydrophobicContact CD2-CD1 4.06Å
32	H	89.3	Confident	77.7	Confident	36 Å²	36	70.4 Å²	70.4	17%	0.167	44%	0.436	C	S	.	.			trans	-156.5	155.5	168.9	60.6	49.6	0	0	0	110.6	P30 R38 Q88 I136 N140	P30-H32 PolarHBondContact O-N 2.76Å; H32-R38 PolarHBondContact CD2-NH2 3.14Å; H32-R38 PolarHBondContact CE1-NH2 3.33Å; H32-R38 PolarHBondContact ND1-NH2 3.32Å; H32-R38 PolarHBondContact NE2-NH2 3.21Å; H32-Q88 PolarHBondContact O-NE2 2.87Å; H32-Q88 PolarHBondContact O-OE1 3.05Å; H32-I136 WeakPolarHBondContact CE1-CG2 3.29Å; H32-N140 PolarHBondContact NE2-ND2 3.35Å
33	R	91.2	Very high	77	Confident	29 Å²	29	69.2 Å²	69.2	11%	0.109	42%	0.423	C	S	.	.			trans	-77.5	167	169.3	-73.6	-172.4	-170.6	-90.7	4.6	112.3	L37 R38 D48 R59 E75	R33-L37 HydrophobicContact CB-CB 4.42Å; R33-R38 PolarHBondContact O-NE 3.38Å; R33-R38 VanDerWaalsContact O-NE 3.13Å; R33-R38 PolarHBondContact O-NH2 2.64Å; R33-D48 IonicContact NH2-OD2 3.64Å; R33-R59 VanDerWaalsContact CZ-CD 3.45Å; R33-E75 WeakPolarHBondContact CD-OE1 3.37Å; R33-E75 IonicContact CZ-OE1 3.91Å; R33-E75 IonicContact NE-OE1 3.57Å; R33-E75 IonicContact NH1-OE1 3.54Å; R33-E75 PolarHBondContact NH1-OE1 3Å
34	P	93.5	Very high	76.2	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.006	44%	0.436	C	S	.	.			trans	-45.2	140.5	171.9	-33	37.1	0	0	0	112.8	F36 L37 R38 A89	P34-F36 HydrophobicContact CB-CD1 4.32Å; P34-F36 HydrophobicContact CB-CD2 4.23Å; P34-F36 HydrophobicContact CB-CE1 3.86Å; P34-F36 HydrophobicContact CB-CE2 3.74Å; P34-F36 HydrophobicContact CB-CG 4.49Å; P34-F36 HydrophobicContact CB-CZ 3.57Å; P34-F36 HydrophobicContact CG-CZ 4.28Å; P34-F36 PolarHBondContact O-N 2.87Å; P34-L37 HydrophobicContact CB-CG 4.42Å; P34-L37 HydrophobicContact CG-CD1 4.45Å; P34-L37 PolarHBondContact O-N 2.89Å; P34-R38 PolarHBondContact O-N 2.76Å; P34-A89 HydrophobicContact CB-CB 4.28Å; P34-A89 WeakPolarHBondContact CB-O 3.44Å; P34-A89 HydrophobicContact CG-CB 3.89Å
35	R	89.8	Confident	75.2	Confident	142 Å²	142	70.3 Å²	70.3	54%	0.536	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.2	-174.8	-69.7	-175.8	-176.7	-177.7	1.1	113	L37 R38 R65 N140	R35-L37 VanDerWaalsContact C-N 3.31Å; R35-L37 PolarHBondContact O-N 3.32Å; R35-R38 PolarHBondContact O-N 3.16Å; R35-R65 PolarHBondContact O-NH1 3.42Å; R35-R65 PolarHBondContact O-NH2 3.32Å; R35-N140 PolarHBondContact NE-OD1 3.1Å; R35-N140 PolarHBondContact NH2-OD1 2.75Å
36	F	89.6	Confident	73.8	Confident	14 Å²	14	63.4 Å²	63.4	6%	0.061	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-6.9	-179.8	56.5	-107.4	0	0	0	115.1	P34 P61 R65 L67 Y73 A89 C91 F447	P34-F36 HydrophobicContact CB-CD1 4.32Å; P34-F36 HydrophobicContact CB-CD2 4.23Å; P34-F36 HydrophobicContact CB-CE1 3.86Å; P34-F36 HydrophobicContact CB-CE2 3.74Å; P34-F36 HydrophobicContact CB-CG 4.49Å; P34-F36 HydrophobicContact CB-CZ 3.57Å; P34-F36 HydrophobicContact CG-CZ 4.28Å; P34-F36 PolarHBondContact O-N 2.87Å; F36-P61 HydrophobicContact CD2-CG 4.1Å; F36-R65 VanDerWaalsContact CA-NH1 3.35Å; F36-R65 WeakPolarHBondContact O-CD 3.47Å; F36-R65 PolarHBondContact O-NH1 3.15Å; F36-L67 HydrophobicContact CB-CD2 3.66Å; F36-L67 HydrophobicContact CD1-CD2 4.31Å; F36-L67 HydrophobicContact CD2-CD2 4.11Å; F36-L67 HydrophobicContact CG-CD2 3.77Å; F36-Y73 AromaticContact CE2-CD1 3.47Å; F36-Y73 HydrophobicContact CE2-CD1 3.47Å; F36-Y73 VanDerWaalsContact CE2-CD1 3.47Å; F36-Y73 HydrophobicContact CE2-CD2 4.18Å; F36-Y73 AromaticContact CE2-CE1 3.75Å; F36-Y73 HydrophobicContact CE2-CE1 3.75Å; F36-Y73 HydrophobicContact CE2-CE2 4.4Å; F36-Y73 AromaticContact CE2-CG 3.68Å; F36-Y73 HydrophobicContact CE2-CG 3.68Å; F36-Y73 HydrophobicContact CZ-CD1 4.08Å; F36-Y73 AromaticContact CZ-CD2 3.98Å; F36-Y73 HydrophobicContact CZ-CD2 3.98Å; F36-Y73 HydrophobicContact CZ-CE1 4.17Å; F36-Y73 HydrophobicContact CZ-CE2 4.05Å; F36-Y73 AromaticContact CZ-CG 3.95Å; F36-Y73 HydrophobicContact CZ-CG 3.95Å; F36-A89 HydrophobicContact CE1-CB 4.12Å; F36-A89 HydrophobicContact CZ-CB 3.62Å; F36-C91 VanDerWaalsContact CD1-SG 3.54Å; F36-F447 HydrophobicContact CE1-CZ 4.06Å; F36-F447 HydrophobicContact CZ-CE1 4.45Å; F36-F447 AromaticContact CZ-CZ 3.89Å; F36-F447 HydrophobicContact CZ-CZ 3.89Å
37	L	89.3	Confident	72.3	Confident	9 Å²	9	64.1 Å²	64.1	5%	0.047	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-11.6	170.9	-63	-173.5	0	0	0	113.2	R33 P34 R35 G39 S40 R59 P61 Y73 E75	R33-L37 HydrophobicContact CB-CB 4.42Å; P34-L37 HydrophobicContact CB-CG 4.42Å; P34-L37 HydrophobicContact CG-CD1 4.45Å; P34-L37 PolarHBondContact O-N 2.89Å; R35-L37 VanDerWaalsContact C-N 3.31Å; R35-L37 PolarHBondContact O-N 3.32Å; L37-G39 PolarHBondContact O-N 2.66Å; L37-S40 PolarHBondContact O-OG 3.14Å; L37-R59 HydrophobicContact CD1-CB 4.45Å; L37-P61 HydrophobicContact CD2-CG 4.23Å; L37-P61 VanDerWaalsContact CD2-N 3.34Å; L37-Y73 HydrophobicContact CD1-CD1 4.47Å; L37-Y73 HydrophobicContact CD1-CE1 3.93Å; L37-Y73 HydrophobicContact CD2-CD1 4.42Å; L37-E75 HydrophobicContact CD1-CG 3.81Å; L37-E75 VanDerWaalsContact CD1-OE1 3.25Å; L37-E75 WeakPolarHBondContact CD1-OE1 3.31Å; L37-E75 WeakPolarHBondContact CD1-OE2 3.35Å
38	R	79.6	Confident	70.7	Confident	107 Å²	107	59.8 Å²	59.8	40%	0.404	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	135.3	178	-57.7	-179.4	-167.9	178.4	4.2	110.1	H32 R33 P34 R35 R65	H32-R38 PolarHBondContact CD2-NH2 3.14Å; H32-R38 PolarHBondContact CE1-NH2 3.33Å; H32-R38 PolarHBondContact ND1-NH2 3.32Å; H32-R38 PolarHBondContact NE2-NH2 3.21Å; R33-R38 PolarHBondContact O-NE 3.38Å; R33-R38 VanDerWaalsContact O-NE 3.13Å; R33-R38 PolarHBondContact O-NH2 2.64Å; P34-R38 PolarHBondContact O-N 2.76Å; R35-R38 PolarHBondContact O-N 3.16Å; R38-R65 PolarHBondContact O-NH1 3.23Å
39	G	61.5	Low	68.6	Low	76 Å²	76	60.1 Å²	60.1	78%	0.784	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	0.4	176.5	0	0	0	0	0	115.8	L37 G41	L37-G39 PolarHBondContact O-N 2.66Å; G39-G41 PolarHBondContact O-N 3.32Å
40	S	56.1	Low	66.7	Low	56 Å²	56	60.6 Å²	60.6	39%	0.392	39%	0.391	S	S	.	.	S	Bend	trans	-74.1	33.8	176.8	66.9	0	0	0	0	114.3	L37	L37-S40 PolarHBondContact O-OG 3.14Å
41	G	47.6	Very low	65	Low	83 Å²	83	66.6 Å²	66.6	86%	0.856	40%	0.401	S	S	*	.	S	Bend	trans	84.5	8.5	175.6	0	0	0	0	0	116.8	G39	G39-G41 PolarHBondContact O-N 3.32Å
42	S	44.9	Very low	63.4	Low	44 Å²	44	72.4 Å²	72.4	31%	0.308	42%	0.423	S	S	.	.	S	Bend	trans	-119.9	135.7	174.4	58	0	0	0	0	111.9	R59	S42-R59 PolarHBondContact OG-NH1 2.93Å; S42-R59 VanDerWaalsContact OG-NH1 3.15Å
43	S	40.8	Very low	61.8	Low	68 Å²	68	73.5 Å²	73.5	48%	0.476	43%	0.433	S	S	.	.			trans	-46.5	146.1	172.7	-178.8	0	0	0	0	111.3	S45 A46	S43-S45 PolarHBondContact O-N 2.96Å; S43-S45 PolarHBondContact OG-N 3.28Å; S43-S45 PolarHBondContact OG-OG 3.05Å; S43-A46 PolarHBondContact O-N 2.65Å
44	P	44.9	Very low	60.3	Low	120 Å²	120	77.8 Å²	77.8	78%	0.779	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-13.3	171.3	-23	31.7	0	0	0	114.6
45	S	44.2	Very low	58.8	Low	88 Å²	88	80.5 Å²	80.5	62%	0.615	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	8.6	-172.5	69.5	0	0	0	0	115.2	S43 T47	S43-S45 PolarHBondContact O-N 2.96Å; S43-S45 PolarHBondContact OG-N 3.28Å; S43-S45 PolarHBondContact OG-OG 3.05Å; S45-T47 PolarHBondContact O-N 2.68Å
46	A	47	Very low	57.9	Low	42 Å²	42	74.8 Å²	74.8	35%	0.347	46%	0.456	S	S	.	.			trans	-74.2	93.2	-176.6	0	0	0	0	0	110.5	S43 D48	S43-A46 PolarHBondContact O-N 2.65Å; A46-D48 PolarHBondContact O-N 2.97Å
47	T	53	Low	57.7	Low	63 Å²	63	76.8 Å²	76.8	39%	0.387	47%	0.471	S	S	.	.			trans	-51.1	131.7	155.5	51.7	0	0	0	0	107.4	S45 A49 E83	S45-T47 PolarHBondContact O-N 2.68Å; T47-A49 PolarHBondContact O-N 2.84Å; T47-E83 HydrophobicContact CG2-CG 3.81Å; T47-E83 WeakPolarHBondContact CG2-OE1 3.43Å
48	D	54.4	Low	57.7	Low	17 Å²	17	77.7 Å²	77.7	9%	0.091	48%	0.476	C	S	.	.			trans	-69.5	93.9	170	-95.4	-28.7	0	0	0	106.8	R33 A46 S50 R56 P57 R59	R33-D48 IonicContact NH2-OD2 3.64Å; A46-D48 PolarHBondContact O-N 2.97Å; D48-S50 PolarHBondContact O-N 3.07Å; D48-R56 HydrophobicContact CB-CG 4.33Å; D48-R56 PolarHBondContact O-NH2 3.09Å; D48-P57 VanDerWaalsContact OD1-CD 3.25Å; D48-P57 WeakPolarHBondContact OD1-CD 3.32Å; D48-P57 VanDerWaalsContact OD1-CG 3.24Å; D48-P57 WeakPolarHBondContact OD1-CG 3.36Å; D48-R59 IonicContact OD1-NH2 3.13Å; D48-R59 PolarHBondContact OD1-NH2 3.11Å; D48-R59 VanDerWaalsContact OD1-NH2 3.13Å; D48-R59 IonicContact OD2-NE 3.86Å; D48-R59 IonicContact OD2-NH2 3.96Å
49	A	47.1	Very low	58.3	Low	93 Å²	93	74.4 Å²	74.4	77%	0.769	46%	0.464	S	S	*	.			trans	-63.3	-13.8	-171.3	0	0	0	0	0	113.5	T47	T47-A49 PolarHBondContact O-N 2.84Å
50	S	53.3	Low	59.8	Low	37 Å²	37	71.8 Å²	71.8	26%	0.259	43%	0.434	S	S	.	.			trans	-78.8	130	174.6	-171	0	0	0	0	111.5	D48 R52 S55 R56	D48-S50 PolarHBondContact O-N 3.07Å; S50-R52 PolarHBondContact OG-N 2.92Å; S50-S55 PolarHBondContact OG-OG 2.65Å; S50-R56 PolarHBondContact O-NE 3.25Å; S50-R56 PolarHBondContact O-NH2 2.85Å
51	R	55.5	Low	61.4	Low	221 Å²	221	69.5 Å²	69.5	83%	0.834	42%	0.417	S	S	*	.			trans	-95.1	-0.5	171.1	-69	-173.9	178.7	174.8	-1.3	113.4	A79	R51-A79 WeakPolarHBondContact O-CB 3.45Å
52	R	58.5	Low	63.2	Low	175 Å²	175	67.8 Å²	67.8	66%	0.66	40%	0.395	S	S	*	.	S	Bend	trans	-93.1	132.7	176.6	-59.1	-173.6	174.9	-147.1	-1.9	110.3	S50 D54 S55	S50-R52 PolarHBondContact OG-N 2.92Å; R52-D54 WeakPolarHBondContact CB-OD1 3.41Å; R52-D54 PolarHBondContact O-N 3.14Å; R52-S55 WeakPolarHBondContact CB-OG 3.44Å; R52-S55 PolarHBondContact O-N 3.24Å; R52-S55 PolarHBondContact O-OG 2.9Å; R52-S55 VanDerWaalsContact O-OG 3.08Å
53	P	56.8	Low	64.8	Low	58 Å²	58	74.5 Å²	74.5	38%	0.377	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-55.8	-32.8	179.9	-26.8	34.1	0	0	0	114.5	S55 A79 Q427	P53-S55 VanDerWaalsContact C-N 3.28Å; P53-S55 PolarHBondContact O-N 3.33Å; P53-A79 HydrophobicContact CG-CB 4.28Å; P53-Q427 PolarHBondContact O-NE2 3.35Å
54	D	58.5	Low	66.5	Low	119 Å²	119	74.4 Å²	74.4	64%	0.636	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-73.7	-8.3	-177.7	63.6	-7.4	0	0	0	115.1	R52	R52-D54 WeakPolarHBondContact CB-OD1 3.41Å; R52-D54 PolarHBondContact O-N 3.14Å
55	S	62.8	Low	68.2	Low	59 Å²	59	73.8 Å²	73.8	41%	0.413	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-130.2	6.3	-169.3	48.4	0	0	0	0	114.2	S50 R52 P53	S50-S55 PolarHBondContact OG-OG 2.65Å; R52-S55 WeakPolarHBondContact CB-OG 3.44Å; R52-S55 PolarHBondContact O-N 3.24Å; R52-S55 PolarHBondContact O-OG 2.9Å; R52-S55 VanDerWaalsContact O-OG 3.08Å; P53-S55 VanDerWaalsContact C-N 3.28Å; P53-S55 PolarHBondContact O-N 3.33Å
56	R	71.8	Confident	70.1	Confident	21 Å²	21	74.3 Å²	74.3	8%	0.079	41%	0.405	C	S	.	.	S	Bend	trans	-80.3	130.5	168.1	-72.7	-165.3	169.1	-151.2	-6.9	110.5	D48 S50 V58 I76 I77	D48-R56 HydrophobicContact CB-CG 4.33Å; D48-R56 PolarHBondContact O-NH2 3.09Å; S50-R56 PolarHBondContact O-NE 3.25Å; S50-R56 PolarHBondContact O-NH2 2.85Å; R56-V58 PolarHBondContact O-N 3.18Å; R56-I76 HydrophobicContact CB-CD1 4.3Å; R56-I76 HydrophobicContact CB-CG1 4.3Å; R56-I77 WeakPolarHBondContact CD-O 3.28Å
57	P	83.9	Confident	72.2	Confident	57 Å²	57	72.8 Å²	72.8	37%	0.37	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-71.9	125.5	-177.4	29	-34	0	0	0	110.8	D48 R59	D48-P57 VanDerWaalsContact OD1-CD 3.25Å; D48-P57 WeakPolarHBondContact OD1-CD 3.32Å; D48-P57 VanDerWaalsContact OD1-CG 3.24Å; D48-P57 WeakPolarHBondContact OD1-CG 3.36Å; P57-R59 PolarHBondContact O-N 3.36Å
58	V	90.1	Very high	73.8	Confident	28 Å²	28	71.1 Å²	71.1	17%	0.17	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-65.7	121.5	160.8	-177.2	0	0	0	0	108.1	R56 A74 I76 K420 I423	R56-V58 PolarHBondContact O-N 3.18Å; V58-A74 HydrophobicContact CG1-CB 3.99Å; V58-I76 HydrophobicContact CG2-CB 4.44Å; V58-I76 HydrophobicContact CG2-CD1 4.04Å; V58-K420 HydrophobicContact CG1-CB 4.22Å; V58-K420 HydrophobicContact CG1-CG 3.86Å; V58-I423 HydrophobicContact CG1-CB 4.35Å; V58-I423 HydrophobicContact CG1-CD1 4.12Å; V58-I423 HydrophobicContact CG1-CG2 4.18Å; V58-I423 HydrophobicContact CG2-CG2 3.77Å
59	R	91.8	Very high	75.4	Confident	38 Å²	38	74.2 Å²	74.2	14%	0.143	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-99.7	141.7	-177.9	-66.7	178.3	-177.9	-94	-2.3	110.1	R33 L37 S42 D48 P57 A74 E75	R33-R59 VanDerWaalsContact CZ-CD 3.45Å; L37-R59 HydrophobicContact CD1-CB 4.45Å; S42-R59 PolarHBondContact OG-NH1 2.93Å; S42-R59 VanDerWaalsContact OG-NH1 3.15Å; D48-R59 IonicContact OD1-NH2 3.13Å; D48-R59 PolarHBondContact OD1-NH2 3.11Å; D48-R59 VanDerWaalsContact OD1-NH2 3.13Å; D48-R59 IonicContact OD2-NE 3.86Å; D48-R59 IonicContact OD2-NH2 3.96Å; P57-R59 PolarHBondContact O-N 3.36Å; R59-A74 CarbonylContact O-C 3.57Å; R59-A74 WeakPolarHBondContact O-CA 3.42Å; R59-E75 HydrophobicContact CB-CG 4.11Å; R59-E75 PolarHBondContact N-O 3.5Å; R59-E75 PolarHBondContact O-N 2.86Å
60	S	93.3	Very high	77.5	Confident	21 Å²	21	73 Å²	73	15%	0.147	37%	0.372	C	S	.	.			trans	-142.8	165.5	173.6	71.6	0	0	0	0	109.3	A62 Y73 K420	S60-A62 PolarHBondContact O-N 3.4Å; S60-Y73 VanDerWaalsContact CB-O 3.28Å; S60-Y73 WeakPolarHBondContact CB-O 3.37Å; S60-K420 WeakPolarHBondContact OG-CE 3.12Å; S60-K420 PolarHBondContact OG-NZ 2.75Å
61	P	89.9	Confident	79.5	Confident	8 Å²	8	71.3 Å²	71.3	5%	0.052	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-50.5	142.4	167.2	-24.8	33.9	0	0	0	111	F36 L37 L67 Y73	F36-P61 HydrophobicContact CD2-CG 4.1Å; L37-P61 HydrophobicContact CD2-CG 4.23Å; L37-P61 VanDerWaalsContact CD2-N 3.34Å; P61-L67 HydrophobicContact CB-CD2 4.4Å; P61-L67 HydrophobicContact CG-CD1 3.93Å; P61-L67 HydrophobicContact CG-CD2 3.9Å; P61-L67 HydrophobicContact CG-CG 3.98Å; P61-Y73 WeakPolarHBondContact CD-O 3.39Å
62	A	84.4	Confident	81.5	Confident	46 Å²	46	60.8 Å²	60.8	38%	0.38	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-61.8	148.8	178	0	0	0	0	0	111	S60 G64 R65	S60-A62 PolarHBondContact O-N 3.4Å; A62-G64 PolarHBondContact O-N 2.9Å; A62-R65 WeakPolarHBondContact O-CB 3.44Å; A62-R65 PolarHBondContact O-N 3.23Å
63	R	79.3	Confident	83.3	Confident	185 Å²	185	52.5 Å²	52.5	70%	0.698	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	130.2	173.4	-72.6	-175.3	175.8	-113.8	-4.2	109.5
64	G	76.3	Confident	85.2	Confident	66 Å²	66	49.7 Å²	49.7	68%	0.68	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-10.6	-173.8	0	0	0	0	0	115.5	A62	A62-G64 PolarHBondContact O-N 2.9Å
65	R	81.7	Confident	87	Confident	108 Å²	108	44 Å²	44	41%	0.408	24%	0.241	S	C	.	.			trans	-98.1	91.2	170.9	-168.1	179.6	-168.4	174.7	7.4	110	R35 F36 R38 A62	R35-R65 PolarHBondContact O-NH1 3.42Å; R35-R65 PolarHBondContact O-NH2 3.32Å; F36-R65 VanDerWaalsContact CA-NH1 3.35Å; F36-R65 WeakPolarHBondContact O-CD 3.47Å; F36-R65 PolarHBondContact O-NH1 3.15Å; R38-R65 PolarHBondContact O-NH1 3.23Å; A62-R65 WeakPolarHBondContact O-CB 3.44Å; A62-R65 PolarHBondContact O-N 3.23Å
66	T	83.6	Confident	88.4	Confident	98 Å²	98	41.8 Å²	41.8	60%	0.601	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-76.8	137.9	176	50	0	0	0	0	110.7
67	L	90.6	Very high	89.1	Confident	10 Å²	10	40.9 Å²	40.9	5%	0.052	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-81.8	162.7	171.1	-57.7	-173	0	0	0	109.8	F36 P61 W69 N70 A71 F447	F36-L67 HydrophobicContact CB-CD2 3.66Å; F36-L67 HydrophobicContact CD1-CD2 4.31Å; F36-L67 HydrophobicContact CD2-CD2 4.11Å; F36-L67 HydrophobicContact CG-CD2 3.77Å; P61-L67 HydrophobicContact CB-CD2 4.4Å; P61-L67 HydrophobicContact CG-CD1 3.93Å; P61-L67 HydrophobicContact CG-CD2 3.9Å; P61-L67 HydrophobicContact CG-CG 3.98Å; L67-W69 PolarHBondContact O-N 3.49Å; L67-N70 WeakPolarHBondContact O-CA 3.32Å; L67-N70 PolarHBondContact O-N 3.43Å; L67-A71 HydrophobicContact CB-CB 4.24Å; L67-A71 WeakPolarHBondContact CB-O 3.07Å; L67-F447 HydrophobicContact CD1-CE1 3.94Å
68	P	86.7	Confident	88.7	Confident	29 Å²	29	39.1 Å²	39.1	19%	0.188	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-52.2	139	175.4	-22.1	32.4	0	0	0	111.1	N70 A71 C91	P68-N70 PolarHBondContact O-N 3.42Å; P68-A71 WeakPolarHBondContact O-CB 3.34Å; P68-A71 PolarHBondContact O-N 2.94Å; P68-C91 VanDerWaalsContact CD-SG 3.56Å; P68-C91 HydrophobicContact CG-CB 4.43Å
69	W	87.4	Confident	87.1	Confident	81 Å²	81	38.7 Å²	38.7	31%	0.307	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	57.8	26.2	-176.3	-144.8	-97.8	0	0	0	114.6	L67 A71 H121 W123 P450	L67-W69 PolarHBondContact O-N 3.49Å; W69-A71 PolarHBondContact O-N 3.05Å; W69-A71 VanDerWaalsContact O-N 3.17Å; W69-H121 AromaticContact CE3-CD2 3.93Å; W69-H121 AromaticContact CE3-CE1 3.13Å; W69-H121 AromaticContact CE3-CG 3.86Å; W69-H121 AromaticContact CE3-ND1 3.34Å; W69-H121 VanDerWaalsContact CE3-ND1 3.34Å; W69-H121 AromaticContact CE3-NE2 3.51Å; W69-H121 AromaticContact CZ3-CE1 3.23Å; W69-H121 WeakPolarHBondContact CZ3-CE1 3.46Å; W69-H121 AromaticContact CZ3-ND1 3.48Å; W69-H121 WeakPolarHBondContact CZ3-ND1 3.33Å; W69-W123 HydrophobicContact CB-CH2 3.87Å; W69-W123 HydrophobicContact CB-CZ2 3.49Å; W69-W123 VanDerWaalsContact CB-CZ2 3.49Å; W69-W123 HydrophobicContact CG-CH2 4.26Å; W69-W123 HydrophobicContact CG-CZ2 4.32Å; W69-P450 PolarHBondContact NE1-O 3.19Å; W69-P450 WeakPolarHBondContact O-CG 3.36Å
70	N	91.1	Very high	85.8	Confident	68 Å²	68	43.6 Å²	43.6	36%	0.364	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	56	28.6	-176.1	-159.6	36.9	0	0	0	114.2	L67 P68 F415	L67-N70 WeakPolarHBondContact O-CA 3.32Å; L67-N70 PolarHBondContact O-N 3.43Å; P68-N70 PolarHBondContact O-N 3.42Å; N70-F415 VanDerWaalsContact O-CD2 3.29Å; N70-F415 WeakPolarHBondContact O-CD2 3.3Å
71	A	95.4	Very high	84.6	Confident	2 Å²	2	46 Å²	46	2%	0.017	24%	0.241	C	C	.	.			trans	-62.7	145.8	177.7	0	0	0	0	0	111.8	L67 P68 W69 V448 I449	L67-A71 HydrophobicContact CB-CB 4.24Å; L67-A71 WeakPolarHBondContact CB-O 3.07Å; P68-A71 WeakPolarHBondContact O-CB 3.34Å; P68-A71 PolarHBondContact O-N 2.94Å; W69-A71 PolarHBondContact O-N 3.05Å; W69-A71 VanDerWaalsContact O-N 3.17Å; A71-V448 CarbonylContact C-O 3.57Å; A71-V448 WeakPolarHBondContact CA-O 3.22Å; A71-I449 HydrophobicContact CB-CG1 4.3Å
72	G	96.9	Very high	83.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	149.2	169.3	0	0	0	0	0	111.8	F447 V448	G72-F447 WeakPolarHBondContact O-CA 3.4Å; G72-F447 WeakPolarHBondContact O-CD1 3.35Å; G72-V448 PolarHBondContact N-O 3.16Å; G72-V448 PolarHBondContact O-N 3.43Å
73	Y	97.9	Very high	83.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142.6	171.1	-178.8	-88.2	0	0	0	111.3	F36 L37 S60 P61 E75 A89 L125 V446 F447	F36-Y73 AromaticContact CE2-CD1 3.47Å; F36-Y73 HydrophobicContact CE2-CD1 3.47Å; F36-Y73 VanDerWaalsContact CE2-CD1 3.47Å; F36-Y73 HydrophobicContact CE2-CD2 4.18Å; F36-Y73 AromaticContact CE2-CE1 3.75Å; F36-Y73 HydrophobicContact CE2-CE1 3.75Å; F36-Y73 HydrophobicContact CE2-CE2 4.4Å; F36-Y73 AromaticContact CE2-CG 3.68Å; F36-Y73 HydrophobicContact CE2-CG 3.68Å; F36-Y73 HydrophobicContact CZ-CD1 4.08Å; F36-Y73 AromaticContact CZ-CD2 3.98Å; F36-Y73 HydrophobicContact CZ-CD2 3.98Å; F36-Y73 HydrophobicContact CZ-CE1 4.17Å; F36-Y73 HydrophobicContact CZ-CE2 4.05Å; F36-Y73 AromaticContact CZ-CG 3.95Å; F36-Y73 HydrophobicContact CZ-CG 3.95Å; L37-Y73 HydrophobicContact CD1-CD1 4.47Å; L37-Y73 HydrophobicContact CD1-CE1 3.93Å; L37-Y73 HydrophobicContact CD2-CD1 4.42Å; S60-Y73 VanDerWaalsContact CB-O 3.28Å; S60-Y73 WeakPolarHBondContact CB-O 3.37Å; P61-Y73 WeakPolarHBondContact CD-O 3.39Å; Y73-E75 HydrophobicContact CE1-CB 3.81Å; Y73-E75 HydrophobicContact CE1-CG 3.94Å; Y73-E75 VanDerWaalsContact CE1-OE2 3.31Å; Y73-E75 WeakPolarHBondContact CE1-OE2 3.26Å; Y73-E75 PolarHBondContact OH-OE2 3.21Å; Y73-A89 HydrophobicContact CD2-CB 4.31Å; Y73-A89 HydrophobicContact CE2-CB 3.4Å; Y73-A89 WeakPolarHBondContact OH-CB 3.22Å; Y73-L125 HydrophobicContact CE2-CD2 3.87Å; Y73-V446 VanDerWaalsContact CA-O 3.29Å; Y73-V446 WeakPolarHBondContact CA-O 3.23Å; Y73-V446 WeakPolarHBondContact CD2-O 3.34Å; Y73-F447 AromaticContact CD2-CD1 3.77Å; Y73-F447 HydrophobicContact CD2-CD1 3.77Å; Y73-F447 AromaticContact CD2-CD2 3.84Å; Y73-F447 HydrophobicContact CD2-CD2 3.84Å; Y73-F447 AromaticContact CD2-CE1 3.6Å; Y73-F447 HydrophobicContact CD2-CE1 3.6Å; Y73-F447 AromaticContact CD2-CE2 3.68Å; Y73-F447 HydrophobicContact CD2-CE2 3.68Å; Y73-F447 AromaticContact CD2-CG 3.88Å; Y73-F447 HydrophobicContact CD2-CG 3.88Å; Y73-F447 AromaticContact CD2-CZ 3.55Å; Y73-F447 HydrophobicContact CD2-CZ 3.55Å; Y73-F447 HydrophobicContact CE2-CD2 4.14Å; Y73-F447 AromaticContact CE2-CE2 3.84Å; Y73-F447 HydrophobicContact CE2-CE2 3.84Å; Y73-F447 HydrophobicContact CE2-CZ 4.04Å; Y73-F447 HydrophobicContact CG-CD1 4.43Å; Y73-F447 HydrophobicContact CG-CE1 4.18Å; Y73-F447 HydrophobicContact CG-CZ 4.41Å
74	A	97	Very high	83.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.3	164.5	0	0	0	0	0	111.5	V58 R59 A419 K420 I423 V446	V58-A74 HydrophobicContact CG1-CB 3.99Å; R59-A74 CarbonylContact O-C 3.57Å; R59-A74 WeakPolarHBondContact O-CA 3.42Å; A74-A419 HydrophobicContact CB-CB 3.7Å; A74-K420 HydrophobicContact CB-CG 3.89Å; A74-I423 VanDerWaalsContact C-CD1 3.44Å; A74-I423 HydrophobicContact CB-CD1 3.63Å; A74-I423 WeakPolarHBondContact O-CD1 3.43Å; A74-V446 PolarHBondContact N-O 3.41Å; A74-V446 PolarHBondContact O-N 3.44Å
75	E	95.3	Very high	84.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.8	172	68.4	-174	-148	0	0	112.2	R33 L37 R59 Y73 V444	R33-E75 WeakPolarHBondContact CD-OE1 3.37Å; R33-E75 IonicContact CZ-OE1 3.91Å; R33-E75 IonicContact NE-OE1 3.57Å; R33-E75 IonicContact NH1-OE1 3.54Å; R33-E75 PolarHBondContact NH1-OE1 3Å; L37-E75 HydrophobicContact CD1-CG 3.81Å; L37-E75 VanDerWaalsContact CD1-OE1 3.25Å; L37-E75 WeakPolarHBondContact CD1-OE1 3.31Å; L37-E75 WeakPolarHBondContact CD1-OE2 3.35Å; R59-E75 HydrophobicContact CB-CG 4.11Å; R59-E75 PolarHBondContact N-O 3.5Å; R59-E75 PolarHBondContact O-N 2.86Å; Y73-E75 HydrophobicContact CE1-CB 3.81Å; Y73-E75 HydrophobicContact CE1-CG 3.94Å; Y73-E75 VanDerWaalsContact CE1-OE2 3.31Å; Y73-E75 WeakPolarHBondContact CE1-OE2 3.26Å; Y73-E75 PolarHBondContact OH-OE2 3.21Å; E75-V444 CarbonylContact C-O 3.51Å; E75-V444 WeakPolarHBondContact CA-O 3.36Å
76	I	91.8	Very high	84.7	Confident	11 Å²	11	38 Å²	38	6%	0.056	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.5	169	-167.2	174.2	0	0	0	109.8	R56 V58 I423 Q427 V444	R56-I76 HydrophobicContact CB-CD1 4.3Å; R56-I76 HydrophobicContact CB-CG1 4.3Å; V58-I76 HydrophobicContact CG2-CB 4.44Å; V58-I76 HydrophobicContact CG2-CD1 4.04Å; I76-I423 HydrophobicContact CB-CG2 3.86Å; I76-I423 HydrophobicContact CD1-CG2 4.49Å; I76-I423 HydrophobicContact CG2-CG2 3.4Å; I76-Q427 HydrophobicContact CD1-CG 4.39Å; I76-V444 HydrophobicContact CG2-CB 3.92Å; I76-V444 HydrophobicContact CG2-CG2 4.18Å; I76-V444 PolarHBondContact N-O 3.25Å; I76-V444 PolarHBondContact O-N 2.95Å; I76-V444 VanDerWaalsContact O-N 3.15Å
77	I	87.6	Confident	85.4	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.015	16%	0.163	C	C	.	.			trans	-87.9	131.3	168.6	-53.4	176.9	0	0	0	108.6	R56 N85 D443	R56-I77 WeakPolarHBondContact CD-O 3.28Å; I77-N85 HydrophobicContact CD1-CB 3.98Å; I77-N85 HydrophobicContact CG1-CB 3.62Å; I77-D443 VanDerWaalsContact CA-OD1 3.25Å; I77-D443 WeakPolarHBondContact CA-OD1 2.95Å; I77-D443 VanDerWaalsContact CG2-OD1 3.31Å; I77-D443 WeakPolarHBondContact CG2-OD1 3.43Å
78	N	73.9	Confident	85.7	Confident	19 Å²	19	33 Å²	33	10%	0.102	16%	0.161	C	C	.	.			trans	-76.1	139.4	172.3	-150.7	-45.6	0	0	0	112.3	E80 S440 Y441 D442 D443	N78-E80 PolarHBondContact O-N 2.83Å; N78-E80 VanDerWaalsContact O-N 3.14Å; N78-S440 PolarHBondContact ND2-O 3.13Å; N78-Y441 WeakPolarHBondContact ND2-CA 3.38Å; N78-Y441 PolarHBondContact ND2-N 3.01Å; N78-D442 WeakPolarHBondContact CB-O 3.48Å; N78-D442 PolarHBondContact ND2-N 2.95Å; N78-D442 PolarHBondContact ND2-O 3.21Å; N78-D443 PolarHBondContact N-OD1 2.88Å
79	A	58.1	Low	86.2	Confident	20 Å²	20	31.7 Å²	31.7	17%	0.165	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.7	-171.2	0	0	0	0	0	114.4	R51 P53	R51-A79 WeakPolarHBondContact O-CB 3.45Å; P53-A79 HydrophobicContact CG-CB 4.28Å
80	E	63.1	Low	86.7	Confident	140 Å²	140	28.5 Å²	28.5	65%	0.654	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-13.4	-173.8	-61.2	-174.1	177	0	0	114.7	N78	N78-E80 PolarHBondContact O-N 2.83Å; N78-E80 VanDerWaalsContact O-N 3.14Å
81	K	68.4	Low	87	Confident	73 Å²	73	26.7 Å²	26.7	32%	0.317	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-57.2	-176.4	-171.8	171.6	172.4	177.3	0	112.2	D127 D442	K81-D127 IonicContact NZ-OD1 3.12Å; K81-D442 WeakPolarHBondContact CD-OD1 3.25Å; K81-D442 WeakPolarHBondContact CE-OD1 3.27Å; K81-D442 IonicContact NZ-OD1 3.69Å; K81-D442 PolarHBondContact NZ-OD1 2.88Å; K81-D442 IonicContact NZ-OD2 2.55Å; K81-D442 PolarHBondContact NZ-OD2 3.45Å
82	S	71.2	Confident	86.9	Confident	25 Å²	25	27.6 Å²	27.6	18%	0.175	15%	0.146	C	C	.	.			trans	-157.6	163.4	-170	45.3	0	0	0	0	113.6	F84	S82-F84 VanDerWaalsContact C-N 3.28Å; S82-F84 WeakPolarHBondContact CB-O 3.39Å; S82-F84 PolarHBondContact OG-O 2.79Å
83	E	76.3	Confident	86.6	Confident	119 Å²	119	35.2 Å²	35.2	56%	0.556	18%	0.179	S	C	*	.	S	Bend	trans	-69.5	-29.2	171.5	-177.5	174.3	-167.3	0	0	112.1	T47	T47-E83 HydrophobicContact CG2-CG 3.81Å; T47-E83 WeakPolarHBondContact CG2-OE1 3.43Å
84	F	83.8	Confident	86.1	Confident	72 Å²	72	35.7 Å²	35.7	32%	0.316	18%	0.181	S	C	.	.	S	Bend	trans	-114.6	152	-177.5	-57.7	-63.2	0	0	0	110.7	Y31 S82 E86	Y31-F84 AromaticContact CD1-CD1 3.43Å; Y31-F84 HydrophobicContact CD1-CD1 3.43Å; Y31-F84 VanDerWaalsContact CD1-CD1 3.43Å; Y31-F84 AromaticContact CD1-CE1 3.89Å; Y31-F84 HydrophobicContact CD1-CE1 3.89Å; Y31-F84 HydrophobicContact CD1-CG 4.22Å; Y31-F84 HydrophobicContact CD2-CB 3.94Å; Y31-F84 HydrophobicContact CD2-CD1 4.15Å; Y31-F84 HydrophobicContact CD2-CG 4.11Å; Y31-F84 HydrophobicContact CE1-CB 4.36Å; Y31-F84 AromaticContact CE1-CD1 3.57Å; Y31-F84 HydrophobicContact CE1-CD1 3.57Å; Y31-F84 HydrophobicContact CE1-CE1 4.35Å; Y31-F84 HydrophobicContact CE1-CG 4.34Å; Y31-F84 HydrophobicContact CE2-CB 3.69Å; Y31-F84 HydrophobicContact CE2-CD1 4.29Å; Y31-F84 HydrophobicContact CE2-CG 4.27Å; Y31-F84 HydrophobicContact CG-CB 4.37Å; Y31-F84 AromaticContact CG-CD1 3.71Å; Y31-F84 HydrophobicContact CG-CD1 3.71Å; Y31-F84 HydrophobicContact CG-CE1 4.24Å; Y31-F84 HydrophobicContact CG-CG 4.07Å; Y31-F84 AromaticContact CZ-CD1 3.99Å; S82-F84 VanDerWaalsContact C-N 3.28Å; S82-F84 WeakPolarHBondContact CB-O 3.39Å; S82-F84 PolarHBondContact OG-O 2.79Å; F84-E86 PolarHBondContact O-N 2.92Å
85	N	89.7	Confident	85.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.			trans	-69	117.2	166.1	-160	-9.1	0	0	0	107.7	Y31 I77 D87 D443	Y31-N85 WeakPolarHBondContact CE2-O 3.48Å; Y31-N85 PolarHBondContact OH-N 3.5Å; I77-N85 HydrophobicContact CD1-CB 3.98Å; I77-N85 HydrophobicContact CG1-CB 3.62Å; N85-D87 VanDerWaalsContact C-N 3.26Å; N85-D87 VanDerWaalsContact OD1-CB 3.29Å; N85-D87 WeakPolarHBondContact OD1-CB 3.49Å; N85-D87 PolarHBondContact OD1-N 2.78Å; N85-D87 VanDerWaalsContact OD1-N 3.14Å; N85-D443 WeakPolarHBondContact CA-OD2 3.28Å; N85-D443 VanDerWaalsContact OD1-CB 3.32Å; N85-D443 WeakPolarHBondContact OD1-CB 3.37Å; N85-D443 PolarHBondContact OD1-OD2 3.46Å
86	E	93.9	Very high	85.3	Confident	28 Å²	28	38.5 Å²	38.5	13%	0.131	20%	0.2	C	C	.	.			trans	-78.8	-18.7	174.4	-62.2	-165.4	176.8	0	0	111.3	F84 G128 H129 G130 G131 A135 D443	F84-E86 PolarHBondContact O-N 2.92Å; E86-G128 WeakPolarHBondContact CB-O 3.47Å; E86-G128 WeakPolarHBondContact O-CA 3.25Å; E86-G128 PolarHBondContact O-N 3.17Å; E86-H129 VanDerWaalsContact OE2-CA 3.27Å; E86-H129 WeakPolarHBondContact OE2-CA 3.49Å; E86-G130 PolarHBondContact OE2-N 2.95Å; E86-G131 WeakPolarHBondContact OE1-CA 3.35Å; E86-G131 PolarHBondContact OE1-N 3.49Å; E86-G131 PolarHBondContact OE2-N 3.39Å; E86-A135 WeakPolarHBondContact O-CB 3.5Å; E86-D443 PolarHBondContact N-OD2 2.96Å
87	D	96.4	Very high	85	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.			trans	-64.8	144.5	170.2	-69.4	-8.7	0	0	0	112.5	N85 F126 D127 T385 S445	N85-D87 VanDerWaalsContact C-N 3.26Å; N85-D87 VanDerWaalsContact OD1-CB 3.29Å; N85-D87 WeakPolarHBondContact OD1-CB 3.49Å; N85-D87 PolarHBondContact OD1-N 2.78Å; N85-D87 VanDerWaalsContact OD1-N 3.14Å; D87-F126 CarbonylContact C-O 3.53Å; D87-F126 VanDerWaalsContact CA-O 3.29Å; D87-F126 WeakPolarHBondContact CA-O 3.22Å; D87-D127 WeakPolarHBondContact OD1-CA 3.38Å; D87-T385 WeakPolarHBondContact OD2-CG2 3.35Å; D87-T385 PolarHBondContact OD2-OG1 3.02Å; D87-S445 WeakPolarHBondContact CB-OG 3.42Å; D87-S445 VanDerWaalsContact OD2-CB 3.25Å; D87-S445 WeakPolarHBondContact OD2-CB 3.22Å; D87-S445 PolarHBondContact OD2-N 3.17Å; D87-S445 PolarHBondContact OD2-OG 3.33Å
88	Q	97.4	Very high	84.4	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	163.7	165.8	-69.8	-68.3	-59.6	0	0	111.7	H32 F126 A135 I136 A139	H32-Q88 PolarHBondContact O-NE2 2.87Å; H32-Q88 PolarHBondContact O-OE1 3.05Å; Q88-F126 HydrophobicContact CB-CB 4.34Å; Q88-F126 HydrophobicContact CB-CD2 4.35Å; Q88-F126 PolarHBondContact N-O 2.79Å; Q88-F126 PolarHBondContact O-N 2.83Å; Q88-A135 HydrophobicContact CB-CB 3.98Å; Q88-A135 HydrophobicContact CG-CB 3.8Å; Q88-I136 HydrophobicContact CG-CG1 3.78Å; Q88-A139 HydrophobicContact CB-CB 3.98Å
89	A	98.1	Very high	83.7	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	149.3	179.4	0	0	0	0	0	111.3	P34 F36 Y73 A124 L125 F447	P34-A89 HydrophobicContact CB-CB 4.28Å; P34-A89 WeakPolarHBondContact CB-O 3.44Å; P34-A89 HydrophobicContact CG-CB 3.89Å; F36-A89 HydrophobicContact CE1-CB 4.12Å; F36-A89 HydrophobicContact CZ-CB 3.62Å; Y73-A89 HydrophobicContact CD2-CB 4.31Å; Y73-A89 HydrophobicContact CE2-CB 3.4Å; Y73-A89 WeakPolarHBondContact OH-CB 3.22Å; A89-A124 CarbonylContact C-O 3.53Å; A89-A124 WeakPolarHBondContact CA-O 3.49Å; A89-L125 HydrophobicContact CB-CD2 3.97Å; A89-F447 HydrophobicContact CB-CE2 3.78Å; A89-F447 HydrophobicContact CB-CZ 4.07Å
90	A	97.4	Very high	83.4	Confident	13 Å²	13	56.7 Å²	56.7	11%	0.107	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	140.2	173.8	0	0	0	0	0	110.1	Y122 W123 A124 F126 A139	A90-Y122 HydrophobicContact CB-CE1 4.05Å; A90-W123 CarbonylContact O-C 3.37Å; A90-W123 WeakPolarHBondContact O-CA 3.44Å; A90-A124 PolarHBondContact N-O 2.93Å; A90-A124 PolarHBondContact O-N 2.81Å; A90-F126 HydrophobicContact CB-CE2 4.34Å; A90-A139 HydrophobicContact CB-CB 4.26Å
91	C	96.6	Very high	82.5	Confident	30 Å²	30	58.6 Å²	58.6	20%	0.203	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	149.3	170.7	65.3	0	0	0	0	110.8	F36 P68 Y122 W123 F447	F36-C91 VanDerWaalsContact CD1-SG 3.54Å; P68-C91 VanDerWaalsContact CD-SG 3.56Å; P68-C91 HydrophobicContact CG-CB 4.43Å; C91-Y122 CarbonylContact C-O 3.49Å; C91-Y122 WeakPolarHBondContact CA-O 3.23Å; C91-Y122 WeakPolarHBondContact CB-O 3.24Å; C91-W123 HydrophobicContact CB-CG 4.25Å; C91-F447 HydrophobicContact CB-CE1 4.27Å; C91-F447 HydrophobicContact CB-CZ 4.14Å
92	G	93.1	Very high	81.5	Confident	22 Å²	22	58.7 Å²	58.7	23%	0.227	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	172.5	-179	0	0	0	0	0	113.4	Y122	G92-Y122 PolarHBondContact N-O 3.42Å; G92-Y122 PolarHBondContact O-N 3.32Å
93	K	90.5	Very high	80.2	Confident	160 Å²	160	64 Å²	64	70%	0.696	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.1	164.1	-67.2	-172.4	176.4	-173.7	0	108.8	G120	K93-G120 WeakPolarHBondContact CA-O 3.27Å
94	L	88.3	Confident	78.5	Confident	9 Å²	9	62 Å²	62	5%	0.047	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.4	167.8	-68.1	173.3	0	0	0	108	T119 G120 L146 V224	L94-T119 CarbonylContact O-C 3.47Å; L94-T119 VanDerWaalsContact O-CA 3.32Å; L94-T119 WeakPolarHBondContact O-CA 3.47Å; L94-G120 PolarHBondContact N-O 3.5Å; L94-G120 PolarHBondContact O-N 2.85Å; L94-L146 HydrophobicContact CD1-CD2 4.13Å; L94-V224 HydrophobicContact CD1-CG1 3.75Å
95	C	88.6	Confident	76.6	Confident	60 Å²	60	67.9 Å²	67.9	41%	0.405	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.7	169.6	-58.6	0	0	0	0	107	F117	C95-F117 HydrophobicContact CB-CD1 4.13Å
96	I	87.9	Confident	74.2	Confident	0 Å²	0	75 Å²	75	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.1	-175.8	-56.9	156.9	0	0	0	107.1	F117 L118 L150 E151 V154 L226	I96-F117 WeakPolarHBondContact O-CA 3.4Å; I96-L118 HydrophobicContact CB-CB 4.21Å; I96-L118 WeakPolarHBondContact CB-O 3.28Å; I96-L118 HydrophobicContact CD1-CB 4.39Å; I96-L118 HydrophobicContact CD1-CD2 4.09Å; I96-L118 HydrophobicContact CD1-CG 4.29Å; I96-L118 PolarHBondContact N-O 3.1Å; I96-L118 PolarHBondContact O-N 3Å; I96-L150 HydrophobicContact CD1-CB 3.96Å; I96-L150 HydrophobicContact CD1-CD1 3.76Å; I96-L150 HydrophobicContact CD1-CG 4.39Å; I96-L150 HydrophobicContact CG1-CB 4.06Å; I96-L150 HydrophobicContact CG1-CD1 4.26Å; I96-L150 HydrophobicContact CG2-CB 4.15Å; I96-E151 HydrophobicContact CG2-CG 3.88Å; I96-V154 HydrophobicContact CG2-CB 3.89Å; I96-V154 HydrophobicContact CG2-CG1 4.47Å; I96-V154 HydrophobicContact CG2-CG2 3.84Å; I96-L226 HydrophobicContact CD1-CD1 3.8Å; I96-L226 HydrophobicContact CD1-CD2 4.03Å
97	R	84.1	Confident	71.5	Confident	135 Å²	135	80.1 Å²	80.1	51%	0.509	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-74.7	132.4	178.1	-171.1	177.6	179.8	-172.1	0.1	110	C99 F117 E151	R97-C99 PolarHBondContact O-N 2.7Å; R97-F117 HydrophobicContact CB-CD1 4.32Å; R97-F117 HydrophobicContact CB-CE1 3.97Å; R97-F117 HydrophobicContact CG-CE1 4.26Å; R97-E151 HydrophobicContact CB-CG 4.48Å
98	R	75.1	Confident	69.1	Low	92 Å²	92	88.7 Å²	88.7	35%	0.347	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-76.4	118.7	166.8	-65.6	178.7	-175	-165	-6.6	108.7	E116 V154	R98-E116 WeakPolarHBondContact CD-O 3.4Å; R98-E116 VanDerWaalsContact CG-O 3.31Å; R98-E116 WeakPolarHBondContact CG-O 3.42Å; R98-E116 IonicContact CZ-OE2 2.69Å; R98-E116 PolarHBondContact NE-O 2.82Å; R98-E116 VanDerWaalsContact NE-O 3.14Å; R98-E116 IonicContact NH1-OE2 3.56Å; R98-E116 PolarHBondContact NH1-OE2 2.95Å; R98-V154 HydrophobicContact CG-CG2 4.24Å
99	C	59.4	Low	66.3	Low	61 Å²	61	99.9 Å²	99.9	41%	0.412	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-99.3	121.5	166.5	-71.9	0	0	0	0	107	R97 E155	R97-C99 PolarHBondContact O-N 2.7Å; C99-E155 VanDerWaalsContact O-CG 3.23Å; C99-E155 WeakPolarHBondContact O-CG 3.34Å
100	L	52.7	Low	63.2	Low	147 Å²	147	105.3 Å²	105.3	77%	0.77	54%	0.539	S	S	*	.			trans	-86.6	112.8	174	-68.8	169.7	0	0	0	109.1	G102 E155	L100-G102 PolarHBondContact O-N 3.19Å; L100-E155 VanDerWaalsContact CA-OE1 3.27Å; L100-E155 WeakPolarHBondContact CA-OE1 3.31Å
101	F	43.5	Very low	60.1	Low	180 Å²	180	109.7 Å²	109.7	79%	0.789	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	118.6	169.1	-88.7	-87.2	0	0	0	109.9	E155	F101-E155 WeakPolarHBondContact CD2-OE2 3.25Å; F101-E155 PolarHBondContact N-OE1 2.91Å
102	G	48.2	Very low	57.5	Low	74 Å²	74	115 Å²	115	76%	0.763	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	136.7	-1.6	169.9	0	0	0	0	0	117.6	L100	L100-G102 PolarHBondContact O-N 3.19Å
103	I	43	Very low	54.9	Low	136 Å²	136	118.9 Å²	118.9	70%	0.697	62%	0.618	S	S	*	*			trans	-105.5	89.9	166.7	-47.6	178.5	0	0	0	107.1	E105	I103-E105 PolarHBondContact O-N 3.44Å
104	A	40.3	Very low	52.6	Low	79 Å²	79	116.8 Å²	116.8	65%	0.653	62%	0.621	S	S	*	*			trans	-58.7	127.4	172.7	0	0	0	0	0	110.3	D106	A104-D106 VanDerWaalsContact C-N 3.29Å; A104-D106 PolarHBondContact O-N 3.48Å
105	E	43.5	Very low	50.9	Low	194 Å²	194	121.7 Å²	121.7	91%	0.907	64%	0.644	S	S	*	*	S	Bend	trans	51.7	-3.9	141	-66.7	-178.1	155.1	0	0	122.5	I103	I103-E105 PolarHBondContact O-N 3.44Å
106	D	39.4	Very low	49.8	Very low	151 Å²	151	125.1 Å²	125.1	81%	0.807	65%	0.654	S	S	*	*			trans	-122.4	32.4	-170.1	-87.3	-20.4	0	0	0	116.6	A104	A104-D106 VanDerWaalsContact C-N 3.29Å; A104-D106 PolarHBondContact O-N 3.48Å
107	Q	38.5	Very low	49.2	Very low	135 Å²	135	129 Å²	129	63%	0.631	67%	0.671	S	S	*	*			trans	-138.5	60.9	165.2	-70.7	-163.9	-0.6	0	0	113.1	W109	Q107-W109 PolarHBondContact O-N 3.3Å
108	E	45.4	Very low	49.3	Very low	179 Å²	179	123.5 Å²	123.5	84%	0.836	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	117	142.6	-122.8	177.8	-165.8	0	0	106.8
109	W	38.6	Very low	50	Low	237 Å²	237	123.5 Å²	123.5	90%	0.898	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.3	37.7	168.3	-61	76.1	0	0	0	121.9	Q107	Q107-W109 PolarHBondContact O-N 3.3Å
110	L	32.3	Very low	51.5	Low	118 Å²	118	120.8 Å²	120.8	62%	0.618	64%	0.644	S	S	*	*			trans	-135.6	102.4	163	-88.5	152.4	0	0	0	113.1
111	T	32.8	Very low	53.5	Low	105 Å²	105	114.8 Å²	114.8	64%	0.644	61%	0.612	S	S	*	*			trans	73.3	108.8	135	-28.3	0	0	0	0	119.3	C113	T111-C113 PolarHBondContact O-N 3.19Å
112	V	42.2	Very low	56.1	Low	141 Å²	141	106.3 Å²	106.3	86%	0.855	58%	0.575	S	S	*	*			trans	15.7	77.8	140.2	-167.8	0	0	0	0	114.4
113	C	38.8	Very low	58.5	Low	103 Å²	103	102.9 Å²	102.9	70%	0.696	54%	0.539	S	S	*	.			trans	-89.1	120.5	161.5	-68.6	0	0	0	0	106.3	T111 E115	T111-C113 PolarHBondContact O-N 3.19Å; C113-E115 PolarHBondContact O-N 2.94Å
114	P	41.9	Very low	61.1	Low	116 Å²	116	96.4 Å²	96.4	75%	0.753	51%	0.506	S	S	*	.			trans	-62.2	106.9	169	25.4	-27.2	0	0	0	106.4	E116	P114-E116 PolarHBondContact O-N 3.28Å
115	E	52.9	Low	63.9	Low	113 Å²	113	92.7 Å²	92.7	53%	0.528	48%	0.475	S	S	.	.			trans	-60.4	106.1	-175.2	-64.5	-177.8	134.8	0	0	109.2	C113 F117	C113-E115 PolarHBondContact O-N 2.94Å; E115-F117 HydrophobicContact CB-CD2 3.7Å; E115-F117 HydrophobicContact CB-CE2 3.25Å; E115-F117 HydrophobicContact CB-CZ 3.84Å; E115-F117 HydrophobicContact CG-CE2 4.09Å; E115-F117 HydrophobicContact CG-CZ 4.34Å; E115-F117 VanDerWaalsContact O-CD2 3.28Å; E115-F117 WeakPolarHBondContact O-CD2 3.43Å; E115-F117 PolarHBondContact O-N 2.86Å; E115-F117 WeakPolarHBondContact OE2-CE2 3.14Å; E115-F117 WeakPolarHBondContact OE2-CZ 3.31Å
116	E	66.4	Low	66.5	Low	132 Å²	132	83.4 Å²	83.4	62%	0.617	43%	0.431	S	S	*	.			trans	-73.3	75.8	174.8	-71.1	-173	166.1	0	0	109.7	R98 P114 L118	R98-E116 WeakPolarHBondContact CD-O 3.4Å; R98-E116 VanDerWaalsContact CG-O 3.31Å; R98-E116 WeakPolarHBondContact CG-O 3.42Å; R98-E116 IonicContact CZ-OE2 2.69Å; R98-E116 PolarHBondContact NE-O 2.82Å; R98-E116 VanDerWaalsContact NE-O 3.14Å; R98-E116 IonicContact NH1-OE2 3.56Å; R98-E116 PolarHBondContact NH1-OE2 2.95Å; P114-E116 PolarHBondContact O-N 3.28Å; E116-L118 PolarHBondContact O-N 3.23Å
117	F	74.6	Confident	69.3	Low	81 Å²	81	76.6 Å²	76.6	36%	0.355	40%	0.395	S	S	.	.			trans	-65.4	133.9	172.1	-68.6	-82.2	0	0	0	110.4	C95 I96 R97 E115 T119	C95-F117 HydrophobicContact CB-CD1 4.13Å; I96-F117 WeakPolarHBondContact O-CA 3.4Å; R97-F117 HydrophobicContact CB-CD1 4.32Å; R97-F117 HydrophobicContact CB-CE1 3.97Å; R97-F117 HydrophobicContact CG-CE1 4.26Å; E115-F117 HydrophobicContact CB-CD2 3.7Å; E115-F117 HydrophobicContact CB-CE2 3.25Å; E115-F117 HydrophobicContact CB-CZ 3.84Å; E115-F117 HydrophobicContact CG-CE2 4.09Å; E115-F117 HydrophobicContact CG-CZ 4.34Å; E115-F117 VanDerWaalsContact O-CD2 3.28Å; E115-F117 WeakPolarHBondContact O-CD2 3.43Å; E115-F117 PolarHBondContact O-N 2.86Å; E115-F117 WeakPolarHBondContact OE2-CE2 3.14Å; E115-F117 WeakPolarHBondContact OE2-CZ 3.31Å; F117-T119 HydrophobicContact CB-CG2 4.33Å; F117-T119 PolarHBondContact O-N 2.82Å
118	L	85.6	Confident	72.1	Confident	20 Å²	20	70.1 Å²	70.1	11%	0.105	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122.1	159.8	-177.3	66.7	0	0	0	107.7	I96 E116 V154 M157 L226 Q227	I96-L118 HydrophobicContact CB-CB 4.21Å; I96-L118 WeakPolarHBondContact CB-O 3.28Å; I96-L118 HydrophobicContact CD1-CB 4.39Å; I96-L118 HydrophobicContact CD1-CD2 4.09Å; I96-L118 HydrophobicContact CD1-CG 4.29Å; I96-L118 PolarHBondContact N-O 3.1Å; I96-L118 PolarHBondContact O-N 3Å; E116-L118 PolarHBondContact O-N 3.23Å; L118-V154 HydrophobicContact CB-CG2 4.35Å; L118-V154 HydrophobicContact CD2-CG2 4.33Å; L118-M157 HydrophobicContact CD2-CE 3.94Å; L118-L226 HydrophobicContact CD1-CD1 4.44Å; L118-L226 HydrophobicContact CD2-CD1 3.74Å; L118-L226 HydrophobicContact CD2-CD2 4.35Å; L118-L226 HydrophobicContact CD2-CG 4.17Å; L118-L226 HydrophobicContact CG-CD1 3.75Å; L118-Q227 HydrophobicContact CD1-CG 3.67Å; L118-Q227 HydrophobicContact CD2-CG 4.02Å; L118-Q227 HydrophobicContact CG-CG 4.4Å
119	T	89.2	Confident	74.4	Confident	91 Å²	91	63.5 Å²	63.5	56%	0.558	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.7	-177.9	60.6	0	0	0	0	111.6	L94 F117	L94-T119 CarbonylContact O-C 3.47Å; L94-T119 VanDerWaalsContact O-CA 3.32Å; L94-T119 WeakPolarHBondContact O-CA 3.47Å; F117-T119 HydrophobicContact CB-CG2 4.33Å; F117-T119 PolarHBondContact O-N 2.82Å
120	G	91.5	Very high	77	Confident	4 Å²	4	55 Å²	55	4%	0.041	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	-176.5	177.5	0	0	0	0	0	111.5	K93 L94 S225	K93-G120 WeakPolarHBondContact CA-O 3.27Å; L94-G120 PolarHBondContact N-O 3.5Å; L94-G120 PolarHBondContact O-N 2.85Å; G120-S225 CarbonylContact C-O 3.55Å; G120-S225 WeakPolarHBondContact CA-O 3.31Å
121	H	94.8	Very high	79.9	Confident	21 Å²	21	50.1 Å²	50.1	10%	0.097	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.4	178.1	-63.7	77.9	0	0	0	110.3	W69 W123 V224 S225	W69-H121 AromaticContact CE3-CD2 3.93Å; W69-H121 AromaticContact CE3-CE1 3.13Å; W69-H121 AromaticContact CE3-CG 3.86Å; W69-H121 AromaticContact CE3-ND1 3.34Å; W69-H121 VanDerWaalsContact CE3-ND1 3.34Å; W69-H121 AromaticContact CE3-NE2 3.51Å; W69-H121 AromaticContact CZ3-CE1 3.23Å; W69-H121 WeakPolarHBondContact CZ3-CE1 3.46Å; W69-H121 AromaticContact CZ3-ND1 3.48Å; W69-H121 WeakPolarHBondContact CZ3-ND1 3.33Å; H121-W123 HydrophobicContact CB-CE3 4.31Å; H121-W123 HydrophobicContact CB-CH2 3.16Å; H121-W123 HydrophobicContact CB-CZ2 3.76Å; H121-W123 HydrophobicContact CB-CZ3 3.47Å; H121-W123 VanDerWaalsContact CB-CZ3 3.47Å; H121-W123 AromaticContact CG-CH2 3.97Å; H121-V224 CarbonylContact O-C 3.59Å; H121-V224 VanDerWaalsContact O-CA 3.3Å; H121-V224 WeakPolarHBondContact O-CA 3.31Å; H121-S225 PolarHBondContact N-O 2.72Å; H121-S225 PolarHBondContact O-N 2.72Å
122	Y	97.4	Very high	82.8	Confident	3 Å²	3	46.1 Å²	46.1	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.6	-176.5	174.5	-85.1	0	0	0	109.5	A90 C91 G92 A124 H143 L146 V222 A223 V224	A90-Y122 HydrophobicContact CB-CE1 4.05Å; C91-Y122 CarbonylContact C-O 3.49Å; C91-Y122 WeakPolarHBondContact CA-O 3.23Å; C91-Y122 WeakPolarHBondContact CB-O 3.24Å; G92-Y122 PolarHBondContact N-O 3.42Å; G92-Y122 PolarHBondContact O-N 3.32Å; Y122-A124 HydrophobicContact CE1-CB 3.49Å; Y122-A124 VanDerWaalsContact CE1-CB 3.49Å; Y122-A124 VanDerWaalsContact CZ-CB 3.5Å; Y122-A124 WeakPolarHBondContact OH-CB 3.37Å; Y122-H143 HydrophobicContact CD1-CB 4.14Å; Y122-H143 HydrophobicContact CD2-CB 4.4Å; Y122-H143 HydrophobicContact CE1-CB 3.9Å; Y122-H143 HydrophobicContact CE2-CB 4.13Å; Y122-H143 HydrophobicContact CG-CB 4.4Å; Y122-L146 HydrophobicContact CD2-CD2 3.86Å; Y122-L146 HydrophobicContact CE2-CD2 4.04Å; Y122-V222 HydrophobicContact CD2-CG1 3.85Å; Y122-V222 HydrophobicContact CE2-CG1 3.37Å; Y122-V222 HydrophobicContact CE2-CG2 4.42Å; Y122-A223 WeakPolarHBondContact CA-O 3.11Å; Y122-V224 HydrophobicContact CD2-CG2 4.13Å
123	W	98.6	Very high	85.4	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.6	168.4	-58.4	-94.2	0	0	0	109	W69 A90 C91 H121 V222 A223 M383 F447 I449	W69-W123 HydrophobicContact CB-CH2 3.87Å; W69-W123 HydrophobicContact CB-CZ2 3.49Å; W69-W123 VanDerWaalsContact CB-CZ2 3.49Å; W69-W123 HydrophobicContact CG-CH2 4.26Å; W69-W123 HydrophobicContact CG-CZ2 4.32Å; A90-W123 CarbonylContact O-C 3.37Å; A90-W123 WeakPolarHBondContact O-CA 3.44Å; C91-W123 HydrophobicContact CB-CG 4.25Å; H121-W123 HydrophobicContact CB-CE3 4.31Å; H121-W123 HydrophobicContact CB-CH2 3.16Å; H121-W123 HydrophobicContact CB-CZ2 3.76Å; H121-W123 HydrophobicContact CB-CZ3 3.47Å; H121-W123 VanDerWaalsContact CB-CZ3 3.47Å; H121-W123 AromaticContact CG-CH2 3.97Å; W123-V222 CarbonylContact O-C 3.59Å; W123-V222 WeakPolarHBondContact O-CA 3.29Å; W123-A223 HydrophobicContact CE3-CB 4.41Å; W123-A223 PolarHBondContact N-O 2.65Å; W123-A223 PolarHBondContact O-N 3.34Å; W123-M383 HydrophobicContact CB-SD 4.29Å; W123-F447 AromaticContact CD1-CD1 3.96Å; W123-F447 AromaticContact CD1-CE1 3.83Å; W123-I449 HydrophobicContact CB-CD1 3.79Å; W123-I449 HydrophobicContact CD2-CD1 3.64Å; W123-I449 HydrophobicContact CD2-CG1 4.12Å; W123-I449 HydrophobicContact CD2-CG2 4.38Å; W123-I449 HydrophobicContact CE3-CD1 3.9Å; W123-I449 HydrophobicContact CE3-CG2 4.4Å; W123-I449 HydrophobicContact CG-CD1 3.58Å; W123-I449 HydrophobicContact CG-CG1 4.1Å; W123-I449 HydrophobicContact CH2-CG2 3.92Å; W123-I449 HydrophobicContact CZ2-CG2 3.96Å; W123-I449 HydrophobicContact CZ3-CG2 4.17Å
124	A	98.8	Very high	88.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	141	178.9	0	0	0	0	0	112.2	A89 A90 Y122 F126 L221 V222 F447	A89-A124 CarbonylContact C-O 3.53Å; A89-A124 WeakPolarHBondContact CA-O 3.49Å; A90-A124 PolarHBondContact N-O 2.93Å; A90-A124 PolarHBondContact O-N 2.81Å; Y122-A124 HydrophobicContact CE1-CB 3.49Å; Y122-A124 VanDerWaalsContact CE1-CB 3.49Å; Y122-A124 VanDerWaalsContact CZ-CB 3.5Å; Y122-A124 WeakPolarHBondContact OH-CB 3.37Å; A124-F126 HydrophobicContact CB-CE1 4.44Å; A124-F126 HydrophobicContact CB-CE2 3.59Å; A124-F126 HydrophobicContact CB-CZ 3.55Å; A124-L221 CarbonylContact C-O 3.56Å; A124-L221 WeakPolarHBondContact CA-O 3.45Å; A124-V222 HydrophobicContact CB-CG2 3.86Å; A124-F447 WeakPolarHBondContact O-CE2 3.33Å
125	L	98.8	Very high	90.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.3	168.2	-66.8	175.8	0	0	0	109.5	Y73 A89 L221 M383 A384 T385 F447	Y73-L125 HydrophobicContact CE2-CD2 3.87Å; A89-L125 HydrophobicContact CB-CD2 3.97Å; L125-L221 PolarHBondContact N-O 3.15Å; L125-L221 PolarHBondContact O-N 2.93Å; L125-M383 HydrophobicContact CD1-CB 3.91Å; L125-M383 WeakPolarHBondContact CD1-O 3.46Å; L125-A384 VanDerWaalsContact CD1-CA 3.46Å; L125-T385 HydrophobicContact CB-CG2 4.42Å; L125-F447 HydrophobicContact CD1-CD2 4.35Å; L125-F447 HydrophobicContact CD2-CD2 3.52Å; L125-F447 HydrophobicContact CD2-CE2 3.69Å; L125-F447 HydrophobicContact CG-CD2 3.77Å; L125-F447 HydrophobicContact CG-CE2 4.2Å
126	F	98.8	Very high	93.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	107.5	177.2	-51.7	-81.9	0	0	0	108.1	D87 Q88 A90 A124 A135 A138 A139 L142 C218 T219 A220	D87-F126 CarbonylContact C-O 3.53Å; D87-F126 VanDerWaalsContact CA-O 3.29Å; D87-F126 WeakPolarHBondContact CA-O 3.22Å; Q88-F126 HydrophobicContact CB-CB 4.34Å; Q88-F126 HydrophobicContact CB-CD2 4.35Å; Q88-F126 PolarHBondContact N-O 2.79Å; Q88-F126 PolarHBondContact O-N 2.83Å; A90-F126 HydrophobicContact CB-CE2 4.34Å; A124-F126 HydrophobicContact CB-CE1 4.44Å; A124-F126 HydrophobicContact CB-CE2 3.59Å; A124-F126 HydrophobicContact CB-CZ 3.55Å; F126-A135 HydrophobicContact CB-CB 3.9Å; F126-A138 HydrophobicContact CD1-CB 3.46Å; F126-A138 VanDerWaalsContact CD1-CB 3.46Å; F126-A138 HydrophobicContact CD2-CB 4.49Å; F126-A138 HydrophobicContact CE1-CB 3.57Å; F126-A138 HydrophobicContact CG-CB 3.94Å; F126-A138 HydrophobicContact CZ-CB 4.14Å; F126-A139 HydrophobicContact CD2-CB 3.85Å; F126-A139 VanDerWaalsContact CE2-CA 3.42Å; F126-A139 HydrophobicContact CE2-CB 3.81Å; F126-L142 HydrophobicContact CE1-CD2 3.7Å; F126-L142 HydrophobicContact CZ-CB 4.29Å; F126-L142 HydrophobicContact CZ-CD2 3.95Å; F126-C218 HydrophobicContact CB-CB 4.42Å; F126-T219 VanDerWaalsContact CA-O 3.31Å; F126-T219 WeakPolarHBondContact CA-O 3.49Å; F126-A220 HydrophobicContact CD1-CB 3.83Å; F126-A220 HydrophobicContact CE1-CB 3.91Å
127	D	98	Very high	94.6	Very high	7 Å²	7	18.5 Å²	18.5	4%	0.037	12%	0.116	C	C	.	.			trans	-86.2	113.3	175.3	-169.2	-27.9	0	0	0	108.7	K81 D87 C218 T219 T385 D386	K81-D127 IonicContact NZ-OD1 3.12Å; D87-D127 WeakPolarHBondContact OD1-CA 3.38Å; D127-C218 CarbonylContact O-C 3.6Å; D127-C218 WeakPolarHBondContact O-CA 3.4Å; D127-C218 WeakPolarHBondContact O-CB 3.25Å; D127-T219 HydrophobicContact CB-CG2 3.97Å; D127-T219 WeakPolarHBondContact CB-OG1 3.43Å; D127-T219 PolarHBondContact N-OG1 2.91Å; D127-T219 VanDerWaalsContact N-OG1 3.1Å; D127-T219 PolarHBondContact O-N 3.26Å; D127-T385 HydrophobicContact CB-CG2 3.83Å; D127-D386 VanDerWaalsContact OD2-OD1 3.08Å
128	G	96.9	Very high	95.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	148.2	-174.2	0	0	0	0	0	113.1	E86	E86-G128 WeakPolarHBondContact CB-O 3.47Å; E86-G128 WeakPolarHBondContact O-CA 3.25Å; E86-G128 PolarHBondContact O-N 3.17Å
129	H	94.4	Very high	96.4	Very high	39 Å²	39	14.1 Å²	14.1	18%	0.181	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.8	169.9	61.7	-98.6	0	0	0	112	E86 G216 G217 D343	E86-H129 VanDerWaalsContact OE2-CA 3.27Å; E86-H129 WeakPolarHBondContact OE2-CA 3.49Å; H129-G216 VanDerWaalsContact O-CA 3.24Å; H129-G216 WeakPolarHBondContact O-CA 3.3Å; H129-G217 VanDerWaalsContact CE1-C 3.47Å; H129-G217 PolarHBondContact N-O 3.25Å; H129-G217 PolarHBondContact O-N 3.24Å; H129-D343 IonicContact CD2-OD1 3.91Å; H129-D343 IonicContact CD2-OD2 3.84Å; H129-D343 IonicContact CE1-OD2 3.65Å; H129-D343 PolarHBondContact CE1-OD2 2.84Å; H129-D343 IonicContact NE2-OD1 3.43Å; H129-D343 PolarHBondContact NE2-OD1 3.31Å; H129-D343 IonicContact NE2-OD2 2.69Å; H129-D343 PolarHBondContact NE2-OD2 3.47Å
130	G	92.7	Very high	96.7	Very high	58 Å²	58	11.7 Å²	11.7	60%	0.598	8%	0.081	S	C	*	.	S	Bend	trans	70.9	23.8	-173.6	0	0	0	0	0	112.4	E86	E86-G130 PolarHBondContact OE2-N 2.95Å
131	G	92.7	Very high	97	Very high	16 Å²	16	12.9 Å²	12.9	17%	0.165	9%	0.087	C	C	.	.	S	Bend	trans	110.7	160.5	-177.9	0	0	0	0	0	113.4	E86 A133	E86-G131 WeakPolarHBondContact OE1-CA 3.35Å; E86-G131 PolarHBondContact OE1-N 3.49Å; E86-G131 PolarHBondContact OE2-N 3.39Å; G131-A133 VanDerWaalsContact C-N 3.29Å; G131-A133 PolarHBondContact O-N 2.85Å
132	P	94.3	Very high	97.2	Very high	22 Å²	22	12 Å²	12	14%	0.143	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-6.4	-171.4	31.8	-37.6	0	0	0	114.4	Y31 A134 A135 I136	Y31-P132 HydrophobicContact CD2-CB 3.93Å; Y31-P132 HydrophobicContact CD2-CG 3.76Å; Y31-P132 HydrophobicContact CE2-CB 4.25Å; Y31-P132 HydrophobicContact CE2-CG 4.45Å; P132-A134 PolarHBondContact O-N 2.83Å; P132-A135 PolarHBondContact O-N 2.93Å; P132-I136 HydrophobicContact CB-CD1 4.03Å; P132-I136 HydrophobicContact CG-CD1 4.41Å; P132-I136 WeakPolarHBondContact O-CB 3.36Å; P132-I136 VanDerWaalsContact O-CG1 3.28Å; P132-I136 WeakPolarHBondContact O-CG1 3.1Å; P132-I136 PolarHBondContact O-N 2.82Å
133	A	96.8	Very high	97.2	Very high	3 Å²	3	14.2 Å²	14.2	3%	0.025	9%	0.094	C	C	.	.	H	α-helix	trans	-64.8	-42.2	-166.5	0	0	0	0	0	113	V29 G131 I136 L137 L209	V29-A133 HydrophobicContact CB-CB 4.18Å; G131-A133 VanDerWaalsContact C-N 3.29Å; G131-A133 PolarHBondContact O-N 2.85Å; A133-I136 PolarHBondContact O-N 2.9Å; A133-L137 VanDerWaalsContact O-CG 3.32Å; A133-L137 WeakPolarHBondContact O-CG 3.2Å; A133-L137 PolarHBondContact O-N 3.37Å; A133-L209 HydrophobicContact CB-CD2 3.69Å
134	A	98	Very high	97	Very high	0 Å²	0	16 Å²	16	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.2	-47.6	178.3	0	0	0	0	0	111.6	P132 I136 L137 A138 I205 L209 C218	P132-A134 PolarHBondContact O-N 2.83Å; A134-I136 VanDerWaalsContact C-N 3.32Å; A134-I136 PolarHBondContact O-N 2.9Å; A134-L137 PolarHBondContact O-N 2.96Å; A134-A138 WeakPolarHBondContact O-CB 3.48Å; A134-A138 PolarHBondContact O-N 3.32Å; A134-I205 HydrophobicContact CB-CG2 4.25Å; A134-L209 HydrophobicContact CB-CD1 4.17Å; A134-C218 HydrophobicContact CB-CB 4.43Å
135	A	98.4	Very high	97	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.4	-39.7	176.9	0	0	0	0	0	111.9	E86 Q88 F126 P132 A138 A139 C218	E86-A135 WeakPolarHBondContact O-CB 3.5Å; Q88-A135 HydrophobicContact CB-CB 3.98Å; Q88-A135 HydrophobicContact CG-CB 3.8Å; F126-A135 HydrophobicContact CB-CB 3.9Å; P132-A135 PolarHBondContact O-N 2.93Å; A135-A138 PolarHBondContact O-N 2.98Å; A135-A139 WeakPolarHBondContact O-CB 3.05Å; A135-A139 PolarHBondContact O-N 3.44Å; A135-C218 HydrophobicContact CB-CB 3.91Å
136	I	98.1	Very high	97	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-62.7	-46.4	175.4	-76	168.4	0	0	0	111.4	V29 Y31 H32 Q88 P132 A133 A134 N140	V29-I136 HydrophobicContact CG1-CB 4.19Å; V29-I136 HydrophobicContact CG1-CG2 3.51Å; Y31-I136 HydrophobicContact CD2-CD1 4.06Å; H32-I136 WeakPolarHBondContact CE1-CG2 3.29Å; Q88-I136 HydrophobicContact CG-CG1 3.78Å; P132-I136 HydrophobicContact CB-CD1 4.03Å; P132-I136 HydrophobicContact CG-CD1 4.41Å; P132-I136 WeakPolarHBondContact O-CB 3.36Å; P132-I136 VanDerWaalsContact O-CG1 3.28Å; P132-I136 WeakPolarHBondContact O-CG1 3.1Å; P132-I136 PolarHBondContact O-N 2.82Å; A133-I136 PolarHBondContact O-N 2.9Å; A134-I136 VanDerWaalsContact C-N 3.32Å; A134-I136 PolarHBondContact O-N 2.9Å; I136-N140 WeakPolarHBondContact O-CB 3.23Å; I136-N140 PolarHBondContact O-N 3.37Å; I136-N140 VanDerWaalsContact O-N 3.13Å; I136-N140 PolarHBondContact O-ND2 2.9Å
137	L	98.4	Very high	96.8	Very high	20 Å²	20	21.4 Å²	21.4	11%	0.105	13%	0.127	C	C	.	.	H	α-helix	trans	-64.6	-41.5	177.5	-72	170.3	0	0	0	111.2	V29 A133 A134 N140 T141 I205 E208 L209	V29-L137 HydrophobicContact CG1-CG 4.45Å; V29-L137 HydrophobicContact CG2-CD1 4.08Å; V29-L137 HydrophobicContact CG2-CD2 4.01Å; V29-L137 HydrophobicContact CG2-CG 4.07Å; A133-L137 VanDerWaalsContact O-CG 3.32Å; A133-L137 WeakPolarHBondContact O-CG 3.2Å; A133-L137 PolarHBondContact O-N 3.37Å; A134-L137 PolarHBondContact O-N 2.96Å; L137-N140 PolarHBondContact O-N 3.1Å; L137-T141 WeakPolarHBondContact O-CB 3.47Å; L137-T141 PolarHBondContact O-N 3.39Å; L137-T141 PolarHBondContact O-OG1 3.43Å; L137-I205 HydrophobicContact CB-CG1 3.83Å; L137-I205 HydrophobicContact CD1-CG2 4.39Å; L137-E208 HydrophobicContact CD1-CB 3.73Å; L137-E208 HydrophobicContact CD2-CB 4.15Å; L137-E208 HydrophobicContact CD2-CG 4.28Å; L137-L209 HydrophobicContact CD1-CD2 3.81Å; L137-L209 HydrophobicContact CD1-CG 3.96Å
138	A	98.7	Very high	96.7	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.4	-48.8	177.1	0	0	0	0	0	111.6	F126 A134 A135 N140 T141 L142 I205 L341	F126-A138 HydrophobicContact CD1-CB 3.46Å; F126-A138 VanDerWaalsContact CD1-CB 3.46Å; F126-A138 HydrophobicContact CD2-CB 4.49Å; F126-A138 HydrophobicContact CE1-CB 3.57Å; F126-A138 HydrophobicContact CG-CB 3.94Å; F126-A138 HydrophobicContact CZ-CB 4.14Å; A134-A138 WeakPolarHBondContact O-CB 3.48Å; A134-A138 PolarHBondContact O-N 3.32Å; A135-A138 PolarHBondContact O-N 2.98Å; A138-N140 PolarHBondContact O-N 2.86Å; A138-T141 PolarHBondContact O-N 2.86Å; A138-T141 VanDerWaalsContact O-N 3.1Å; A138-L142 WeakPolarHBondContact O-CB 3.34Å; A138-L142 PolarHBondContact O-N 3.1Å; A138-I205 HydrophobicContact CB-CD1 3.9Å; A138-L341 HydrophobicContact CB-CD1 3.92Å
139	A	98.3	Very high	96.7	Very high	8 Å²	8	28.2 Å²	28.2	7%	0.066	16%	0.155	C	C	.	.	H	α-helix	trans	-59.9	-33.2	177.2	0	0	0	0	0	113	Q88 A90 F126 A135 H143	Q88-A139 HydrophobicContact CB-CB 3.98Å; A90-A139 HydrophobicContact CB-CB 4.26Å; F126-A139 HydrophobicContact CD2-CB 3.85Å; F126-A139 VanDerWaalsContact CE2-CA 3.42Å; F126-A139 HydrophobicContact CE2-CB 3.81Å; A135-A139 WeakPolarHBondContact O-CB 3.05Å; A135-A139 PolarHBondContact O-N 3.44Å; A139-H143 PolarHBondContact O-CE1 3.3Å; A139-H143 PolarHBondContact O-ND1 3.49Å
140	N	96.8	Very high	96.7	Very high	41 Å²	41	26.3 Å²	26.3	22%	0.219	15%	0.146	C	C	.	.	H	α-helix	trans	-84.3	-16.7	178.3	-75	-46.8	0	0	0	114.2	H32 R35 I136 L137 A138 H143	H32-N140 PolarHBondContact NE2-ND2 3.35Å; R35-N140 PolarHBondContact NE-OD1 3.1Å; R35-N140 PolarHBondContact NH2-OD1 2.75Å; I136-N140 WeakPolarHBondContact O-CB 3.23Å; I136-N140 PolarHBondContact O-N 3.37Å; I136-N140 VanDerWaalsContact O-N 3.13Å; I136-N140 PolarHBondContact O-ND2 2.9Å; L137-N140 PolarHBondContact O-N 3.1Å; A138-N140 PolarHBondContact O-N 2.86Å; N140-H143 VanDerWaalsContact C-CE1 3.45Å; N140-H143 PolarHBondContact O-CE1 3.13Å
141	T	97.6	Very high	96.6	Very high	28 Å²	28	26.1 Å²	26.1	17%	0.172	13%	0.13	C	C	.	.	H	α-helix	trans	-119.3	-41.7	-167.3	-54.1	0	0	0	0	114	L137 A138 H143 S144 C145 V204	L137-T141 WeakPolarHBondContact O-CB 3.47Å; L137-T141 PolarHBondContact O-N 3.39Å; L137-T141 PolarHBondContact O-OG1 3.43Å; A138-T141 PolarHBondContact O-N 2.86Å; A138-T141 VanDerWaalsContact O-N 3.1Å; T141-H143 PolarHBondContact O-N 3.11Å; T141-S144 WeakPolarHBondContact O-CA 3.45Å; T141-S144 WeakPolarHBondContact O-CB 3.4Å; T141-S144 PolarHBondContact O-N 3.5Å; T141-C145 PolarHBondContact O-N 3.36Å; T141-C145 VanDerWaalsContact O-N 3.11Å; T141-V204 HydrophobicContact CG2-CB 4.2Å; T141-V204 HydrophobicContact CG2-CG1 4Å; T141-V204 HydrophobicContact CG2-CG2 4.32Å
142	L	98.6	Very high	96.5	Very high	2 Å²	2	29 Å²	29	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-41.6	-165.7	-178.3	56	0	0	0	113.4	F126 A138 S144 C145 L146 A197 F198 C201 V222	F126-L142 HydrophobicContact CE1-CD2 3.7Å; F126-L142 HydrophobicContact CZ-CB 4.29Å; F126-L142 HydrophobicContact CZ-CD2 3.95Å; A138-L142 WeakPolarHBondContact O-CB 3.34Å; A138-L142 PolarHBondContact O-N 3.1Å; L142-S144 PolarHBondContact O-N 3.25Å; L142-C145 PolarHBondContact O-N 3.32Å; L142-L146 WeakPolarHBondContact O-CB 3.32Å; L142-L146 PolarHBondContact O-N 2.88Å; L142-A197 HydrophobicContact CD1-CB 4.26Å; L142-F198 HydrophobicContact CD1-CD2 3.84Å; L142-F198 HydrophobicContact CD1-CE2 4.26Å; L142-F198 HydrophobicContact CD1-CG 4.33Å; L142-F198 HydrophobicContact CD2-CD2 4.21Å; L142-F198 HydrophobicContact CD2-CE2 3.87Å; L142-F198 HydrophobicContact CD2-CZ 4.08Å; L142-C201 HydrophobicContact CB-CB 4.36Å; L142-C201 HydrophobicContact CD1-CB 3.68Å; L142-V222 HydrophobicContact CD2-CG2 3.61Å
143	H	97.2	Very high	96.3	Very high	51 Å²	51	29.7 Å²	29.7	24%	0.236	16%	0.155	C	C	.	.	H	α-helix	trans	-60.7	-32.9	176.4	63.9	-87	0	0	0	112.8	Y122 A139 N140 T141 R147	Y122-H143 HydrophobicContact CD1-CB 4.14Å; Y122-H143 HydrophobicContact CD2-CB 4.4Å; Y122-H143 HydrophobicContact CE1-CB 3.9Å; Y122-H143 HydrophobicContact CE2-CB 4.13Å; Y122-H143 HydrophobicContact CG-CB 4.4Å; A139-H143 PolarHBondContact O-CE1 3.3Å; A139-H143 PolarHBondContact O-ND1 3.49Å; N140-H143 VanDerWaalsContact C-CE1 3.45Å; N140-H143 PolarHBondContact O-CE1 3.13Å; T141-H143 PolarHBondContact O-N 3.11Å; H143-R147 PolarHBondContact O-N 3.45Å
144	S	95.9	Very high	95.8	Very high	39 Å²	39	29.6 Å²	29.6	27%	0.273	16%	0.155	S	C	.	.	H	α-helix	trans	-77.5	-35.5	178.5	-69.3	0	0	0	0	112	T141 L142 R148	T141-S144 WeakPolarHBondContact O-CA 3.45Å; T141-S144 WeakPolarHBondContact O-CB 3.4Å; T141-S144 PolarHBondContact O-N 3.5Å; L142-S144 PolarHBondContact O-N 3.25Å; S144-R148 PolarHBondContact O-N 3.39Å
145	C	98.2	Very high	95.1	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.014	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-49.9	168.6	-60.8	0	0	0	0	110.2	T141 L142 R147 R148 Q149 A197 E200	T141-C145 PolarHBondContact O-N 3.36Å; T141-C145 VanDerWaalsContact O-N 3.11Å; L142-C145 PolarHBondContact O-N 3.32Å; C145-R147 PolarHBondContact O-N 3.49Å; C145-R148 PolarHBondContact O-N 2.99Å; C145-R148 VanDerWaalsContact O-N 3.16Å; C145-Q149 WeakPolarHBondContact O-CG 3.47Å; C145-Q149 PolarHBondContact O-N 3.47Å; C145-A197 HydrophobicContact CB-CB 3.97Å; C145-E200 HydrophobicContact CB-CB 4.47Å
146	L	98.1	Very high	94.3	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-57.2	-46.6	179.2	177.8	61.7	0	0	0	112.3	L94 Y122 L142 R148 Q149 L150 L194 A197 V224	L94-L146 HydrophobicContact CD1-CD2 4.13Å; Y122-L146 HydrophobicContact CD2-CD2 3.86Å; Y122-L146 HydrophobicContact CE2-CD2 4.04Å; L142-L146 WeakPolarHBondContact O-CB 3.32Å; L142-L146 PolarHBondContact O-N 2.88Å; L146-R148 VanDerWaalsContact C-N 3.33Å; L146-R148 PolarHBondContact O-N 3.47Å; L146-Q149 PolarHBondContact O-N 2.89Å; L146-L150 HydrophobicContact CD1-CD1 3.82Å; L146-L150 HydrophobicContact CD1-CG 3.89Å; L146-L150 HydrophobicContact CD2-CD1 4.36Å; L146-L150 HydrophobicContact CG-CD1 3.76Å; L146-L150 HydrophobicContact CG-CG 4.26Å; L146-L150 WeakPolarHBondContact O-CB 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.03Å; L146-L150 PolarHBondContact O-N 3.14Å; L146-L194 HydrophobicContact CD1-CD2 3.71Å; L146-L194 HydrophobicContact CD1-CG 3.93Å; L146-L194 HydrophobicContact CD2-CD2 4.01Å; L146-L194 HydrophobicContact CG-CD2 4.48Å; L146-A197 HydrophobicContact CB-CB 3.99Å; L146-A197 HydrophobicContact CD1-CB 4.35Å; L146-V224 HydrophobicContact CD2-CG2 3.69Å
147	R	95.8	Very high	93.6	Very high	109 Å²	109	33.5 Å²	33.5	41%	0.411	18%	0.181	S	C	.	.	H	α-helix	trans	-54.5	-49.1	177.2	-176.9	-175.2	64.5	-163.8	-4.4	111.4	H143 C145 Q149 L150 E151	H143-R147 PolarHBondContact O-N 3.45Å; C145-R147 PolarHBondContact O-N 3.49Å; R147-Q149 PolarHBondContact O-N 2.93Å; R147-L150 PolarHBondContact O-N 2.91Å; R147-E151 HydrophobicContact CG-CG 4.37Å; R147-E151 IonicContact NE-OE1 2.74Å; R147-E151 VanDerWaalsContact O-CG 3.28Å; R147-E151 WeakPolarHBondContact O-CG 3.03Å; R147-E151 PolarHBondContact O-N 2.8Å
148	R	94.4	Very high	92.7	Very high	103 Å²	103	34.7 Å²	34.7	39%	0.389	19%	0.189	S	C	.	.	H	α-helix	trans	-63.9	-41	-180	-73.7	-175.1	-64	114.8	-2.5	112.7	S144 C145 L146 L150 E151 A152 E200	S144-R148 PolarHBondContact O-N 3.39Å; C145-R148 PolarHBondContact O-N 2.99Å; C145-R148 VanDerWaalsContact O-N 3.16Å; L146-R148 VanDerWaalsContact C-N 3.33Å; L146-R148 PolarHBondContact O-N 3.47Å; R148-L150 VanDerWaalsContact C-N 3.32Å; R148-E151 PolarHBondContact O-N 3.17Å; R148-A152 PolarHBondContact O-N 3.21Å; R148-A152 VanDerWaalsContact O-N 3.1Å; R148-E200 IonicContact CZ-OE1 3.25Å; R148-E200 IonicContact CZ-OE2 3.63Å; R148-E200 IonicContact NH1-OE1 3.5Å; R148-E200 PolarHBondContact NH1-OE1 2.98Å; R148-E200 IonicContact NH1-OE2 3.98Å; R148-E200 PolarHBondContact NH1-OE2 2.83Å; R148-E200 IonicContact NH2-OE1 3.78Å; R148-E200 PolarHBondContact NH2-OE1 3.03Å; R148-E200 IonicContact NH2-OE2 2.66Å; R148-E200 PolarHBondContact NH2-OE2 3.07Å; R148-E200 VanDerWaalsContact NH2-OE2 3.15Å
149	Q	96.6	Very high	91.6	Very high	47 Å²	47	36.8 Å²	36.8	22%	0.22	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-38.6	176.8	-62.6	-60.7	-27.5	0	0	111.3	C145 L146 R147 A152 V153 A193 A197 E200	C145-Q149 WeakPolarHBondContact O-CG 3.47Å; C145-Q149 PolarHBondContact O-N 3.47Å; L146-Q149 PolarHBondContact O-N 2.89Å; R147-Q149 PolarHBondContact O-N 2.93Å; Q149-A152 PolarHBondContact O-N 2.82Å; Q149-V153 PolarHBondContact O-N 3.06Å; Q149-A193 HydrophobicContact CB-CB 3.79Å; Q149-A193 WeakPolarHBondContact CB-O 3.32Å; Q149-A197 HydrophobicContact CG-CB 4.11Å; Q149-E200 PolarHBondContact NE2-OE2 3.06Å
150	L	94.5	Very high	90.3	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-68.3	-41.1	174.8	-70.8	172.1	0	0	0	112.4	I96 L146 R147 R148 A152 V153 V154 V190 A193 L226	I96-L150 HydrophobicContact CD1-CB 3.96Å; I96-L150 HydrophobicContact CD1-CD1 3.76Å; I96-L150 HydrophobicContact CD1-CG 4.39Å; I96-L150 HydrophobicContact CG1-CB 4.06Å; I96-L150 HydrophobicContact CG1-CD1 4.26Å; I96-L150 HydrophobicContact CG2-CB 4.15Å; L146-L150 HydrophobicContact CD1-CD1 3.82Å; L146-L150 HydrophobicContact CD1-CG 3.89Å; L146-L150 HydrophobicContact CD2-CD1 4.36Å; L146-L150 HydrophobicContact CG-CD1 3.76Å; L146-L150 HydrophobicContact CG-CG 4.26Å; L146-L150 WeakPolarHBondContact O-CB 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.03Å; L146-L150 PolarHBondContact O-N 3.14Å; R147-L150 PolarHBondContact O-N 2.91Å; R148-L150 VanDerWaalsContact C-N 3.32Å; L150-A152 PolarHBondContact O-N 3.03Å; L150-V153 PolarHBondContact O-N 3.28Å; L150-V153 VanDerWaalsContact O-N 3.1Å; L150-V154 WeakPolarHBondContact O-CB 3.28Å; L150-V154 PolarHBondContact O-N 2.74Å; L150-V190 HydrophobicContact CD2-CG1 4.22Å; L150-V190 HydrophobicContact CD2-CG2 4.3Å; L150-A193 HydrophobicContact CD2-CB 3.8Å; L150-A193 HydrophobicContact CG-CB 4.22Å; L150-L226 HydrophobicContact CD1-CD2 4.35Å; L150-L226 HydrophobicContact CD2-CD2 4.27Å
151	E	91.8	Very high	88.8	Confident	54 Å²	54	48.1 Å²	48.1	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-33.3	174.4	-74.2	168.5	164.8	0	0	111.8	I96 R97 R147 R148 V153 V154	I96-E151 HydrophobicContact CG2-CG 3.88Å; R97-E151 HydrophobicContact CB-CG 4.48Å; R147-E151 HydrophobicContact CG-CG 4.37Å; R147-E151 IonicContact NE-OE1 2.74Å; R147-E151 VanDerWaalsContact O-CG 3.28Å; R147-E151 WeakPolarHBondContact O-CG 3.03Å; R147-E151 PolarHBondContact O-N 2.8Å; R148-E151 PolarHBondContact O-N 3.17Å; E151-V153 VanDerWaalsContact C-N 3.33Å; E151-V153 PolarHBondContact O-N 2.85Å; E151-V154 WeakPolarHBondContact O-CG1 3.46Å
152	A	90.1	Very high	87.5	Confident	76 Å²	76	48.1 Å²	48.1	63%	0.628	27%	0.266	S	S	*	.	H	α-helix	trans	-72.3	-23.1	177	0	0	0	0	0	113.9	R148 Q149 L150	R148-A152 PolarHBondContact O-N 3.21Å; R148-A152 VanDerWaalsContact O-N 3.1Å; Q149-A152 PolarHBondContact O-N 2.82Å; L150-A152 PolarHBondContact O-N 3.03Å
153	V	89.4	Confident	85.9	Confident	37 Å²	37	52.5 Å²	52.5	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-114.8	-3.4	-176.4	-55.8	0	0	0	0	113.8	Q149 L150 E151 E155 G156 M157 L189 A193	Q149-V153 PolarHBondContact O-N 3.06Å; L150-V153 PolarHBondContact O-N 3.28Å; L150-V153 VanDerWaalsContact O-N 3.1Å; E151-V153 VanDerWaalsContact C-N 3.33Å; E151-V153 PolarHBondContact O-N 2.85Å; V153-E155 VanDerWaalsContact C-N 3.25Å; V153-E155 PolarHBondContact O-N 3.46Å; V153-G156 WeakPolarHBondContact O-CA 3.26Å; V153-G156 PolarHBondContact O-N 2.92Å; V153-M157 HydrophobicContact CG2-SD 4.09Å; V153-M157 PolarHBondContact O-N 2.85Å; V153-L189 HydrophobicContact CB-CB 4.22Å; V153-L189 HydrophobicContact CG2-CB 4.18Å; V153-A193 HydrophobicContact CG2-CB 4.27Å
154	V	87.6	Confident	84.2	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-58.2	-36.1	-173	68.8	0	0	0	0	112.6	I96 R98 L118 L150 E151 G156 M157 V158	I96-V154 HydrophobicContact CG2-CB 3.89Å; I96-V154 HydrophobicContact CG2-CG1 4.47Å; I96-V154 HydrophobicContact CG2-CG2 3.84Å; R98-V154 HydrophobicContact CG-CG2 4.24Å; L118-V154 HydrophobicContact CB-CG2 4.35Å; L118-V154 HydrophobicContact CD2-CG2 4.33Å; L150-V154 WeakPolarHBondContact O-CB 3.28Å; L150-V154 PolarHBondContact O-N 2.74Å; E151-V154 WeakPolarHBondContact O-CG1 3.46Å; V154-G156 VanDerWaalsContact C-N 3.3Å; V154-G156 PolarHBondContact O-N 2.84Å; V154-M157 WeakPolarHBondContact O-CB 3.5Å; V154-M157 PolarHBondContact O-N 2.8Å; V154-V158 HydrophobicContact CG2-CG1 4.44Å; V154-V158 WeakPolarHBondContact O-CG2 3.49Å; V154-V158 PolarHBondContact O-N 3.03Å; V154-V158 VanDerWaalsContact O-N 3.16Å
155	E	82.6	Confident	82.2	Confident	35 Å²	35	58.2 Å²	58.2	16%	0.164	32%	0.319	C	S	.	.	H	α-helix	trans	-59	-43.5	174.8	-68.2	-169.8	139.4	0	0	111.4	C99 L100 F101 V153 M157 V158 A159	C99-E155 VanDerWaalsContact O-CG 3.23Å; C99-E155 WeakPolarHBondContact O-CG 3.34Å; L100-E155 VanDerWaalsContact CA-OE1 3.27Å; L100-E155 WeakPolarHBondContact CA-OE1 3.31Å; F101-E155 WeakPolarHBondContact CD2-OE2 3.25Å; F101-E155 PolarHBondContact N-OE1 2.91Å; V153-E155 VanDerWaalsContact C-N 3.25Å; V153-E155 PolarHBondContact O-N 3.46Å; E155-M157 PolarHBondContact O-N 3.24Å; E155-M157 VanDerWaalsContact O-N 3.14Å; E155-V158 PolarHBondContact O-N 3.24Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.23Å
156	G	81.7	Confident	80	Confident	29 Å²	29	61.9 Å²	61.9	30%	0.299	34%	0.338	S	S	.	.	H	α-helix	trans	-60.3	-22.1	176.1	0	0	0	0	0	114.1	V153 V154 L189	V153-G156 WeakPolarHBondContact O-CA 3.26Å; V153-G156 PolarHBondContact O-N 2.92Å; V154-G156 VanDerWaalsContact C-N 3.3Å; V154-G156 PolarHBondContact O-N 2.84Å; G156-L189 VanDerWaalsContact C-CD1 3.4Å; G156-L189 WeakPolarHBondContact O-CD1 3.33Å
157	M	82.8	Confident	77.9	Confident	19 Å²	19	64.6 Å²	64.6	9%	0.094	36%	0.358	C	S	.	.	H	α-helix	trans	-94	-28	-177.5	-59.7	169.3	55.8	0	0	113.5	L118 V153 V154 E155 A186 L189 V190 L226	L118-M157 HydrophobicContact CD2-CE 3.94Å; V153-M157 HydrophobicContact CG2-SD 4.09Å; V153-M157 PolarHBondContact O-N 2.85Å; V154-M157 WeakPolarHBondContact O-CB 3.5Å; V154-M157 PolarHBondContact O-N 2.8Å; E155-M157 PolarHBondContact O-N 3.24Å; E155-M157 VanDerWaalsContact O-N 3.14Å; M157-A186 HydrophobicContact CB-CB 4.43Å; M157-A186 HydrophobicContact CG-CB 4.48Å; M157-L189 HydrophobicContact CG-CB 4.26Å; M157-L189 HydrophobicContact CG-CD1 3.95Å; M157-V190 HydrophobicContact CE-CG2 3.37Å; M157-V190 HydrophobicContact SD-CG2 3.76Å; M157-L226 HydrophobicContact CE-CD2 3.81Å; M157-L226 HydrophobicContact CE-CG 4.47Å
158	V	80.8	Confident	76	Confident	46 Å²	46	61.8 Å²	61.8	28%	0.279	36%	0.362	S	S	.	.	H	α-helix	trans	-122.7	-20.9	-169.4	-52.6	0	0	0	0	114.3	V154 E155	V154-V158 HydrophobicContact CG2-CG1 4.44Å; V154-V158 WeakPolarHBondContact O-CG2 3.49Å; V154-V158 PolarHBondContact O-N 3.03Å; V154-V158 VanDerWaalsContact O-N 3.16Å; E155-V158 PolarHBondContact O-N 3.24Å
159	A	75.3	Confident	74.2	Confident	44 Å²	44	66.9 Å²	66.9	36%	0.364	38%	0.382	S	S	.	.			trans	-69.1	141.4	-177.5	0	0	0	0	0	110.7	E155 Q161 P162	E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.23Å; A159-Q161 PolarHBondContact O-N 3.02Å; A159-P162 HydrophobicContact CB-CB 4.48Å
160	T	70.4	Confident	72.5	Confident	139 Å²	139	67 Å²	67	85%	0.853	39%	0.387	S	S	*	.	S	Bend	trans	-63.7	-28.3	169.7	51.8	0	0	0	0	111.6
161	Q	65.9	Low	71.3	Confident	147 Å²	147	69.8 Å²	69.8	69%	0.687	40%	0.404	S	S	*	.	S	Bend	trans	-136.8	85.4	176.2	-63	-171.1	-15.6	0	0	111	A159	A159-Q161 PolarHBondContact O-N 3.02Å
162	P	70.1	Confident	70.4	Confident	28 Å²	28	70.6 Å²	70.6	18%	0.182	41%	0.414	C	S	.	.			trans	-68.7	156.3	-179.9	29.8	-35.7	0	0	0	112	A159 M164 H165	A159-P162 HydrophobicContact CB-CB 4.48Å; P162-M164 CarbonylContact O-C 3.51Å; P162-M164 PolarHBondContact O-N 2.9Å; P162-H165 PolarHBondContact O-N 2.93Å
163	P	64.3	Low	69.7	Low	94 Å²	94	73.4 Å²	73.4	61%	0.61	43%	0.429	S	S	*	.	S	Bend	trans	-53.8	129.4	173.8	-22	31.4	0	0	0	110.6
164	M	61.4	Low	69.5	Low	150 Å²	150	76.5 Å²	76.5	74%	0.739	45%	0.453	S	S	*	.	S	Bend	trans	62	78.8	-164.9	-160	176.5	-62.2	0	0	111.3	P162 L166 C170	P162-M164 CarbonylContact O-C 3.51Å; P162-M164 PolarHBondContact O-N 2.9Å; M164-L166 PolarHBondContact O-N 2.8Å; M164-C170 HydrophobicContact CG-CB 4.25Å; M164-C170 WeakPolarHBondContact CG-SG 3.43Å
165	H	54.7	Low	69.1	Low	60 Å²	60	79.1 Å²	79.1	28%	0.278	47%	0.467	S	S	.	.			trans	-66.6	110.9	-174	-170.4	-90.2	0	0	0	112.1	P162 S167	P162-H165 PolarHBondContact O-N 2.93Å; H165-S167 WeakPolarHBondContact CE1-CB 3.21Å; H165-S167 PolarHBondContact CE1-OG 2.96Å; H165-S167 WeakPolarHBondContact ND1-CB 3.2Å; H165-S167 PolarHBondContact ND1-OG 2.8Å; H165-S167 PolarHBondContact O-N 2.83Å
166	L	51.5	Low	69.1	Low	79 Å²	79	80.6 Å²	80.6	41%	0.414	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	63.2	178.5	-61.2	167.5	0	0	0	112.8	M164 E181 I184	M164-L166 PolarHBondContact O-N 2.8Å; L166-E181 WeakPolarHBondContact CA-OE1 3.33Å; L166-E181 HydrophobicContact CD2-CG 4.25Å; L166-I184 HydrophobicContact CD1-CB 4.04Å; L166-I184 WeakPolarHBondContact CD1-O 3.29Å; L166-I184 HydrophobicContact CD2-CB 4.47Å
167	S	55.4	Low	68.9	Low	60 Å²	60	89 Å²	89	42%	0.42	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	31.2	178.3	81.2	0	0	0	0	114	H165 R169 E181	H165-S167 WeakPolarHBondContact CE1-CB 3.21Å; H165-S167 PolarHBondContact CE1-OG 2.96Å; H165-S167 WeakPolarHBondContact ND1-CB 3.2Å; H165-S167 PolarHBondContact ND1-OG 2.8Å; H165-S167 PolarHBondContact O-N 2.83Å; S167-R169 PolarHBondContact O-N 2.92Å; S167-E181 PolarHBondContact N-OE2 2.91Å
168	G	53.8	Low	68.8	Low	49 Å²	49	96.2 Å²	96.2	51%	0.505	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	9	-178.4	0	0	0	0	0	114.5	E181	G168-E181 WeakPolarHBondContact CA-OE2 3.27Å; G168-E181 PolarHBondContact N-OE2 2.8Å
169	R	57.1	Low	68.8	Low	211 Å²	211	96.8 Å²	96.8	80%	0.796	55%	0.545	S	S	*	.			trans	-88.5	-11.2	178.2	-68.9	-174.7	-175.1	-137	2.5	113.6	S167	S167-R169 PolarHBondContact O-N 2.92Å
170	C	62.4	Low	68.8	Low	50 Å²	50	102.9 Å²	102.9	34%	0.338	57%	0.566	S	S	.	*	S	Bend	trans	-89.8	-10.6	-177.4	-71.6	0	0	0	0	113.9	M164 C172	M164-C170 HydrophobicContact CG-CB 4.25Å; M164-C170 WeakPolarHBondContact CG-SG 3.43Å; C170-C172 PolarHBondContact O-N 3.41Å
171	V	68.8	Low	69.1	Low	57 Å²	57	99.3 Å²	99.3	35%	0.345	54%	0.54	S	S	.	.	S	Bend	trans	-83.4	112.6	170.9	-175.4	0	0	0	0	108.3	D175 V179 E181	V171-D175 WeakPolarHBondContact CA-OD2 3.23Å; V171-D175 HydrophobicContact CG1-CB 4.07Å; V171-V179 HydrophobicContact CG1-CG1 4.34Å; V171-V179 HydrophobicContact CG2-CG1 4.36Å; V171-E181 HydrophobicContact CG2-CB 4.47Å
172	C	72.9	Confident	69.7	Low	71 Å²	71	100.3 Å²	100.3	48%	0.48	54%	0.542	S	S	.	.			trans	-77.2	151.9	177.3	-64.9	0	0	0	0	110.2	C170 S174 D175	C170-C172 PolarHBondContact O-N 3.41Å; C172-S174 WeakPolarHBondContact CB-OG 3.5Å; C172-S174 PolarHBondContact O-N 2.96Å; C172-D175 PolarHBondContact N-OD2 3.21Å; C172-D175 WeakPolarHBondContact O-CB 3.09Å; C172-D175 PolarHBondContact O-N 3.01Å
173	S	75.9	Confident	70.2	Confident	135 Å²	135	102.6 Å²	102.6	94%	0.944	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-16.2	173.2	59.2	0	0	0	0	113.7
174	S	83.3	Confident	71.1	Confident	102 Å²	102	102.1 Å²	102.1	71%	0.713	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-9.4	173.8	53.4	0	0	0	0	113.8	C172	C172-S174 WeakPolarHBondContact CB-OG 3.5Å; C172-S174 PolarHBondContact O-N 2.96Å
175	D	81	Confident	72.3	Confident	57 Å²	57	101.3 Å²	101.3	31%	0.305	55%	0.55	S	S	.	*	S	Bend	trans	-72.8	150.2	-179.3	-68.3	-28	0	0	0	111.1	V171 C172 V179	V171-D175 WeakPolarHBondContact CA-OD2 3.23Å; V171-D175 HydrophobicContact CG1-CB 4.07Å; C172-D175 PolarHBondContact N-OD2 3.21Å; C172-D175 WeakPolarHBondContact O-CB 3.09Å; C172-D175 PolarHBondContact O-N 3.01Å; D175-V179 HydrophobicContact CB-CB 4.1Å; D175-V179 HydrophobicContact CB-CG1 4.35Å; D175-V179 HydrophobicContact CB-CG2 4.15Å
176	P	82.1	Confident	73.9	Confident	65 Å²	65	100.2 Å²	100.2	42%	0.422	55%	0.552	S	S	.	*			trans	-54.3	146	172.6	-23.2	29.6	0	0	0	112.2	F178 V179	P176-F178 HydrophobicContact CB-CD1 3.94Å; P176-F178 HydrophobicContact CB-CE1 3.48Å; P176-F178 VanDerWaalsContact CB-CE1 3.48Å; P176-F178 HydrophobicContact CB-CE2 4.16Å; P176-F178 HydrophobicContact CB-CG 4.46Å; P176-F178 HydrophobicContact CB-CZ 3.6Å; P176-F178 HydrophobicContact CG-CE1 4.46Å; P176-F178 HydrophobicContact CG-CZ 4.18Å; P176-F178 PolarHBondContact O-N 3.4Å; P176-V179 HydrophobicContact CB-CG2 4.04Å; P176-V179 HydrophobicContact CG-CG2 4.07Å; P176-V179 WeakPolarHBondContact O-CB 3.49Å; P176-V179 WeakPolarHBondContact O-CG2 3.38Å; P176-V179 PolarHBondContact O-N 3.34Å
177	H	77.9	Confident	75.8	Confident	205 Å²	205	97.5 Å²	97.5	95%	0.949	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-13	-174.4	-72.1	66.3	0	0	0	114.7
178	F	80.8	Confident	77.6	Confident	171 Å²	171	97.4 Å²	97.4	75%	0.75	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	7.3	177.6	59.3	-97.2	0	0	0	113	P176 E180	P176-F178 HydrophobicContact CB-CD1 3.94Å; P176-F178 HydrophobicContact CB-CE1 3.48Å; P176-F178 VanDerWaalsContact CB-CE1 3.48Å; P176-F178 HydrophobicContact CB-CE2 4.16Å; P176-F178 HydrophobicContact CB-CG 4.46Å; P176-F178 HydrophobicContact CB-CZ 3.6Å; P176-F178 HydrophobicContact CG-CE1 4.46Å; P176-F178 HydrophobicContact CG-CZ 4.18Å; P176-F178 PolarHBondContact O-N 3.4Å; F178-E180 PolarHBondContact O-N 3.15Å
179	V	79.1	Confident	79.5	Confident	58 Å²	58	97.3 Å²	97.3	35%	0.352	52%	0.52	S	S	.	.			trans	-77.8	110.5	174.9	176.4	0	0	0	0	109	V171 D175 P176	V171-V179 HydrophobicContact CG1-CG1 4.34Å; V171-V179 HydrophobicContact CG2-CG1 4.36Å; D175-V179 HydrophobicContact CB-CB 4.1Å; D175-V179 HydrophobicContact CB-CG1 4.35Å; D175-V179 HydrophobicContact CB-CG2 4.15Å; P176-V179 HydrophobicContact CB-CG2 4.04Å; P176-V179 HydrophobicContact CG-CG2 4.07Å; P176-V179 WeakPolarHBondContact O-CB 3.49Å; P176-V179 WeakPolarHBondContact O-CG2 3.38Å; P176-V179 PolarHBondContact O-N 3.34Å
180	E	76.5	Confident	81.4	Confident	172 Å²	172	87.3 Å²	87.3	80%	0.804	48%	0.482	S	S	*	.			trans	-107.3	144.1	170.3	-66.1	-178.5	176.4	0	0	109.8	F178	F178-E180 PolarHBondContact O-N 3.15Å
181	E	76	Confident	83.1	Confident	64 Å²	64	86.5 Å²	86.5	30%	0.299	47%	0.474	S	S	.	.			trans	-68.3	135	173.2	-175.6	166.7	-130.9	0	0	110.2	L166 S167 G168 V171	L166-E181 WeakPolarHBondContact CA-OE1 3.33Å; L166-E181 HydrophobicContact CD2-CG 4.25Å; S167-E181 PolarHBondContact N-OE2 2.91Å; G168-E181 WeakPolarHBondContact CA-OE2 3.27Å; G168-E181 PolarHBondContact N-OE2 2.8Å; V171-E181 HydrophobicContact CG2-CB 4.47Å
182	K	78.5	Confident	84.5	Confident	169 Å²	169	85 Å²	85	74%	0.735	47%	0.47	S	S	*	.			trans	-75.6	133.6	177.4	-66.4	-176.8	180	179.7	0	109.9	I184	K182-I184 VanDerWaalsContact C-N 3.26Å; K182-I184 HydrophobicContact CB-CG1 4.13Å; K182-I184 PolarHBondContact O-N 2.99Å
183	G	79.8	Confident	85.7	Confident	76 Å²	76	81.7 Å²	81.7	78%	0.784	45%	0.448	S	S	*	.			trans	-72.9	74.3	173.3	0	0	0	0	0	112.6
184	I	83.9	Confident	86.8	Confident	83 Å²	83	75.4 Å²	75.4	43%	0.426	40%	0.403	S	S	.	.			trans	-81.2	129	176.6	-58.6	174.2	0	0	0	109	L166 K182 D188	L166-I184 HydrophobicContact CD1-CB 4.04Å; L166-I184 WeakPolarHBondContact CD1-O 3.29Å; L166-I184 HydrophobicContact CD2-CB 4.47Å; K182-I184 VanDerWaalsContact C-N 3.26Å; K182-I184 HydrophobicContact CB-CG1 4.13Å; K182-I184 PolarHBondContact O-N 2.99Å; I184-D188 HydrophobicContact CG2-CB 4.12Å
185	R	86.9	Confident	87.5	Confident	133 Å²	133	74.1 Å²	74.1	50%	0.502	39%	0.386	S	S	.	.			trans	-106.2	160.1	179.7	-61.4	174.4	-64.4	151.6	11.2	110	E187 D188	R185-E187 HydrophobicContact CB-CG 3.9Å; R185-E187 IonicContact CZ-OE1 3.76Å; R185-E187 IonicContact CZ-OE2 2.65Å; R185-E187 IonicContact NE-OE1 3.74Å; R185-E187 IonicContact NH1-OE1 3.38Å; R185-E187 PolarHBondContact NH1-OE1 2.99Å; R185-E187 IonicContact NH1-OE2 2.72Å; R185-E187 PolarHBondContact NH1-OE2 3.49Å; R185-E187 VanDerWaalsContact NH2-CD 3.27Å; R185-E187 IonicContact NH2-OE1 3.92Å; R185-E187 PolarHBondContact NH2-OE1 3.36Å; R185-E187 PolarHBondContact O-N 2.87Å; R185-E187 VanDerWaalsContact O-N 3.15Å; R185-D188 PolarHBondContact N-OD2 2.91Å; R185-D188 IonicContact NE-OD2 2.64Å; R185-D188 IonicContact NH2-OD1 2.65Å; R185-D188 WeakPolarHBondContact O-CB 3.49Å; R185-D188 PolarHBondContact O-N 3.16Å
186	A	87.7	Confident	88.4	Confident	37 Å²	37	73.9 Å²	73.9	31%	0.306	39%	0.389	S	S	.	.	H	α-helix	trans	-56.1	-32.7	175.9	0	0	0	0	0	112.9	M157 D188 L189 V190	M157-A186 HydrophobicContact CB-CB 4.43Å; M157-A186 HydrophobicContact CG-CB 4.48Å; A186-D188 VanDerWaalsContact C-N 3.28Å; A186-D188 PolarHBondContact O-N 2.68Å; A186-L189 WeakPolarHBondContact O-CB 3.48Å; A186-L189 PolarHBondContact O-N 3.21Å; A186-V190 PolarHBondContact O-N 3.37Å
187	E	92.2	Very high	89.2	Confident	23 Å²	23	70.8 Å²	70.8	11%	0.107	37%	0.369	C	S	.	.	H	α-helix	trans	-64.5	-31.1	175.4	63.6	-165.8	-114	0	0	113.1	R185 L189 V190 I191 K229 Y231	R185-E187 HydrophobicContact CB-CG 3.9Å; R185-E187 IonicContact CZ-OE1 3.76Å; R185-E187 IonicContact CZ-OE2 2.65Å; R185-E187 IonicContact NE-OE1 3.74Å; R185-E187 IonicContact NH1-OE1 3.38Å; R185-E187 PolarHBondContact NH1-OE1 2.99Å; R185-E187 IonicContact NH1-OE2 2.72Å; R185-E187 PolarHBondContact NH1-OE2 3.49Å; R185-E187 VanDerWaalsContact NH2-CD 3.27Å; R185-E187 IonicContact NH2-OE1 3.92Å; R185-E187 PolarHBondContact NH2-OE1 3.36Å; R185-E187 PolarHBondContact O-N 2.87Å; R185-E187 VanDerWaalsContact O-N 3.15Å; E187-L189 VanDerWaalsContact C-N 3.27Å; E187-L189 PolarHBondContact O-N 3.24Å; E187-V190 PolarHBondContact O-N 3.26Å; E187-I191 WeakPolarHBondContact O-CG1 3.46Å; E187-I191 PolarHBondContact O-N 3Å; E187-K229 IonicContact OE2-NZ 3.84Å; E187-K229 PolarHBondContact OE2-NZ 3.33Å; E187-Y231 HydrophobicContact CB-CE1 3.92Å
188	D	93.6	Very high	90.2	Very high	57 Å²	57	61.1 Å²	61.1	31%	0.305	32%	0.324	S	S	.	.	H	α-helix	trans	-68.3	-30.5	177.8	-55.4	-43.2	0	0	0	111	I184 R185 A186 G192	I184-D188 HydrophobicContact CG2-CB 4.12Å; R185-D188 PolarHBondContact N-OD2 2.91Å; R185-D188 IonicContact NE-OD2 2.64Å; R185-D188 IonicContact NH2-OD1 2.65Å; R185-D188 WeakPolarHBondContact O-CB 3.49Å; R185-D188 PolarHBondContact O-N 3.16Å; A186-D188 VanDerWaalsContact C-N 3.28Å; A186-D188 PolarHBondContact O-N 2.68Å; D188-G192 PolarHBondContact O-N 3.35Å
189	L	94	Very high	91	Very high	48 Å²	48	54.8 Å²	54.8	25%	0.251	30%	0.297	S	S	.	.	H	α-helix	trans	-68.4	-42.4	172.6	-60.1	176.8	0	0	0	111.7	V153 G156 M157 A186 E187 G192 A193	V153-L189 HydrophobicContact CB-CB 4.22Å; V153-L189 HydrophobicContact CG2-CB 4.18Å; G156-L189 VanDerWaalsContact C-CD1 3.4Å; G156-L189 WeakPolarHBondContact O-CD1 3.33Å; M157-L189 HydrophobicContact CG-CB 4.26Å; M157-L189 HydrophobicContact CG-CD1 3.95Å; A186-L189 WeakPolarHBondContact O-CB 3.48Å; A186-L189 PolarHBondContact O-N 3.21Å; E187-L189 VanDerWaalsContact C-N 3.27Å; E187-L189 PolarHBondContact O-N 3.24Å; L189-G192 PolarHBondContact O-N 3Å; L189-A193 WeakPolarHBondContact O-CB 3.34Å; L189-A193 PolarHBondContact O-N 3.16Å
190	V	96.4	Very high	91.9	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-40.4	176.8	179.9	0	0	0	0	110.9	L150 M157 A186 E187 A193 L194 L226 Y231	L150-V190 HydrophobicContact CD2-CG1 4.22Å; L150-V190 HydrophobicContact CD2-CG2 4.3Å; M157-V190 HydrophobicContact CE-CG2 3.37Å; M157-V190 HydrophobicContact SD-CG2 3.76Å; A186-V190 PolarHBondContact O-N 3.37Å; E187-V190 PolarHBondContact O-N 3.26Å; V190-A193 PolarHBondContact O-N 2.97Å; V190-L194 HydrophobicContact CG1-CD1 4.24Å; V190-L194 PolarHBondContact O-N 3.13Å; V190-L226 HydrophobicContact CG2-CD2 4.22Å; V190-Y231 HydrophobicContact CB-CD1 4.1Å; V190-Y231 HydrophobicContact CB-CE1 3.61Å; V190-Y231 HydrophobicContact CB-CE2 4.43Å; V190-Y231 HydrophobicContact CG1-CD1 3.61Å; V190-Y231 HydrophobicContact CG1-CD2 3.91Å; V190-Y231 HydrophobicContact CG1-CE1 3.57Å; V190-Y231 HydrophobicContact CG1-CE2 3.88Å; V190-Y231 HydrophobicContact CG1-CG 3.8Å; V190-Y231 HydrophobicContact CG2-CE1 4.28Å
191	I	98.3	Very high	93	Very high	33 Å²	33	46.1 Å²	46.1	17%	0.169	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-50.5	173.6	-68.4	163.9	0	0	0	110	E187 A193 L194 E195 V365 V367	E187-I191 WeakPolarHBondContact O-CG1 3.46Å; E187-I191 PolarHBondContact O-N 3Å; I191-A193 VanDerWaalsContact C-N 3.29Å; I191-A193 PolarHBondContact O-N 2.7Å; I191-L194 WeakPolarHBondContact O-CB 3.3Å; I191-L194 PolarHBondContact O-N 3.46Å; I191-L194 VanDerWaalsContact O-N 3.15Å; I191-E195 HydrophobicContact CG2-CG 4.49Å; I191-E195 WeakPolarHBondContact O-CG 3.43Å; I191-E195 PolarHBondContact O-N 3.03Å; I191-V365 HydrophobicContact CG1-CB 4.09Å; I191-V365 HydrophobicContact CG1-CG1 3.89Å; I191-V365 HydrophobicContact CG2-CB 4.17Å; I191-V365 HydrophobicContact CG2-CG2 4.13Å; I191-V367 HydrophobicContact CD1-CG2 3.91Å; I191-V367 HydrophobicContact CG1-CG2 4.23Å
192	G	97.9	Very high	94.1	Very high	25 Å²	25	43.1 Å²	43.1	26%	0.258	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-35.6	177.9	0	0	0	0	0	113.4	D188 L189 S196	D188-G192 PolarHBondContact O-N 3.35Å; L189-G192 PolarHBondContact O-N 3Å; G192-S196 VanDerWaalsContact O-CB 3.31Å; G192-S196 WeakPolarHBondContact O-CB 3.11Å; G192-S196 PolarHBondContact O-N 2.97Å; G192-S196 PolarHBondContact O-OG 3.34Å
193	A	98.2	Very high	95	Very high	2 Å²	2	37 Å²	37	2%	0.017	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-40.9	174.5	0	0	0	0	0	112.2	Q149 L150 V153 L189 V190 I191 A197	Q149-A193 HydrophobicContact CB-CB 3.79Å; Q149-A193 WeakPolarHBondContact CB-O 3.32Å; L150-A193 HydrophobicContact CD2-CB 3.8Å; L150-A193 HydrophobicContact CG-CB 4.22Å; V153-A193 HydrophobicContact CG2-CB 4.27Å; L189-A193 WeakPolarHBondContact O-CB 3.34Å; L189-A193 PolarHBondContact O-N 3.16Å; V190-A193 PolarHBondContact O-N 2.97Å; I191-A193 VanDerWaalsContact C-N 3.29Å; I191-A193 PolarHBondContact O-N 2.7Å; A193-A197 VanDerWaalsContact O-CB 3.22Å; A193-A197 WeakPolarHBondContact O-CB 3.3Å; A193-A197 PolarHBondContact O-N 3.39Å
194	L	98.8	Very high	95.9	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-49	174.3	-79.9	160.9	0	0	0	111.6	L146 V190 I191 S196 A197 F198 V224 Y231 A233 V365	L146-L194 HydrophobicContact CD1-CD2 3.71Å; L146-L194 HydrophobicContact CD1-CG 3.93Å; L146-L194 HydrophobicContact CD2-CD2 4.01Å; L146-L194 HydrophobicContact CG-CD2 4.48Å; V190-L194 HydrophobicContact CG1-CD1 4.24Å; V190-L194 PolarHBondContact O-N 3.13Å; I191-L194 WeakPolarHBondContact O-CB 3.3Å; I191-L194 PolarHBondContact O-N 3.46Å; I191-L194 VanDerWaalsContact O-N 3.15Å; L194-S196 VanDerWaalsContact C-N 3.32Å; L194-S196 PolarHBondContact O-N 2.93Å; L194-A197 PolarHBondContact O-N 2.84Å; L194-F198 VanDerWaalsContact O-CD2 3.26Å; L194-F198 WeakPolarHBondContact O-CD2 3.48Å; L194-F198 PolarHBondContact O-N 3.41Å; L194-V224 HydrophobicContact CD2-CG2 4.16Å; L194-Y231 HydrophobicContact CD1-CG 4.46Å; L194-A233 HydrophobicContact CD1-CB 4.4Å; L194-A233 HydrophobicContact CD2-CB 4.2Å; L194-V365 HydrophobicContact CB-CG2 4.2Å; L194-V365 HydrophobicContact CD1-CG1 3.88Å; L194-V365 HydrophobicContact CD1-CG2 4.21Å
195	E	98.8	Very high	96.6	Very high	76 Å²	76	30.7 Å²	30.7	36%	0.355	16%	0.164	S	C	.	.	H	α-helix	trans	-58.8	-44.3	178.1	-69	175.6	161.1	0	0	111.7	I191 F198 Q199 I362	I191-E195 HydrophobicContact CG2-CG 4.49Å; I191-E195 WeakPolarHBondContact O-CG 3.43Å; I191-E195 PolarHBondContact O-N 3.03Å; E195-F198 PolarHBondContact O-N 3.37Å; E195-Q199 PolarHBondContact O-N 3.12Å; E195-Q199 VanDerWaalsContact O-N 3.15Å; E195-I362 HydrophobicContact CB-CG2 4.21Å; E195-I362 HydrophobicContact CG-CG2 4.03Å
196	S	98.7	Very high	97.1	Very high	52 Å²	52	24.8 Å²	24.8	36%	0.364	14%	0.144	S	C	.	.	H	α-helix	trans	-66.1	-38.9	177.7	-58.9	0	0	0	0	112	G192 L194 Q199 E200	G192-S196 VanDerWaalsContact O-CB 3.31Å; G192-S196 WeakPolarHBondContact O-CB 3.11Å; G192-S196 PolarHBondContact O-N 2.97Å; G192-S196 PolarHBondContact O-OG 3.34Å; L194-S196 VanDerWaalsContact C-N 3.32Å; L194-S196 PolarHBondContact O-N 2.93Å; S196-Q199 PolarHBondContact O-N 2.91Å; S196-E200 WeakPolarHBondContact O-CB 3.42Å; S196-E200 PolarHBondContact O-N 3.19Å
197	A	98.8	Very high	97.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.1	-38.7	178.3	0	0	0	0	0	112.6	L142 C145 L146 Q149 A193 L194 E200 C201	L142-A197 HydrophobicContact CD1-CB 4.26Å; C145-A197 HydrophobicContact CB-CB 3.97Å; L146-A197 HydrophobicContact CB-CB 3.99Å; L146-A197 HydrophobicContact CD1-CB 4.35Å; Q149-A197 HydrophobicContact CG-CB 4.11Å; A193-A197 VanDerWaalsContact O-CB 3.22Å; A193-A197 WeakPolarHBondContact O-CB 3.3Å; A193-A197 PolarHBondContact O-N 3.39Å; L194-A197 PolarHBondContact O-N 2.84Å; A197-E200 PolarHBondContact O-N 3.34Å; A197-C201 WeakPolarHBondContact O-CB 3.26Å; A197-C201 PolarHBondContact O-N 2.74Å
198	F	98.8	Very high	97.8	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-46.3	174.8	-89.5	-119.6	0	0	0	111.4	L142 L194 E195 E200 C201 D202 A220 V222 A233 A235 L341 S361 P363	L142-F198 HydrophobicContact CD1-CD2 3.84Å; L142-F198 HydrophobicContact CD1-CE2 4.26Å; L142-F198 HydrophobicContact CD1-CG 4.33Å; L142-F198 HydrophobicContact CD2-CD2 4.21Å; L142-F198 HydrophobicContact CD2-CE2 3.87Å; L142-F198 HydrophobicContact CD2-CZ 4.08Å; L194-F198 VanDerWaalsContact O-CD2 3.26Å; L194-F198 WeakPolarHBondContact O-CD2 3.48Å; L194-F198 PolarHBondContact O-N 3.41Å; E195-F198 PolarHBondContact O-N 3.37Å; F198-E200 VanDerWaalsContact C-N 3.32Å; F198-E200 PolarHBondContact O-N 2.86Å; F198-C201 PolarHBondContact O-N 3.28Å; F198-D202 WeakPolarHBondContact O-CB 3.47Å; F198-D202 PolarHBondContact O-N 2.96Å; F198-A220 HydrophobicContact CD1-CB 4.36Å; F198-A220 HydrophobicContact CE1-CB 3.57Å; F198-A220 HydrophobicContact CZ-CB 4.13Å; F198-V222 HydrophobicContact CE2-CB 4.39Å; F198-V222 HydrophobicContact CE2-CG2 3.88Å; F198-V222 HydrophobicContact CZ-CB 4.28Å; F198-V222 HydrophobicContact CZ-CG2 3.67Å; F198-A233 HydrophobicContact CE2-CB 4Å; F198-A233 HydrophobicContact CZ-CB 4Å; F198-A235 HydrophobicContact CD1-CB 4.18Å; F198-A235 HydrophobicContact CE1-CB 3.93Å; F198-L341 HydrophobicContact CD1-CD2 4.2Å; F198-S361 WeakPolarHBondContact CB-O 3.46Å; F198-S361 WeakPolarHBondContact CD1-O 3.31Å; F198-P363 HydrophobicContact CB-CG 4.2Å; F198-P363 HydrophobicContact CD1-CB 3.9Å; F198-P363 HydrophobicContact CD1-CG 3.79Å; F198-P363 HydrophobicContact CD2-CG 3.79Å; F198-P363 HydrophobicContact CE1-CB 3.7Å; F198-P363 HydrophobicContact CE1-CG 3.99Å; F198-P363 HydrophobicContact CE2-CB 4.34Å; F198-P363 HydrophobicContact CE2-CG 3.99Å; F198-P363 HydrophobicContact CG-CB 4.3Å; F198-P363 HydrophobicContact CG-CG 3.67Å; F198-P363 HydrophobicContact CZ-CB 3.93Å; F198-P363 HydrophobicContact CZ-CG 4.08Å
199	Q	98.6	Very high	97.9	Very high	38 Å²	38	30.2 Å²	30.2	18%	0.178	16%	0.156	C	C	.	.	H	α-helix	trans	-59	-45.1	175.8	179.7	60.5	75.7	0	0	111.7	E195 S196 D202 D203 I362	E195-Q199 PolarHBondContact O-N 3.12Å; E195-Q199 VanDerWaalsContact O-N 3.15Å; S196-Q199 PolarHBondContact O-N 2.91Å; Q199-D202 PolarHBondContact O-N 3.42Å; Q199-D203 PolarHBondContact NE2-OD1 3.01Å; Q199-D203 VanDerWaalsContact O-CG 3.25Å; Q199-D203 PolarHBondContact O-N 2.98Å; Q199-I362 HydrophobicContact CB-CD1 3.8Å; Q199-I362 HydrophobicContact CG-CD1 4.49Å
200	E	98.6	Very high	98	Very high	48 Å²	48	34.1 Å²	34.1	22%	0.224	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-41.6	-179.9	-176.5	171	-165.3	0	0	112.1	C145 R148 Q149 S196 A197 F198 D203 V204	C145-E200 HydrophobicContact CB-CB 4.47Å; R148-E200 IonicContact CZ-OE1 3.25Å; R148-E200 IonicContact CZ-OE2 3.63Å; R148-E200 IonicContact NH1-OE1 3.5Å; R148-E200 PolarHBondContact NH1-OE1 2.98Å; R148-E200 IonicContact NH1-OE2 3.98Å; R148-E200 PolarHBondContact NH1-OE2 2.83Å; R148-E200 IonicContact NH2-OE1 3.78Å; R148-E200 PolarHBondContact NH2-OE1 3.03Å; R148-E200 IonicContact NH2-OE2 2.66Å; R148-E200 PolarHBondContact NH2-OE2 3.07Å; R148-E200 VanDerWaalsContact NH2-OE2 3.15Å; Q149-E200 PolarHBondContact NE2-OE2 3.06Å; S196-E200 WeakPolarHBondContact O-CB 3.42Å; S196-E200 PolarHBondContact O-N 3.19Å; A197-E200 PolarHBondContact O-N 3.34Å; F198-E200 VanDerWaalsContact C-N 3.32Å; F198-E200 PolarHBondContact O-N 2.86Å; E200-D203 PolarHBondContact O-N 2.82Å; E200-V204 WeakPolarHBondContact O-CG2 3.22Å; E200-V204 PolarHBondContact O-N 2.9Å
201	C	98.8	Very high	97.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-42.8	175	-172.4	0	0	0	0	111.5	L142 A197 F198 D203 V204 I205	L142-C201 HydrophobicContact CB-CB 4.36Å; L142-C201 HydrophobicContact CD1-CB 3.68Å; A197-C201 WeakPolarHBondContact O-CB 3.26Å; A197-C201 PolarHBondContact O-N 2.74Å; F198-C201 PolarHBondContact O-N 3.28Å; C201-D203 VanDerWaalsContact C-N 3.3Å; C201-D203 PolarHBondContact O-N 3.3Å; C201-V204 PolarHBondContact O-N 2.92Å; C201-I205 VanDerWaalsContact O-CG1 3.29Å; C201-I205 WeakPolarHBondContact O-CG1 3.48Å; C201-I205 PolarHBondContact O-N 3.06Å
202	D	98.8	Very high	97.7	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-43.4	175	-177.6	48.5	0	0	0	111.5	F198 Q199 V204 I205 G206 L341 G342 H344 K356 S361	F198-D202 WeakPolarHBondContact O-CB 3.47Å; F198-D202 PolarHBondContact O-N 2.96Å; Q199-D202 PolarHBondContact O-N 3.42Å; D202-V204 VanDerWaalsContact C-N 3.34Å; D202-V204 PolarHBondContact O-N 3.08Å; D202-I205 PolarHBondContact O-N 2.81Å; D202-G206 PolarHBondContact O-N 2.99Å; D202-L341 HydrophobicContact CB-CD2 3.86Å; D202-G342 PolarHBondContact OD1-N 2.81Å; D202-H344 PolarHBondContact O-CE1 3.44Å; D202-H344 PolarHBondContact O-NE2 3.13Å; D202-H344 IonicContact OD1-CD2 2.81Å; D202-H344 IonicContact OD1-CE1 2.7Å; D202-H344 IonicContact OD1-NE2 3.43Å; D202-H344 PolarHBondContact OD1-NE2 3.18Å; D202-H344 VanDerWaalsContact OD1-NE2 3.14Å; D202-H344 IonicContact OD2-CE1 3.9Å; D202-H344 IonicContact OD2-NE2 2.66Å; D202-K356 IonicContact OD1-NZ 3.41Å; D202-K356 PolarHBondContact OD1-NZ 2.77Å; D202-K356 WeakPolarHBondContact OD2-CE 3.35Å; D202-K356 IonicContact OD2-NZ 2.7Å; D202-K356 PolarHBondContact OD2-NZ 3.04Å; D202-S361 VanDerWaalsContact CG-CB 3.48Å; D202-S361 WeakPolarHBondContact OD2-CB 3.29Å; D202-S361 PolarHBondContact OD2-OG 3.02Å; D202-S361 VanDerWaalsContact OD2-OG 3.12Å
203	D	98.4	Very high	97.5	Very high	40 Å²	40	35.6 Å²	35.6	21%	0.214	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-38.6	177.4	-69	-9.5	0	0	0	112.2	R9 Q199 E200 C201 R207	R9-D203 IonicContact CZ-OD1 3.39Å; R9-D203 IonicContact NH1-OD1 2.83Å; R9-D203 IonicContact NH2-OD1 2.77Å; R9-D203 PolarHBondContact NH2-OD1 3.11Å; R9-D203 IonicContact NH2-OD2 3.14Å; Q199-D203 PolarHBondContact NE2-OD1 3.01Å; Q199-D203 VanDerWaalsContact O-CG 3.25Å; Q199-D203 PolarHBondContact O-N 2.98Å; E200-D203 PolarHBondContact O-N 2.82Å; C201-D203 VanDerWaalsContact C-N 3.3Å; C201-D203 PolarHBondContact O-N 3.3Å; D203-R207 WeakPolarHBondContact O-CG 3.4Å; D203-R207 PolarHBondContact O-N 3.24Å; D203-R207 PolarHBondContact O-NH1 2.83Å
204	V	98.1	Very high	97.3	Very high	28 Å²	28	38 Å²	38	17%	0.17	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-50.3	173.4	173.5	0	0	0	0	110.3	T141 E200 C201 D202 G206 R207 E208	T141-V204 HydrophobicContact CG2-CB 4.2Å; T141-V204 HydrophobicContact CG2-CG1 4Å; T141-V204 HydrophobicContact CG2-CG2 4.32Å; E200-V204 WeakPolarHBondContact O-CG2 3.22Å; E200-V204 PolarHBondContact O-N 2.9Å; C201-V204 PolarHBondContact O-N 2.92Å; D202-V204 VanDerWaalsContact C-N 3.34Å; D202-V204 PolarHBondContact O-N 3.08Å; V204-G206 VanDerWaalsContact C-N 3.27Å; V204-G206 PolarHBondContact O-N 3.13Å; V204-R207 VanDerWaalsContact CG2-NH2 3.34Å; V204-R207 PolarHBondContact O-N 2.93Å; V204-E208 HydrophobicContact CG1-CG 4.14Å; V204-E208 WeakPolarHBondContact O-CG 3.31Å; V204-E208 PolarHBondContact O-N 3.28Å
205	I	98.3	Very high	97.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.3	-44.4	179.5	-69.2	163.1	0	0	0	110.6	A134 L137 A138 C201 D202 R207 E208 L209 L341	A134-I205 HydrophobicContact CB-CG2 4.25Å; L137-I205 HydrophobicContact CB-CG1 3.83Å; L137-I205 HydrophobicContact CD1-CG2 4.39Å; A138-I205 HydrophobicContact CB-CD1 3.9Å; C201-I205 VanDerWaalsContact O-CG1 3.29Å; C201-I205 WeakPolarHBondContact O-CG1 3.48Å; C201-I205 PolarHBondContact O-N 3.06Å; D202-I205 PolarHBondContact O-N 2.81Å; I205-R207 PolarHBondContact O-N 2.97Å; I205-E208 PolarHBondContact O-N 2.7Å; I205-L209 HydrophobicContact CG2-CD1 3.63Å; I205-L209 HydrophobicContact CG2-CG 4.08Å; I205-L209 WeakPolarHBondContact O-CB 3.41Å; I205-L209 VanDerWaalsContact O-CG 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.49Å; I205-L209 PolarHBondContact O-N 2.79Å; I205-L341 HydrophobicContact CD1-CB 3.79Å; I205-L341 HydrophobicContact CD1-CD1 4.03Å; I205-L341 HydrophobicContact CD1-CG 4.48Å
206	G	97.3	Very high	96.9	Very high	8 Å²	8	39 Å²	39	8%	0.082	22%	0.215	C	C	.	.	H	α-helix	trans	-58.2	-46.9	178.2	0	0	0	0	0	113.4	D202 V204 E210 H344	D202-G206 PolarHBondContact O-N 2.99Å; V204-G206 VanDerWaalsContact C-N 3.27Å; V204-G206 PolarHBondContact O-N 3.13Å; G206-E210 VanDerWaalsContact O-CB 3.24Å; G206-E210 WeakPolarHBondContact O-CB 3.46Å; G206-E210 PolarHBondContact O-N 3.43Å; G206-H344 WeakPolarHBondContact CA-CD2 3.45Å; G206-H344 WeakPolarHBondContact CA-NE2 3.45Å; G206-H344 PolarHBondContact N-NE2 3.5Å
207	R	97.2	Very high	96.9	Very high	138 Å²	138	36.5 Å²	36.5	52%	0.521	20%	0.197	S	C	.	.	H	α-helix	trans	-65.2	-43.6	178.4	-70.7	-172.2	-62	-89.6	2.6	112.4	D203 V204 I205 A211	D203-R207 WeakPolarHBondContact O-CG 3.4Å; D203-R207 PolarHBondContact O-N 3.24Å; D203-R207 PolarHBondContact O-NH1 2.83Å; V204-R207 VanDerWaalsContact CG2-NH2 3.34Å; V204-R207 PolarHBondContact O-N 2.93Å; I205-R207 PolarHBondContact O-N 2.97Å; R207-A211 VanDerWaalsContact O-CB 3.27Å; R207-A211 WeakPolarHBondContact O-CB 3.37Å; R207-A211 PolarHBondContact O-N 2.85Å
208	E	96.9	Very high	96.9	Very high	85 Å²	85	36.5 Å²	36.5	40%	0.397	20%	0.197	S	C	.	.	H	α-helix	trans	-68.7	-43	-177.7	-68.3	-59.5	143.9	0	0	112.2	L137 V204 I205 A211 S212	L137-E208 HydrophobicContact CD1-CB 3.73Å; L137-E208 HydrophobicContact CD2-CB 4.15Å; L137-E208 HydrophobicContact CD2-CG 4.28Å; V204-E208 HydrophobicContact CG1-CG 4.14Å; V204-E208 WeakPolarHBondContact O-CG 3.31Å; V204-E208 PolarHBondContact O-N 3.28Å; I205-E208 PolarHBondContact O-N 2.7Å; E208-A211 PolarHBondContact O-N 2.95Å; E208-S212 WeakPolarHBondContact O-CB 3.42Å; E208-S212 PolarHBondContact O-N 2.88Å; E208-S212 PolarHBondContact O-OG 2.87Å
209	L	96.4	Very high	96.9	Very high	9 Å²	9	36.6 Å²	36.6	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-66	-41.4	176.1	-68	-177.7	0	0	0	111.5	A133 A134 L137 I205 S212 G213 Q214	A133-L209 HydrophobicContact CB-CD2 3.69Å; A134-L209 HydrophobicContact CB-CD1 4.17Å; L137-L209 HydrophobicContact CD1-CD2 3.81Å; L137-L209 HydrophobicContact CD1-CG 3.96Å; I205-L209 HydrophobicContact CG2-CD1 3.63Å; I205-L209 HydrophobicContact CG2-CG 4.08Å; I205-L209 WeakPolarHBondContact O-CB 3.41Å; I205-L209 VanDerWaalsContact O-CG 3.3Å; I205-L209 WeakPolarHBondContact O-CG 3.49Å; I205-L209 PolarHBondContact O-N 2.79Å; L209-S212 WeakPolarHBondContact CA-OG 3.35Å; L209-S212 PolarHBondContact O-N 2.94Å; L209-S212 PolarHBondContact O-OG 2.89Å; L209-G213 PolarHBondContact O-N 3.11Å; L209-Q214 CarbonylContact C-O 3.49Å; L209-Q214 HydrophobicContact CD2-CB 3.86Å; L209-Q214 PolarHBondContact O-N 2.92Å
210	E	95.1	Very high	96.9	Very high	129 Å²	129	34.8 Å²	34.8	60%	0.603	19%	0.189	S	C	*	.	H	α-helix	trans	-61.4	-46.1	174.3	178.8	170.1	-154.6	0	0	111.9	G206 S212 G213	G206-E210 VanDerWaalsContact O-CB 3.24Å; G206-E210 WeakPolarHBondContact O-CB 3.46Å; G206-E210 PolarHBondContact O-N 3.43Å; E210-S212 VanDerWaalsContact C-N 3.33Å; E210-S212 PolarHBondContact O-N 3.49Å; E210-G213 PolarHBondContact O-N 3.3Å
211	A	94.7	Very high	96.9	Very high	44 Å²	44	32.5 Å²	32.5	36%	0.364	18%	0.179	S	C	.	.	H	α-helix	trans	-64.7	-35.9	-179.2	0	0	0	0	0	113.1	R25 S26 R207 E208	R25-A211 WeakPolarHBondContact CA-O 3.3Å; S26-A211 PolarHBondContact N-O 3.41Å; S26-A211 PolarHBondContact OG-O 3.15Å; R207-A211 VanDerWaalsContact O-CB 3.27Å; R207-A211 WeakPolarHBondContact O-CB 3.37Å; R207-A211 PolarHBondContact O-N 2.85Å; E208-A211 PolarHBondContact O-N 2.95Å
212	S	93.7	Very high	96.9	Very high	8 Å²	8	32.6 Å²	32.6	6%	0.056	18%	0.179	C	C	.	.	H	α-helix	trans	-85.3	-11.9	178.8	56	0	0	0	0	113.3	S26 E208 L209 E210 Q214	S26-S212 WeakPolarHBondContact OG-CA 3.43Å; S26-S212 PolarHBondContact OG-N 3.44Å; S26-S212 VanDerWaalsContact OG-N 3.16Å; E208-S212 WeakPolarHBondContact O-CB 3.42Å; E208-S212 PolarHBondContact O-N 2.88Å; E208-S212 PolarHBondContact O-OG 2.87Å; L209-S212 WeakPolarHBondContact CA-OG 3.35Å; L209-S212 PolarHBondContact O-N 2.94Å; L209-S212 PolarHBondContact O-OG 2.89Å; E210-S212 VanDerWaalsContact C-N 3.33Å; E210-S212 PolarHBondContact O-N 3.49Å; S212-Q214 VanDerWaalsContact C-N 3.28Å; S212-Q214 PolarHBondContact OG-OE1 3.24Å
213	G	93.9	Very high	96.9	Very high	39 Å²	39	32.5 Å²	32.5	40%	0.402	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	26.4	-174.1	0	0	0	0	0	113.3	L209 E210	L209-G213 PolarHBondContact O-N 3.11Å; E210-G213 PolarHBondContact O-N 3.3Å
214	Q	94.3	Very high	96.9	Very high	51 Å²	51	30.7 Å²	30.7	24%	0.238	17%	0.169	C	C	.	.			trans	-97.3	160.9	173.7	-68.1	-179.8	-86.2	0	0	110.7	L209 S212	L209-Q214 CarbonylContact C-O 3.49Å; L209-Q214 HydrophobicContact CD2-CB 3.86Å; L209-Q214 PolarHBondContact O-N 2.92Å; S212-Q214 VanDerWaalsContact C-N 3.28Å; S212-Q214 PolarHBondContact OG-OE1 3.24Å
215	V	94.6	Very high	96.8	Very high	93 Å²	93	30.5 Å²	30.5	56%	0.564	17%	0.169	S	C	*	.			trans	-127.6	178.6	178	-61.5	0	0	0	0	109.7
216	G	95.6	Very high	96.5	Very high	7 Å²	7	30.6 Å²	30.6	7%	0.072	17%	0.169	C	C	.	.			trans	113.7	173.8	176.8	0	0	0	0	0	113.2	H129 D343	H129-G216 VanDerWaalsContact O-CA 3.24Å; H129-G216 WeakPolarHBondContact O-CA 3.3Å; G216-D343 PolarHBondContact O-N 2.84Å
217	G	98.1	Very high	96.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	-177.2	179.8	0	0	0	0	0	110.7	H129 L341 D343	H129-G217 VanDerWaalsContact CE1-C 3.47Å; H129-G217 PolarHBondContact N-O 3.25Å; H129-G217 PolarHBondContact O-N 3.24Å; G217-L341 CarbonylContact C-O 3.46Å; G217-L341 WeakPolarHBondContact CA-O 3.39Å; G217-D343 PolarHBondContact N-OD1 2.88Å
218	C	98.5	Very high	96	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	156	171.9	59.7	0	0	0	0	111.3	F126 D127 A134 A135 G340 L341	F126-C218 HydrophobicContact CB-CB 4.42Å; D127-C218 CarbonylContact O-C 3.6Å; D127-C218 WeakPolarHBondContact O-CA 3.4Å; D127-C218 WeakPolarHBondContact O-CB 3.25Å; A134-C218 HydrophobicContact CB-CB 4.43Å; A135-C218 HydrophobicContact CB-CB 3.91Å; C218-G340 CarbonylContact O-C 3.45Å; C218-G340 WeakPolarHBondContact O-CA 3.43Å; C218-L341 PolarHBondContact N-O 3.05Å; C218-L341 PolarHBondContact O-N 3.41Å
219	T	98.7	Very high	95.9	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.018	16%	0.157	C	C	.	.			trans	-70.7	166.1	161.1	76	0	0	0	0	110	F126 D127 A235 D237 S238 V337	F126-T219 VanDerWaalsContact CA-O 3.31Å; F126-T219 WeakPolarHBondContact CA-O 3.49Å; D127-T219 HydrophobicContact CB-CG2 3.97Å; D127-T219 WeakPolarHBondContact CB-OG1 3.43Å; D127-T219 PolarHBondContact N-OG1 2.91Å; D127-T219 VanDerWaalsContact N-OG1 3.1Å; D127-T219 PolarHBondContact O-N 3.26Å; T219-A235 CarbonylContact C-O 3.5Å; T219-A235 WeakPolarHBondContact CA-O 3.39Å; T219-D237 VanDerWaalsContact CG2-OD1 3.31Å; T219-D237 WeakPolarHBondContact CG2-OD1 3.46Å; T219-S238 PolarHBondContact OG1-OG 2.75Å; T219-V337 HydrophobicContact CG2-CG1 4.26Å
220	A	98.8	Very high	96	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	116.8	172.7	0	0	0	0	0	110.7	F126 F198 A235 L341	F126-A220 HydrophobicContact CD1-CB 3.83Å; F126-A220 HydrophobicContact CE1-CB 3.91Å; F198-A220 HydrophobicContact CD1-CB 4.36Å; F198-A220 HydrophobicContact CE1-CB 3.57Å; F198-A220 HydrophobicContact CZ-CB 4.13Å; A220-A235 PolarHBondContact N-O 2.95Å; A220-A235 PolarHBondContact O-N 2.93Å; A220-L341 HydrophobicContact CB-CD1 3.84Å; A220-L341 HydrophobicContact CB-CG 4.17Å
221	L	98.9	Very high	96.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.9	173.3	176.6	67	0	0	0	109	A124 L125 V232 A233 N234 R239 A240 M383	A124-L221 CarbonylContact C-O 3.56Å; A124-L221 WeakPolarHBondContact CA-O 3.45Å; L125-L221 PolarHBondContact N-O 3.15Å; L125-L221 PolarHBondContact O-N 2.93Å; L221-V232 HydrophobicContact CD1-CG1 3.92Å; L221-A233 WeakPolarHBondContact CA-O 3.35Å; L221-N234 HydrophobicContact CD1-CB 3.82Å; L221-R239 VanDerWaalsContact CD2-C 3.42Å; L221-R239 VanDerWaalsContact CD2-O 3.3Å; L221-R239 WeakPolarHBondContact CD2-O 3.35Å; L221-A240 HydrophobicContact CD1-CB 4.21Å; L221-A240 HydrophobicContact CD2-CB 4.17Å; L221-M383 HydrophobicContact CD2-CB 3.88Å; L221-M383 HydrophobicContact CD2-CE 4.11Å; L221-M383 HydrophobicContact CD2-CG 4.2Å; L221-M383 HydrophobicContact CG-CE 3.74Å; L221-M383 WeakPolarHBondContact O-CE 3.27Å
222	V	98.9	Very high	96.3	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135	-174	179.3	0	0	0	0	110.2	Y122 W123 A124 L142 F198 V224 V232 A233	Y122-V222 HydrophobicContact CD2-CG1 3.85Å; Y122-V222 HydrophobicContact CE2-CG1 3.37Å; Y122-V222 HydrophobicContact CE2-CG2 4.42Å; W123-V222 CarbonylContact O-C 3.59Å; W123-V222 WeakPolarHBondContact O-CA 3.29Å; A124-V222 HydrophobicContact CB-CG2 3.86Å; L142-V222 HydrophobicContact CD2-CG2 3.61Å; F198-V222 HydrophobicContact CE2-CB 4.39Å; F198-V222 HydrophobicContact CE2-CG2 3.88Å; F198-V222 HydrophobicContact CZ-CB 4.28Å; F198-V222 HydrophobicContact CZ-CG2 3.67Å; V222-V224 HydrophobicContact CG1-CG2 3.87Å; V222-V232 CarbonylContact O-C 3.55Å; V222-V232 VanDerWaalsContact O-CA 3.3Å; V222-V232 WeakPolarHBondContact O-CA 3.42Å; V222-A233 HydrophobicContact CB-CB 4.38Å; V222-A233 PolarHBondContact N-O 3.24Å; V222-A233 PolarHBondContact O-N 3.12Å
223	A	98.7	Very high	96.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.4	167.8	0	0	0	0	0	110.3	Y122 W123 L230 Y231 V232 M383 I449	Y122-A223 WeakPolarHBondContact CA-O 3.11Å; W123-A223 HydrophobicContact CE3-CB 4.41Å; W123-A223 PolarHBondContact N-O 2.65Å; W123-A223 PolarHBondContact O-N 3.34Å; A223-L230 HydrophobicContact CB-CD1 4.26Å; A223-Y231 CarbonylContact C-O 3.56Å; A223-Y231 WeakPolarHBondContact CA-O 3.43Å; A223-V232 HydrophobicContact CB-CG2 4.43Å; A223-M383 HydrophobicContact CB-CE 3.89Å; A223-M383 HydrophobicContact CB-SD 3.51Å; A223-M383 VanDerWaalsContact CB-SD 3.51Å; A223-I449 HydrophobicContact CB-CD1 4.28Å
224	V	98.2	Very high	96.8	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.006	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.2	178.8	-178.7	0	0	0	0	109.6	L94 H121 Y122 L146 L194 V222 L226 L230 Y231	L94-V224 HydrophobicContact CD1-CG1 3.75Å; H121-V224 CarbonylContact O-C 3.59Å; H121-V224 VanDerWaalsContact O-CA 3.3Å; H121-V224 WeakPolarHBondContact O-CA 3.31Å; Y122-V224 HydrophobicContact CD2-CG2 4.13Å; L146-V224 HydrophobicContact CD2-CG2 3.69Å; L194-V224 HydrophobicContact CD2-CG2 4.16Å; V222-V224 HydrophobicContact CG1-CG2 3.87Å; V224-L226 HydrophobicContact CG1-CB 4.17Å; V224-L230 CarbonylContact O-C 3.52Å; V224-L230 WeakPolarHBondContact O-CA 3.47Å; V224-Y231 PolarHBondContact N-O 3.22Å; V224-Y231 PolarHBondContact O-N 3.18Å
225	S	95.9	Very high	97	Very high	25 Å²	25	13.2 Å²	13.2	18%	0.175	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.6	169.1	177	0	0	0	0	109.2	G120 H121 K229	G120-S225 CarbonylContact C-O 3.55Å; G120-S225 WeakPolarHBondContact CA-O 3.31Å; H121-S225 PolarHBondContact N-O 2.72Å; H121-S225 PolarHBondContact O-N 2.72Å; S225-K229 WeakPolarHBondContact CA-O 3.35Å
226	L	93.3	Very high	97.2	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.005	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	128.2	-176	-170.4	64.1	0	0	0	110.2	I96 L118 L150 M157 V190 V224 G228 K229 Y231	I96-L226 HydrophobicContact CD1-CD1 3.8Å; I96-L226 HydrophobicContact CD1-CD2 4.03Å; L118-L226 HydrophobicContact CD1-CD1 4.44Å; L118-L226 HydrophobicContact CD2-CD1 3.74Å; L118-L226 HydrophobicContact CD2-CD2 4.35Å; L118-L226 HydrophobicContact CD2-CG 4.17Å; L118-L226 HydrophobicContact CG-CD1 3.75Å; L150-L226 HydrophobicContact CD1-CD2 4.35Å; L150-L226 HydrophobicContact CD2-CD2 4.27Å; M157-L226 HydrophobicContact CE-CD2 3.81Å; M157-L226 HydrophobicContact CE-CG 4.47Å; V190-L226 HydrophobicContact CG2-CD2 4.22Å; V224-L226 HydrophobicContact CG1-CB 4.17Å; L226-G228 PolarHBondContact O-N 2.93Å; L226-K229 PolarHBondContact N-O 2.77Å; L226-K229 PolarHBondContact O-N 3.43Å; L226-K229 VanDerWaalsContact O-N 3.09Å; L226-Y231 HydrophobicContact CB-CE2 4.21Å
227	Q	90.4	Very high	97.3	Very high	79 Å²	79	9.3 Å²	9.3	37%	0.369	5%	0.052	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	50.7	177.5	-63.3	-177.8	-56.7	0	0	114.2	L118 K229	L118-Q227 HydrophobicContact CD1-CG 3.67Å; L118-Q227 HydrophobicContact CD2-CG 4.02Å; L118-Q227 HydrophobicContact CG-CG 4.4Å; Q227-K229 PolarHBondContact O-N 3.16Å
228	G	91.8	Very high	97.3	Very high	20 Å²	20	9.3 Å²	9.3	21%	0.206	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	6	177.1	0	0	0	0	0	114.8	L226 V370 D371	L226-G228 PolarHBondContact O-N 2.93Å; G228-V370 WeakPolarHBondContact O-CA 3.49Å; G228-V370 VanDerWaalsContact O-CB 3.28Å; G228-V370 WeakPolarHBondContact O-CB 3.37Å; G228-V370 PolarHBondContact O-N 3.46Å; G228-D371 VanDerWaalsContact CA-OD2 3.32Å; G228-D371 WeakPolarHBondContact CA-OD2 3.43Å; G228-D371 PolarHBondContact O-N 3.3Å
229	K	95.8	Very high	97.3	Very high	40 Å²	40	11.4 Å²	11.4	17%	0.174	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	149	179.7	-62.8	-175.1	176.2	178	0	111.2	E187 S225 L226 Q227 Y231 V367 L368	E187-K229 IonicContact OE2-NZ 3.84Å; E187-K229 PolarHBondContact OE2-NZ 3.33Å; S225-K229 WeakPolarHBondContact CA-O 3.35Å; L226-K229 PolarHBondContact N-O 2.77Å; L226-K229 PolarHBondContact O-N 3.43Å; L226-K229 VanDerWaalsContact O-N 3.09Å; Q227-K229 PolarHBondContact O-N 3.16Å; K229-Y231 HydrophobicContact CB-CD2 4.36Å; K229-Y231 HydrophobicContact CB-CE2 3.64Å; K229-V367 HydrophobicContact CB-CG1 4.36Å; K229-V367 HydrophobicContact CD-CG1 4.03Å; K229-L368 CarbonylContact C-O 3.55Å; K229-L368 WeakPolarHBondContact CA-O 3.29Å
230	L	97.9	Very high	97.3	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.016	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.8	170.3	-174.5	76.5	0	0	0	109	A223 V224 V232 L251 L368 V370 V381 L451	A223-L230 HydrophobicContact CB-CD1 4.26Å; V224-L230 CarbonylContact O-C 3.52Å; V224-L230 WeakPolarHBondContact O-CA 3.47Å; L230-V232 HydrophobicContact CD2-CG2 4.14Å; L230-V232 HydrophobicContact CG-CG2 4.22Å; L230-L251 HydrophobicContact CD2-CD1 4.26Å; L230-L368 HydrophobicContact CB-CB 4.25Å; L230-L368 HydrophobicContact CD2-CD2 4.38Å; L230-L368 PolarHBondContact N-O 2.92Å; L230-L368 PolarHBondContact O-N 3.36Å; L230-V370 HydrophobicContact CB-CG2 3.7Å; L230-V381 HydrophobicContact CD2-CG2 3.77Å; L230-L451 HydrophobicContact CD2-CD2 4.4Å
231	Y	98.7	Very high	97.3	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.008	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	120.1	176.1	-57.2	-100.3	0	0	0	108.4	E187 V190 L194 A223 V224 L226 K229 V365 T366 V367	E187-Y231 HydrophobicContact CB-CE1 3.92Å; V190-Y231 HydrophobicContact CB-CD1 4.1Å; V190-Y231 HydrophobicContact CB-CE1 3.61Å; V190-Y231 HydrophobicContact CB-CE2 4.43Å; V190-Y231 HydrophobicContact CG1-CD1 3.61Å; V190-Y231 HydrophobicContact CG1-CD2 3.91Å; V190-Y231 HydrophobicContact CG1-CE1 3.57Å; V190-Y231 HydrophobicContact CG1-CE2 3.88Å; V190-Y231 HydrophobicContact CG1-CG 3.8Å; V190-Y231 HydrophobicContact CG2-CE1 4.28Å; L194-Y231 HydrophobicContact CD1-CG 4.46Å; A223-Y231 CarbonylContact C-O 3.56Å; A223-Y231 WeakPolarHBondContact CA-O 3.43Å; V224-Y231 PolarHBondContact N-O 3.22Å; V224-Y231 PolarHBondContact O-N 3.18Å; L226-Y231 HydrophobicContact CB-CE2 4.21Å; K229-Y231 HydrophobicContact CB-CD2 4.36Å; K229-Y231 HydrophobicContact CB-CE2 3.64Å; Y231-V365 HydrophobicContact CD1-CG1 4.41Å; Y231-T366 WeakPolarHBondContact CA-O 3.35Å; Y231-V367 HydrophobicContact CD1-CG1 4.25Å; Y231-V367 HydrophobicContact CD1-CG2 3.72Å; Y231-V367 HydrophobicContact CE1-CG1 4Å; Y231-V367 HydrophobicContact CE1-CG2 3.89Å
232	V	98.9	Very high	97.2	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.012	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	110.2	177.3	-180	0	0	0	0	108.9	L221 V222 A223 L230 A240 L251 V365 T366	L221-V232 HydrophobicContact CD1-CG1 3.92Å; V222-V232 CarbonylContact O-C 3.55Å; V222-V232 VanDerWaalsContact O-CA 3.3Å; V222-V232 WeakPolarHBondContact O-CA 3.42Å; A223-V232 HydrophobicContact CB-CG2 4.43Å; L230-V232 HydrophobicContact CD2-CG2 4.14Å; L230-V232 HydrophobicContact CG-CG2 4.22Å; V232-A240 HydrophobicContact CG1-CB 3.83Å; V232-L251 HydrophobicContact CB-CB 4.25Å; V232-L251 HydrophobicContact CG1-CB 4.24Å; V232-L251 HydrophobicContact CG2-CB 4.01Å; V232-L251 HydrophobicContact CG2-CD1 4.04Å; V232-V365 CarbonylContact O-C 3.53Å; V232-V365 WeakPolarHBondContact O-CA 3.4Å; V232-T366 PolarHBondContact N-O 3.38Å; V232-T366 PolarHBondContact O-N 3.32Å
233	A	98.9	Very high	97.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.8	180	0	0	0	0	0	110.2	L194 F198 L221 V222 P363 Q364 V365	L194-A233 HydrophobicContact CD1-CB 4.4Å; L194-A233 HydrophobicContact CD2-CB 4.2Å; F198-A233 HydrophobicContact CE2-CB 4Å; F198-A233 HydrophobicContact CZ-CB 4Å; L221-A233 WeakPolarHBondContact CA-O 3.35Å; V222-A233 HydrophobicContact CB-CB 4.38Å; V222-A233 PolarHBondContact N-O 3.24Å; V222-A233 PolarHBondContact O-N 3.12Å; A233-P363 HydrophobicContact CB-CB 3.95Å; A233-P363 HydrophobicContact CB-CG 4.16Å; A233-Q364 CarbonylContact C-O 3.57Å; A233-Q364 WeakPolarHBondContact CA-O 3.47Å; A233-V365 HydrophobicContact CB-CG2 3.96Å
234	N	98.8	Very high	97	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.9	-178.9	-169.4	35	0	0	0	112.9	L221 G236 S238 T253 F255 P363 Q364	L221-N234 HydrophobicContact CD1-CB 3.82Å; N234-G236 PolarHBondContact ND2-O 2.92Å; N234-S238 PolarHBondContact ND2-O 3.45Å; N234-S238 VanDerWaalsContact ND2-O 3.11Å; N234-S238 PolarHBondContact OD1-O 2.84Å; N234-T253 PolarHBondContact ND2-O 3.28Å; N234-F255 HydrophobicContact CB-CE2 4.31Å; N234-F255 VanDerWaalsContact O-CE2 3.31Å; N234-F255 WeakPolarHBondContact O-CE2 3.32Å; N234-P363 CarbonylContact O-C 3.58Å; N234-P363 WeakPolarHBondContact O-CA 3.38Å; N234-P363 WeakPolarHBondContact O-CB 3.3Å; N234-Q364 PolarHBondContact N-O 3.16Å; N234-Q364 PolarHBondContact O-N 2.98Å
235	A	98.6	Very high	96.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	95.2	168	0	0	0	0	0	109.2	F198 T219 A220 R339 P363	F198-A235 HydrophobicContact CD1-CB 4.18Å; F198-A235 HydrophobicContact CE1-CB 3.93Å; T219-A235 CarbonylContact C-O 3.5Å; T219-A235 WeakPolarHBondContact CA-O 3.39Å; A220-A235 PolarHBondContact N-O 2.95Å; A220-A235 PolarHBondContact O-N 2.93Å; A235-R339 HydrophobicContact CB-CB 4.11Å; A235-P363 HydrophobicContact CB-CB 4.37Å
236	G	98.1	Very high	96.2	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	135.5	-158.8	-176.9	0	0	0	0	0	111.8	N234 F255 R339	N234-G236 PolarHBondContact ND2-O 2.92Å; G236-F255 PolarHBondContact O-N 3.36Å; G236-R339 WeakPolarHBondContact CA-O 3.43Å; G236-R339 PolarHBondContact N-O 2.69Å
237	D	97.4	Very high	96.3	Very high	19 Å²	19	30.6 Å²	30.6	10%	0.102	14%	0.143	C	C	.	.	S	Bend	trans	-108.2	1.8	-177.3	49.5	8.4	0	0	0	114.3	T219 E254 V337	T219-D237 VanDerWaalsContact CG2-OD1 3.31Å; T219-D237 WeakPolarHBondContact CG2-OD1 3.46Å; D237-E254 HydrophobicContact CB-CB 4.25Å; D237-E254 HydrophobicContact CB-CG 4.14Å; D237-V337 HydrophobicContact CB-CG1 4.16Å; D237-V337 VanDerWaalsContact CG-CG1 3.42Å; D237-V337 WeakPolarHBondContact OD2-CG1 3.18Å
238	S	98.1	Very high	96.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.			trans	-58.6	147.3	159.6	-70.3	0	0	0	0	111.1	T219 N234 A384	T219-S238 PolarHBondContact OG1-OG 2.75Å; N234-S238 PolarHBondContact ND2-O 3.45Å; N234-S238 VanDerWaalsContact ND2-O 3.11Å; N234-S238 PolarHBondContact OD1-O 2.84Å; S238-A384 WeakPolarHBondContact CA-O 3.45Å
239	R	97.9	Very high	96.9	Very high	43 Å²	43	32.8 Å²	32.8	16%	0.162	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.7	-178.7	-53.5	-171.5	-66.3	-154.5	10.9	114.9	L221 S252 E254 M383 A384 W389	L221-R239 VanDerWaalsContact CD2-C 3.42Å; L221-R239 VanDerWaalsContact CD2-O 3.3Å; L221-R239 WeakPolarHBondContact CD2-O 3.35Å; R239-S252 WeakPolarHBondContact CA-OG 3.48Å; R239-E254 VanDerWaalsContact CD-OE1 3.23Å; R239-E254 WeakPolarHBondContact CD-OE1 3.32Å; R239-E254 HydrophobicContact CG-CG 3.78Å; R239-E254 IonicContact CZ-OE1 2.68Å; R239-E254 IonicContact NE-OE1 3.85Å; R239-E254 PolarHBondContact NE-OE1 2.77Å; R239-E254 IonicContact NH1-OE1 3.01Å; R239-E254 PolarHBondContact NH1-OE1 3.39Å; R239-M383 WeakPolarHBondContact O-CA 3.21Å; R239-A384 PolarHBondContact N-O 2.88Å; R239-A384 PolarHBondContact O-N 2.87Å; R239-W389 HydrophobicContact CB-CD2 4.23Å; R239-W389 HydrophobicContact CB-CG 4.29Å; R239-W389 HydrophobicContact CB-CZ2 4.16Å; R239-W389 HydrophobicContact CG-CG 4.35Å; R239-W389 VanDerWaalsContact NE-CG 3.28Å; R239-W389 WeakPolarHBondContact O-CZ2 3.2Å; R239-W389 PolarHBondContact O-NE1 3.44Å
240	A	98.8	Very high	97	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.7	172.2	0	0	0	0	0	111.7	L221 V232 L251 S252 I382 M383	L221-A240 HydrophobicContact CD1-CB 4.21Å; L221-A240 HydrophobicContact CD2-CB 4.17Å; V232-A240 HydrophobicContact CG1-CB 3.83Å; A240-L251 HydrophobicContact CB-CB 4.08Å; A240-L251 PolarHBondContact O-N 3.24Å; A240-S252 PolarHBondContact N-OG 2.87Å; A240-S252 PolarHBondContact O-N 3.35Å; A240-I382 CarbonylContact C-O 3.43Å; A240-I382 VanDerWaalsContact CA-O 3.23Å; A240-I382 WeakPolarHBondContact CA-O 3.42Å; A240-M383 HydrophobicContact CB-CG 3.92Å
241	I	98.7	Very high	97	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.8	171.3	66.4	176.5	0	0	0	110.5	V243 I248 R249 V381 I382 W389 N394 V397	I241-V243 HydrophobicContact CD1-CG2 3.92Å; I241-V243 HydrophobicContact CG1-CG2 4.07Å; I241-I248 HydrophobicContact CB-CG2 4.4Å; I241-I248 HydrophobicContact CD1-CG2 4.26Å; I241-R249 WeakPolarHBondContact CA-O 3.48Å; I241-V381 CarbonylContact O-C 3.54Å; I241-V381 WeakPolarHBondContact O-CA 3.25Å; I241-I382 HydrophobicContact CG1-CB 4.09Å; I241-I382 PolarHBondContact N-O 3.04Å; I241-I382 PolarHBondContact O-N 2.7Å; I241-W389 HydrophobicContact CD1-CH2 3.86Å; I241-W389 HydrophobicContact CD1-CZ3 4.16Å; I241-W389 HydrophobicContact CG1-CH2 3.96Å; I241-W389 HydrophobicContact CG2-CH2 4.45Å; I241-N394 HydrophobicContact CD1-CB 4.28Å; I241-V397 HydrophobicContact CD1-CB 4.34Å; I241-V397 HydrophobicContact CD1-CG1 4.11Å
242	L	98.5	Very high	97	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.1	164.1	166.8	59.9	0	0	0	108.5	R244 I248 R249 L251 L368 L373 V380 V381 L451	L242-R244 HydrophobicContact CD1-CG 3.75Å; L242-R244 HydrophobicContact CD2-CG 4.15Å; L242-R244 HydrophobicContact CG-CG 3.84Å; L242-I248 WeakPolarHBondContact O-CA 3.21Å; L242-R249 HydrophobicContact CB-CB 4.16Å; L242-R249 HydrophobicContact CD2-CB 4.33Å; L242-R249 PolarHBondContact N-O 2.72Å; L242-R249 PolarHBondContact O-N 3Å; L242-L251 HydrophobicContact CB-CD1 4.04Å; L242-L251 HydrophobicContact CB-CD2 4.39Å; L242-L251 HydrophobicContact CB-CG 4.23Å; L242-L368 HydrophobicContact CD2-CD2 3.89Å; L242-L373 HydrophobicContact CD2-CD1 4.31Å; L242-V380 WeakPolarHBondContact CD1-O 3.09Å; L242-V381 HydrophobicContact CB-CG2 4.43Å; L242-V381 HydrophobicContact CD1-CG2 4.28Å; L242-L451 HydrophobicContact CD1-CD1 3.54Å
243	V	98.3	Very high	96.8	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.5	171.6	-177.4	0	0	0	0	108.3	I241 V380 I382 A398 V401 R402	I241-V243 HydrophobicContact CD1-CG2 3.92Å; I241-V243 HydrophobicContact CG1-CG2 4.07Å; V243-V380 HydrophobicContact CB-CG2 4.34Å; V243-V380 PolarHBondContact N-O 3.21Å; V243-V380 PolarHBondContact O-N 3.15Å; V243-V380 VanDerWaalsContact O-N 3.1Å; V243-I382 HydrophobicContact CG2-CG1 4.14Å; V243-A398 HydrophobicContact CG1-CB 3.89Å; V243-A398 HydrophobicContact CG2-CB 4.15Å; V243-V401 HydrophobicContact CB-CG1 4.13Å; V243-V401 HydrophobicContact CG1-CB 4.08Å; V243-V401 HydrophobicContact CG1-CG1 3.81Å; V243-R402 HydrophobicContact CG1-CG 4.2Å
244	R	95	Very high	96.7	Very high	50 Å²	50	40.4 Å²	40.4	19%	0.189	19%	0.191	C	C	.	.			trans	-114.8	172.1	169.5	-59.3	-177.7	63.8	-147.2	2.7	109.9	L242 D246 E247 A374 D379 R402	L242-R244 HydrophobicContact CD1-CG 3.75Å; L242-R244 HydrophobicContact CD2-CG 4.15Å; L242-R244 HydrophobicContact CG-CG 3.84Å; R244-D246 VanDerWaalsContact C-N 3.3Å; R244-D246 PolarHBondContact O-N 3.02Å; R244-E247 HydrophobicContact CB-CB 4.37Å; R244-E247 PolarHBondContact N-O 2.74Å; R244-E247 IonicContact NH1-OE2 3.39Å; R244-E247 PolarHBondContact NH1-OE2 3.37Å; R244-A374 PolarHBondContact NH2-O 3.39Å; R244-D379 WeakPolarHBondContact CA-OD1 3.43Å; R244-D379 VanDerWaalsContact CB-OD1 3.26Å; R244-D379 WeakPolarHBondContact CB-OD1 3.46Å; R244-D379 HydrophobicContact CG-CB 4.15Å; R244-D379 WeakPolarHBondContact CG-OD1 3.32Å; R244-D379 IonicContact CZ-OD2 3.89Å; R244-D379 IonicContact NE-OD1 2.66Å; R244-D379 IonicContact NE-OD2 3.57Å; R244-D379 PolarHBondContact NE-OD2 3.2Å; R244-D379 IonicContact NH2-OD2 3.83Å; R244-R402 VanDerWaalsContact O-CZ 3.24Å; R244-R402 PolarHBondContact O-NE 2.75Å; R244-R402 PolarHBondContact O-NH2 3.22Å
245	R	89.4	Confident	96.6	Very high	155 Å²	155	40.7 Å²	40.7	59%	0.585	19%	0.192	S	C	*	.	S	Bend	trans	-48.4	-50.2	178.3	-174.3	-179	178	138.4	0.6	113.2	R402	R245-R402 VanDerWaalsContact O-CZ 3.23Å; R245-R402 PolarHBondContact O-NE 2.74Å
246	D	87.8	Confident	96.5	Very high	147 Å²	147	41.7 Å²	41.7	79%	0.786	20%	0.198	S	C	*	.	S	Bend	trans	-114.8	0.4	-171.9	-58.8	-49.1	0	0	0	113.9	R244	R244-D246 VanDerWaalsContact C-N 3.3Å; R244-D246 PolarHBondContact O-N 3.02Å
247	E	94.1	Very high	96.4	Very high	77 Å²	77	41.7 Å²	41.7	36%	0.36	20%	0.198	S	C	.	.			trans	-137.8	146.1	-171.9	-170.7	-173.1	174.7	0	0	111.7	R244 R402	R244-E247 HydrophobicContact CB-CB 4.37Å; R244-E247 PolarHBondContact N-O 2.74Å; R244-E247 IonicContact NH1-OE2 3.39Å; R244-E247 PolarHBondContact NH1-OE2 3.37Å; E247-R402 PolarHBondContact O-NH2 3.47Å
248	I	97.6	Very high	96.3	Very high	51 Å²	51	44.4 Å²	44.4	26%	0.262	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.6	162.4	-52.5	169.8	0	0	0	106.3	I241 L242 N394 E395 A398	I241-I248 HydrophobicContact CB-CG2 4.4Å; I241-I248 HydrophobicContact CD1-CG2 4.26Å; L242-I248 WeakPolarHBondContact O-CA 3.21Å; I248-N394 HydrophobicContact CG2-CB 4.38Å; I248-E395 HydrophobicContact CD1-CG 4.36Å; I248-A398 HydrophobicContact CD1-CB 3.34Å; I248-A398 HydrophobicContact CG1-CB 3.6Å
249	R	97.7	Very high	96.2	Very high	94 Å²	94	48.5 Å²	48.5	36%	0.355	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.2	176.1	-179.9	172.8	175.8	172.8	-3.3	109.7	I241 L242 L251 L368	I241-R249 WeakPolarHBondContact CA-O 3.48Å; L242-R249 HydrophobicContact CB-CB 4.16Å; L242-R249 HydrophobicContact CD2-CB 4.33Å; L242-R249 PolarHBondContact N-O 2.72Å; L242-R249 PolarHBondContact O-N 3Å; R249-L251 HydrophobicContact CG-CD2 4.17Å; R249-L251 PolarHBondContact O-N 3.33Å; R249-L368 VanDerWaalsContact CZ-CD1 3.43Å
250	V	98.3	Very high	96.1	Very high	71 Å²	71	47.8 Å²	47.8	43%	0.43	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.2	175	179.3	0	0	0	0	108.6	S252 T253	V250-S252 WeakPolarHBondContact CG1-O 3.44Å; V250-T253 HydrophobicContact CG1-CG2 4.37Å
251	L	98.5	Very high	96	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.236	C	C	.	.			trans	-104.7	-19.1	-179.8	-58.6	-179.6	0	0	0	112.4	L230 V232 A240 L242 R249 T366 L368 V381	L230-L251 HydrophobicContact CD2-CD1 4.26Å; V232-L251 HydrophobicContact CB-CB 4.25Å; V232-L251 HydrophobicContact CG1-CB 4.24Å; V232-L251 HydrophobicContact CG2-CB 4.01Å; V232-L251 HydrophobicContact CG2-CD1 4.04Å; A240-L251 HydrophobicContact CB-CB 4.08Å; A240-L251 PolarHBondContact O-N 3.24Å; L242-L251 HydrophobicContact CB-CD1 4.04Å; L242-L251 HydrophobicContact CB-CD2 4.39Å; L242-L251 HydrophobicContact CB-CG 4.23Å; R249-L251 HydrophobicContact CG-CD2 4.17Å; R249-L251 PolarHBondContact O-N 3.33Å; L251-T366 WeakPolarHBondContact O-CB 3.4Å; L251-T366 PolarHBondContact O-OG1 2.74Å; L251-L368 HydrophobicContact CD2-CD2 4.39Å; L251-V381 HydrophobicContact CD1-CG1 3.93Å; L251-V381 HydrophobicContact CD1-CG2 3.83Å
252	S	98.2	Very high	95.9	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.021	25%	0.253	C	S	.	.			trans	-145.4	154.2	169.2	67.2	0	0	0	0	112.3	R239 A240 V250	R239-S252 WeakPolarHBondContact CA-OG 3.48Å; A240-S252 PolarHBondContact N-OG 2.87Å; A240-S252 PolarHBondContact O-N 3.35Å; V250-S252 WeakPolarHBondContact CG1-O 3.44Å
253	T	94.6	Very high	95.8	Very high	73 Å²	73	54.3 Å²	54.3	45%	0.448	26%	0.262	S	S	.	.			trans	-115.2	155.9	172.6	53.8	0	0	0	0	110.6	N234 V250 Q364	N234-T253 PolarHBondContact ND2-O 3.28Å; V250-T253 HydrophobicContact CG1-CG2 4.37Å; T253-Q364 PolarHBondContact OG1-OE1 3.25Å
254	E	95.6	Very high	95.8	Very high	59 Å²	59	54.2 Å²	54.2	28%	0.276	26%	0.261	S	S	.	.			trans	-72.7	139.6	180	-63.4	163.1	-162	0	0	112.4	D237 R239 T256 T259	D237-E254 HydrophobicContact CB-CB 4.25Å; D237-E254 HydrophobicContact CB-CG 4.14Å; R239-E254 VanDerWaalsContact CD-OE1 3.23Å; R239-E254 WeakPolarHBondContact CD-OE1 3.32Å; R239-E254 HydrophobicContact CG-CG 3.78Å; R239-E254 IonicContact CZ-OE1 2.68Å; R239-E254 IonicContact NE-OE1 3.85Å; R239-E254 PolarHBondContact NE-OE1 2.77Å; R239-E254 IonicContact NH1-OE1 3.01Å; R239-E254 PolarHBondContact NH1-OE1 3.39Å; E254-T256 HydrophobicContact CB-CG2 4.03Å; E254-T259 PolarHBondContact O-OG1 3.04Å
255	F	97.4	Very high	95.9	Very high	6 Å²	6	52 Å²	52	3%	0.026	25%	0.253	C	S	.	.			trans	-102.8	73.4	174.8	-71.5	-71.6	0	0	0	111.3	N234 G236 E260 S338 R339 Q364	N234-F255 HydrophobicContact CB-CE2 4.31Å; N234-F255 VanDerWaalsContact O-CE2 3.31Å; N234-F255 WeakPolarHBondContact O-CE2 3.32Å; G236-F255 PolarHBondContact O-N 3.36Å; F255-E260 HydrophobicContact CD1-CG 3.73Å; F255-E260 HydrophobicContact CE1-CG 4.48Å; F255-S338 PolarHBondContact O-N 3.05Å; F255-S338 PolarHBondContact O-OG 3.2Å; F255-R339 HydrophobicContact CB-CB 3.91Å; F255-R339 HydrophobicContact CB-CG 3.83Å; F255-R339 HydrophobicContact CD1-CG 4.1Å; F255-R339 VanDerWaalsContact CE1-CZ 3.45Å; F255-R339 HydrophobicContact CG-CB 4.23Å; F255-R339 HydrophobicContact CG-CG 3.92Å; F255-Q364 HydrophobicContact CE1-CB 4.48Å; F255-Q364 HydrophobicContact CE2-CB 3.84Å; F255-Q364 HydrophobicContact CZ-CB 3.39Å; F255-Q364 HydrophobicContact CZ-CG 4.27Å
256	T	96.4	Very high	96.3	Very high	21 Å²	21	49.3 Å²	49.3	13%	0.129	25%	0.247	C	C	.	.			trans	-88.7	165	175	77.5	0	0	0	0	110.9	E254 E258 T259 E260 S338	E254-T256 HydrophobicContact CB-CG2 4.03Å; T256-E258 PolarHBondContact O-N 3.01Å; T256-E258 PolarHBondContact OG1-N 3.3Å; T256-T259 PolarHBondContact N-OG1 3.07Å; T256-T259 PolarHBondContact O-N 3.23Å; T256-T259 PolarHBondContact O-OG1 2.86Å; T256-T259 PolarHBondContact OG1-N 2.83Å; T256-E260 PolarHBondContact O-N 3.22Å; T256-E260 VanDerWaalsContact O-N 3.15Å; T256-S338 PolarHBondContact O-OG 3.2Å
257	P	96.6	Very high	96.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.3	172.8	-24.9	30.9	0	0	0	112.7	R261 I322 L331 A336	P257-R261 WeakPolarHBondContact O-CA 3.22Å; P257-R261 PolarHBondContact O-N 3.15Å; P257-I322 HydrophobicContact CB-CB 4.43Å; P257-I322 HydrophobicContact CB-CD1 4.41Å; P257-I322 HydrophobicContact CB-CG1 3.9Å; P257-I322 HydrophobicContact CB-CG2 3.86Å; P257-I322 WeakPolarHBondContact O-CD1 3.29Å; P257-L331 HydrophobicContact CB-CB 4.29Å; P257-L331 HydrophobicContact CG-CB 3.86Å; P257-A336 WeakPolarHBondContact CD-O 3.4Å
258	E	95	Very high	96.8	Very high	76 Å²	76	39.8 Å²	39.8	36%	0.355	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-45.1	179.5	-69	-176.3	128.8	0	0	112.3	T256 E260 R261 I322 Q325 G326 A329	T256-E258 PolarHBondContact O-N 3.01Å; T256-E258 PolarHBondContact OG1-N 3.3Å; E258-E260 PolarHBondContact O-N 2.99Å; E258-R261 WeakPolarHBondContact O-CB 2.86Å; E258-R261 PolarHBondContact O-N 2.9Å; E258-I322 HydrophobicContact CG-CG2 4.19Å; E258-Q325 WeakPolarHBondContact OE1-CA 3.39Å; E258-G326 PolarHBondContact OE1-N 3.39Å; E258-G326 VanDerWaalsContact OE2-CA 3.29Å; E258-G326 WeakPolarHBondContact OE2-CA 3.23Å; E258-G326 PolarHBondContact OE2-N 2.87Å; E258-A329 HydrophobicContact CG-CB 3.82Å
259	T	95.1	Very high	96.8	Very high	86 Å²	86	42.3 Å²	42.3	53%	0.528	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-30.7	179.7	61.1	0	0	0	0	111.7	E254 T256	E254-T259 PolarHBondContact O-OG1 3.04Å; T256-T259 PolarHBondContact N-OG1 3.07Å; T256-T259 PolarHBondContact O-N 3.23Å; T256-T259 PolarHBondContact O-OG1 2.86Å; T256-T259 PolarHBondContact OG1-N 2.83Å
260	E	96.6	Very high	96.7	Very high	28 Å²	28	42.1 Å²	42.1	13%	0.131	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	14.6	-179.9	-68.7	-92.3	118.2	0	0	113.6	F255 T256 E258 Q262 R263 I264 S338 R339	F255-E260 HydrophobicContact CD1-CG 3.73Å; F255-E260 HydrophobicContact CE1-CG 4.48Å; T256-E260 PolarHBondContact O-N 3.22Å; T256-E260 VanDerWaalsContact O-N 3.15Å; E258-E260 PolarHBondContact O-N 2.99Å; E260-Q262 VanDerWaalsContact C-N 3.31Å; E260-Q262 PolarHBondContact O-N 2.98Å; E260-R263 WeakPolarHBondContact O-CB 3.36Å; E260-R263 PolarHBondContact O-N 2.84Å; E260-R263 VanDerWaalsContact O-N 3.08Å; E260-R263 WeakPolarHBondContact OE2-CD 3.08Å; E260-R263 IonicContact OE2-CZ 3.36Å; E260-R263 IonicContact OE2-NE 3.7Å; E260-R263 PolarHBondContact OE2-NE 3.15Å; E260-R263 IonicContact OE2-NH2 3.07Å; E260-I264 HydrophobicContact CB-CD1 4.15Å; E260-I264 PolarHBondContact O-N 3.1Å; E260-S338 WeakPolarHBondContact CB-OG 3.46Å; E260-S338 VanDerWaalsContact CG-OG 3.31Å; E260-S338 WeakPolarHBondContact CG-OG 3.39Å; E260-R339 VanDerWaalsContact CD-NH2 3.31Å; E260-R339 IonicContact OE1-CZ 2.83Å; E260-R339 IonicContact OE1-NE 3.04Å; E260-R339 IonicContact OE1-NH2 3.95Å; E260-R339 PolarHBondContact OE1-NH2 3.05Å; E260-R339 IonicContact OE2-CZ 3.68Å; E260-R339 IonicContact OE2-NE 3.59Å; E260-R339 PolarHBondContact OE2-NE 3.2Å; E260-R339 IonicContact OE2-NH2 2.97Å; E260-R339 PolarHBondContact OE2-NH2 2.9Å
261	R	96.8	Very high	96.6	Very high	14 Å²	14	39.8 Å²	39.8	5%	0.053	20%	0.197	C	C	.	.	H	α-helix	trans	-48.1	-49.7	-176.3	174.8	-158.4	60.7	101.3	-7.9	113	P257 E258 R263 I264 Q265 E283 D301 M304 I322	P257-R261 WeakPolarHBondContact O-CA 3.22Å; P257-R261 PolarHBondContact O-N 3.15Å; E258-R261 WeakPolarHBondContact O-CB 2.86Å; E258-R261 PolarHBondContact O-N 2.9Å; R261-R263 VanDerWaalsContact C-N 3.33Å; R261-R263 PolarHBondContact O-N 3.49Å; R261-I264 PolarHBondContact O-N 2.63Å; R261-Q265 HydrophobicContact CG-CG 4.2Å; R261-Q265 WeakPolarHBondContact O-CB 3.4Å; R261-Q265 WeakPolarHBondContact O-CG 3.5Å; R261-Q265 PolarHBondContact O-N 3.47Å; R261-E283 WeakPolarHBondContact CD-OE2 3.46Å; R261-E283 IonicContact NE-OE2 3.86Å; R261-D301 PolarHBondContact NH1-O 2.9Å; R261-M304 PolarHBondContact NH1-O 3.33Å; R261-M304 PolarHBondContact NH2-O 3.21Å; R261-I322 HydrophobicContact CB-CD1 3.61Å; R261-I322 HydrophobicContact CG-CD1 3.65Å
262	Q	96.4	Very high	96.4	Very high	74 Å²	74	43.4 Å²	43.4	35%	0.346	22%	0.22	S	C	.	.	H	α-helix	trans	-62.4	-42	-175.6	-76.7	-176.1	-37.2	0	0	111.8	E260 Q266 M304 N305	E260-Q262 VanDerWaalsContact C-N 3.31Å; E260-Q262 PolarHBondContact O-N 2.98Å; Q262-Q266 WeakPolarHBondContact O-CB 3.32Å; Q262-Q266 PolarHBondContact O-N 2.81Å; Q262-M304 PolarHBondContact NE2-O 3.35Å; Q262-N305 PolarHBondContact NE2-OD1 3.29Å
263	R	96.5	Very high	96.2	Very high	52 Å²	52	47.9 Å²	47.9	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-46.9	175.4	-176.9	-171	64.3	75.2	-4.4	111	E260 R261 Q266 L267 S338 F358	E260-R263 WeakPolarHBondContact O-CB 3.36Å; E260-R263 PolarHBondContact O-N 2.84Å; E260-R263 VanDerWaalsContact O-N 3.08Å; E260-R263 WeakPolarHBondContact OE2-CD 3.08Å; E260-R263 IonicContact OE2-CZ 3.36Å; E260-R263 IonicContact OE2-NE 3.7Å; E260-R263 PolarHBondContact OE2-NE 3.15Å; E260-R263 IonicContact OE2-NH2 3.07Å; R261-R263 VanDerWaalsContact C-N 3.33Å; R261-R263 PolarHBondContact O-N 3.49Å; R263-Q266 PolarHBondContact O-N 2.85Å; R263-L267 PolarHBondContact O-N 3.31Å; R263-S338 PolarHBondContact NH2-O 3.23Å; R263-F358 PolarHBondContact NH1-O 2.98Å; R263-F358 PolarHBondContact NH2-O 3.38Å
264	I	97.5	Very high	96.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-47.7	-179.5	-69.7	159	0	0	0	110.8	E260 R261 L267 A268 L321 L331 F358	E260-I264 HydrophobicContact CB-CD1 4.15Å; E260-I264 PolarHBondContact O-N 3.1Å; R261-I264 PolarHBondContact O-N 2.63Å; I264-L267 PolarHBondContact O-N 3.13Å; I264-A268 PolarHBondContact O-N 3.4Å; I264-A268 VanDerWaalsContact O-N 3.13Å; I264-L321 HydrophobicContact CG2-CB 4.04Å; I264-L321 HydrophobicContact CG2-CD1 3.93Å; I264-L321 HydrophobicContact CG2-CG 4.43Å; I264-L331 HydrophobicContact CD1-CD1 3.91Å; I264-L331 HydrophobicContact CG1-CD1 4.26Å; I264-L331 HydrophobicContact CG2-CD1 4.06Å; I264-F358 HydrophobicContact CG2-CD1 3.96Å; I264-F358 HydrophobicContact CG2-CE1 4.46Å
265	Q	97.6	Very high	96	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.019	21%	0.214	C	C	.	.	H	α-helix	trans	-67.9	-36.8	177.2	-69.7	-179.7	-45.4	0	0	112.5	R261 L267 A268 F269 R281 H302 L321	R261-Q265 HydrophobicContact CG-CG 4.2Å; R261-Q265 WeakPolarHBondContact O-CB 3.4Å; R261-Q265 WeakPolarHBondContact O-CG 3.5Å; R261-Q265 PolarHBondContact O-N 3.47Å; Q265-L267 VanDerWaalsContact C-N 3.33Å; Q265-A268 PolarHBondContact O-N 2.93Å; Q265-F269 WeakPolarHBondContact O-CB 3.21Å; Q265-F269 PolarHBondContact O-N 2.97Å; Q265-R281 WeakPolarHBondContact CG-O 3.43Å; Q265-R281 PolarHBondContact NE2-O 3.22Å; Q265-H302 HydrophobicContact CB-CB 3.66Å; Q265-L321 HydrophobicContact CG-CD1 4.2Å
266	Q	97.7	Very high	95.7	Very high	99 Å²	99	45.7 Å²	45.7	46%	0.463	24%	0.237	S	C	.	.	H	α-helix	trans	-64.8	-40.2	176.6	-178.6	172.1	5.2	0	0	110.9	Q262 R263 F269 I270 H302	Q262-Q266 WeakPolarHBondContact O-CB 3.32Å; Q262-Q266 PolarHBondContact O-N 2.81Å; R263-Q266 PolarHBondContact O-N 2.85Å; Q266-F269 WeakPolarHBondContact O-CB 3.28Å; Q266-F269 PolarHBondContact O-N 3.35Å; Q266-I270 HydrophobicContact CG-CD1 3.97Å; Q266-I270 WeakPolarHBondContact O-CG1 3.19Å; Q266-I270 PolarHBondContact O-N 3.35Å; Q266-H302 HydrophobicContact CB-CB 4.14Å
267	L	96.6	Very high	95.5	Very high	23 Å²	23	46.7 Å²	46.7	12%	0.12	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-46.9	174	-173.4	72.6	0	0	0	111.3	F6 R263 I264 Q265 F269 I270 Y271 L274 P357 F358	F6-L267 HydrophobicContact CE1-CD1 4.12Å; F6-L267 HydrophobicContact CE2-CD1 3.81Å; F6-L267 HydrophobicContact CZ-CD1 3.52Å; F6-L267 HydrophobicContact CZ-CD2 4.09Å; F6-L267 HydrophobicContact CZ-CG 4.25Å; R263-L267 PolarHBondContact O-N 3.31Å; I264-L267 PolarHBondContact O-N 3.13Å; Q265-L267 VanDerWaalsContact C-N 3.33Å; L267-F269 VanDerWaalsContact C-N 3.25Å; L267-F269 PolarHBondContact O-N 2.87Å; L267-I270 PolarHBondContact O-N 3.06Å; L267-Y271 HydrophobicContact CD1-CD2 3.6Å; L267-Y271 HydrophobicContact CD1-CE2 3.94Å; L267-Y271 HydrophobicContact CG-CD2 4.32Å; L267-Y271 PolarHBondContact O-N 3.23Å; L267-L274 HydrophobicContact CD2-CD1 3.94Å; L267-L274 HydrophobicContact CG-CD1 3.95Å; L267-P357 HydrophobicContact CD2-CB 4.28Å; L267-P357 WeakPolarHBondContact CD2-O 3.44Å; L267-F358 HydrophobicContact CD2-CD1 3.75Å; L267-F358 HydrophobicContact CD2-CE1 3.95Å; L267-F358 HydrophobicContact CD2-CG 4.25Å
268	A	96.1	Very high	95.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-28.1	175.9	0	0	0	0	0	113.9	I264 Q265 P272 L275 R281 L321 F358	I264-A268 PolarHBondContact O-N 3.4Å; I264-A268 VanDerWaalsContact O-N 3.13Å; Q265-A268 PolarHBondContact O-N 2.93Å; A268-P272 VanDerWaalsContact O-CA 3.3Å; A268-P272 WeakPolarHBondContact O-CA 3.14Å; A268-L275 HydrophobicContact CB-CD1 4.22Å; A268-L275 HydrophobicContact CB-CD2 3.74Å; A268-L275 HydrophobicContact CB-CG 4.26Å; A268-R281 HydrophobicContact CB-CB 3.79Å; A268-L321 HydrophobicContact CB-CD1 3.56Å; A268-F358 HydrophobicContact CB-CE1 4.37Å
269	F	96.8	Very high	95.3	Very high	104 Å²	104	48.3 Å²	48.3	46%	0.456	26%	0.258	S	S	.	.	H	α-helix	trans	-72	-43.7	173	172.3	-100.5	0	0	0	111.7	Q265 Q266 L267 H302	Q265-F269 WeakPolarHBondContact O-CB 3.21Å; Q265-F269 PolarHBondContact O-N 2.97Å; Q266-F269 WeakPolarHBondContact O-CB 3.28Å; Q266-F269 PolarHBondContact O-N 3.35Å; L267-F269 VanDerWaalsContact C-N 3.25Å; L267-F269 PolarHBondContact O-N 2.87Å; F269-H302 AromaticContact CD1-CE1 4Å; F269-H302 AromaticContact CD1-NE2 3.8Å; F269-H302 AromaticContact CD2-CD2 3.91Å; F269-H302 AromaticContact CD2-NE2 3.77Å; F269-H302 AromaticContact CG-CD2 3.72Å; F269-H302 AromaticContact CG-NE2 3.66Å
270	I	97.1	Very high	95.3	Very high	90 Å²	90	44.8 Å²	44.8	46%	0.462	24%	0.236	S	C	.	.	H	α-helix	trans	-72.8	-36.4	-179.8	-63.4	168.8	0	0	0	111.4	Q266 L267	Q266-I270 HydrophobicContact CG-CD1 3.97Å; Q266-I270 WeakPolarHBondContact O-CG1 3.19Å; Q266-I270 PolarHBondContact O-N 3.35Å; L267-I270 PolarHBondContact O-N 3.06Å
271	Y	96.1	Very high	95.2	Very high	22 Å²	22	47.2 Å²	47.2	9%	0.086	24%	0.244	C	C	.	.			trans	-128.4	69.3	-175.2	-56.6	-71.6	0	0	0	111.1	F6 L11 L267 E273 L274	F6-Y271 AromaticContact CD1-CD2 3.96Å; F6-Y271 HydrophobicContact CD1-CD2 3.96Å; F6-Y271 HydrophobicContact CD1-CE1 4.12Å; F6-Y271 AromaticContact CD1-CE2 3.52Å; F6-Y271 HydrophobicContact CD1-CE2 3.52Å; F6-Y271 HydrophobicContact CD1-CG 4.42Å; F6-Y271 AromaticContact CD1-CZ 3.6Å; F6-Y271 AromaticContact CE1-CD2 3.62Å; F6-Y271 HydrophobicContact CE1-CD2 3.62Å; F6-Y271 AromaticContact CE1-CE2 3.67Å; F6-Y271 HydrophobicContact CE1-CE2 3.67Å; F6-Y271 HydrophobicContact CE1-CG 4.05Å; F6-Y271 HydrophobicContact CG-CE2 4.17Å; F6-Y271 HydrophobicContact CZ-CD2 4.32Å; F6-Y271 HydrophobicContact CZ-CE2 4.42Å; L11-Y271 HydrophobicContact CD1-CD1 3.59Å; L11-Y271 HydrophobicContact CD1-CE1 3.9Å; L11-Y271 HydrophobicContact CD1-CG 4.36Å; L267-Y271 HydrophobicContact CD1-CD2 3.6Å; L267-Y271 HydrophobicContact CD1-CE2 3.94Å; L267-Y271 HydrophobicContact CG-CD2 4.32Å; L267-Y271 PolarHBondContact O-N 3.23Å; Y271-E273 VanDerWaalsContact CA-OE2 3.29Å; Y271-E273 WeakPolarHBondContact CA-OE2 3.47Å; Y271-E273 WeakPolarHBondContact CB-OE1 2.9Å; Y271-E273 WeakPolarHBondContact CD1-OE1 3.47Å; Y271-E273 PolarHBondContact O-N 3.12Å; Y271-E273 VanDerWaalsContact O-N 3.15Å; Y271-L274 HydrophobicContact CG-CD1 4.48Å; Y271-L274 WeakPolarHBondContact O-CB 3.45Å; Y271-L274 WeakPolarHBondContact O-CG 3.42Å; Y271-L274 PolarHBondContact O-N 2.89Å; Y271-L274 VanDerWaalsContact O-N 3.08Å
272	P	94.3	Very high	95.2	Very high	77 Å²	77	47.2 Å²	47.2	50%	0.5	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-61.8	-20.7	-177.3	25.9	-35.5	0	0	0	114	A268 L274 L275	A268-P272 VanDerWaalsContact O-CA 3.3Å; A268-P272 WeakPolarHBondContact O-CA 3.14Å; P272-L274 PolarHBondContact O-N 2.86Å; P272-L275 VanDerWaalsContact O-CB 3.3Å; P272-L275 WeakPolarHBondContact O-CB 3.31Å; P272-L275 WeakPolarHBondContact O-CG 3.4Å; P272-L275 PolarHBondContact O-N 2.85Å; P272-L275 VanDerWaalsContact O-N 3.1Å
273	E	93.9	Very high	95.2	Very high	97 Å²	97	45.4 Å²	45.4	45%	0.453	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-61.5	-26.2	173.8	67.7	-79.9	-170.4	0	0	113.2	L11 Y271 L275 A276	L11-E273 WeakPolarHBondContact CD1-OE1 3.33Å; L11-E273 HydrophobicContact CD2-CG 3.46Å; L11-E273 VanDerWaalsContact CD2-CG 3.46Å; L11-E273 VanDerWaalsContact CD2-OE1 3.23Å; L11-E273 WeakPolarHBondContact CD2-OE1 3.41Å; Y271-E273 VanDerWaalsContact CA-OE2 3.29Å; Y271-E273 WeakPolarHBondContact CA-OE2 3.47Å; Y271-E273 WeakPolarHBondContact CB-OE1 2.9Å; Y271-E273 WeakPolarHBondContact CD1-OE1 3.47Å; Y271-E273 PolarHBondContact O-N 3.12Å; Y271-E273 VanDerWaalsContact O-N 3.15Å; E273-L275 PolarHBondContact O-N 2.97Å; E273-A276 PolarHBondContact O-N 3.03Å; E273-A276 VanDerWaalsContact O-N 3.1Å
274	L	93.6	Very high	95.2	Very high	18 Å²	18	44 Å²	44	9%	0.094	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-64.6	-19.6	174.9	-64.1	178.4	0	0	0	112.7	F6 L11 L267 Y271 P272 A276 P357 F358	F6-L274 HydrophobicContact CE1-CD1 4.12Å; F6-L274 HydrophobicContact CZ-CD1 4.05Å; L11-L274 HydrophobicContact CD2-CD2 3.64Å; L11-L274 HydrophobicContact CD2-CG 4.25Å; L267-L274 HydrophobicContact CD2-CD1 3.94Å; L267-L274 HydrophobicContact CG-CD1 3.95Å; Y271-L274 HydrophobicContact CG-CD1 4.48Å; Y271-L274 WeakPolarHBondContact O-CB 3.45Å; Y271-L274 WeakPolarHBondContact O-CG 3.42Å; Y271-L274 PolarHBondContact O-N 2.89Å; Y271-L274 VanDerWaalsContact O-N 3.08Å; P272-L274 PolarHBondContact O-N 2.86Å; L274-A276 VanDerWaalsContact C-N 3.28Å; L274-P357 HydrophobicContact CD1-CB 3.92Å; L274-P357 HydrophobicContact CD2-CB 4.14Å; L274-P357 HydrophobicContact CD2-CG 4.1Å; L274-F358 HydrophobicContact CB-CE2 4Å; L274-F358 HydrophobicContact CB-CZ 3.77Å; L274-F358 HydrophobicContact CD1-CE2 4.48Å; L274-F358 HydrophobicContact CD1-CZ 4.22Å
275	L	92.4	Very high	95.1	Very high	14 Å²	14	47.1 Å²	47.1	7%	0.073	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-80.5	-11.9	178.1	-54.2	-178.3	0	0	0	112.8	A268 P272 E273 G277 E278 F279 L321 F358	A268-L275 HydrophobicContact CB-CD1 4.22Å; A268-L275 HydrophobicContact CB-CD2 3.74Å; A268-L275 HydrophobicContact CB-CG 4.26Å; P272-L275 VanDerWaalsContact O-CB 3.3Å; P272-L275 WeakPolarHBondContact O-CB 3.31Å; P272-L275 WeakPolarHBondContact O-CG 3.4Å; P272-L275 PolarHBondContact O-N 2.85Å; P272-L275 VanDerWaalsContact O-N 3.1Å; E273-L275 PolarHBondContact O-N 2.97Å; L275-G277 PolarHBondContact O-N 2.89Å; L275-E278 PolarHBondContact O-N 3.48Å; L275-F279 HydrophobicContact CB-CB 4.13Å; L275-F279 HydrophobicContact CD2-CB 3.89Å; L275-F279 PolarHBondContact O-N 2.99Å; L275-L321 HydrophobicContact CD2-CD1 4.46Å; L275-L321 HydrophobicContact CD2-CD2 3.54Å; L275-L321 HydrophobicContact CD2-CG 4.33Å; L275-F358 HydrophobicContact CD2-CZ 4.31Å
276	A	91.3	Very high	94.8	Very high	60 Å²	60	53.3 Å²	53.3	50%	0.496	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	22.8	-175.4	0	0	0	0	0	114.9	E273 L274 E278 I353	E273-A276 PolarHBondContact O-N 3.03Å; E273-A276 VanDerWaalsContact O-N 3.1Å; L274-A276 VanDerWaalsContact C-N 3.28Å; A276-E278 PolarHBondContact O-N 2.78Å; A276-I353 HydrophobicContact CB-CD1 3.73Å; A276-I353 HydrophobicContact CB-CG1 3.74Å
277	G	91.4	Very high	94.6	Very high	41 Å²	41	54.9 Å²	54.9	42%	0.423	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	-5.2	-174.1	0	0	0	0	0	115.4	L275 K318	L275-G277 PolarHBondContact O-N 2.89Å; G277-K318 VanDerWaalsContact O-CD 3.23Å; G277-K318 WeakPolarHBondContact O-CD 3.39Å; G277-K318 WeakPolarHBondContact O-CE 3.15Å; G277-K318 PolarHBondContact O-NZ 3.33Å
278	E	92.1	Very high	94.6	Very high	100 Å²	100	54.3 Å²	54.3	47%	0.467	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-30.2	-176.4	-64.1	-58	142.9	0	0	113.1	L275 A276 K318 Y319 I353	L275-E278 PolarHBondContact O-N 3.48Å; A276-E278 PolarHBondContact O-N 2.78Å; E278-K318 WeakPolarHBondContact O-CB 3.29Å; E278-Y319 PolarHBondContact O-N 3.19Å; E278-I353 HydrophobicContact CB-CD1 4.34Å
279	F	94.8	Very high	94.6	Very high	10 Å²	10	61.2 Å²	61.2	4%	0.044	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	149.3	-176	-70.5	-93.6	0	0	0	112.5	L275 Y319 P320 L321 H323 L332 V348 I353	L275-F279 HydrophobicContact CB-CB 4.13Å; L275-F279 HydrophobicContact CD2-CB 3.89Å; L275-F279 PolarHBondContact O-N 2.99Å; F279-Y319 CarbonylContact C-O 3.54Å; F279-Y319 WeakPolarHBondContact CA-O 3.4Å; F279-Y319 WeakPolarHBondContact CD1-O 3.19Å; F279-P320 WeakPolarHBondContact CD1-O 3.28Å; F279-L321 HydrophobicContact CB-CD2 4.25Å; F279-H323 AromaticContact CE1-NE2 3.79Å; F279-L332 HydrophobicContact CD1-CD2 3.64Å; F279-L332 HydrophobicContact CD2-CD2 4.28Å; F279-L332 HydrophobicContact CE1-CB 4.19Å; F279-L332 HydrophobicContact CE1-CD2 3.69Å; F279-L332 HydrophobicContact CE2-CD2 4.35Å; F279-L332 HydrophobicContact CG-CD2 3.96Å; F279-L332 HydrophobicContact CZ-CB 4.23Å; F279-L332 HydrophobicContact CZ-CD2 4.07Å; F279-V348 HydrophobicContact CE2-CG1 4.31Å; F279-V348 HydrophobicContact CZ-CG1 3.93Å; F279-I353 HydrophobicContact CD2-CD1 3.66Å; F279-I353 HydrophobicContact CE2-CD1 3.57Å
280	T	95.2	Very high	94.5	Very high	12 Å²	12	58.3 Å²	58.3	7%	0.074	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.8	164.6	-178.4	0	0	0	0	109.5	L282 F284 K318 Y319 L321	T280-L282 VanDerWaalsContact C-N 3.27Å; T280-L282 PolarHBondContact OG1-N 2.84Å; T280-L282 VanDerWaalsContact OG1-N 3.12Å; T280-F284 HydrophobicContact CG2-CE2 4.35Å; T280-K318 HydrophobicContact CG2-CB 4.24Å; T280-Y319 PolarHBondContact N-O 3.45Å; T280-L321 PolarHBondContact O-N 3.34Å
281	R	95.9	Very high	94.5	Very high	79 Å²	79	61.4 Å²	61.4	30%	0.298	32%	0.322	S	S	.	.	S	Bend	trans	-73.7	-23.5	170.2	75.7	178.2	-172.9	-75.6	-9.9	112	Q265 A268 D301 L321	Q265-R281 WeakPolarHBondContact CG-O 3.43Å; Q265-R281 PolarHBondContact NE2-O 3.22Å; A268-R281 HydrophobicContact CB-CB 3.79Å; R281-D301 WeakPolarHBondContact CD-OD1 3.21Å; R281-D301 IonicContact CZ-OD2 2.93Å; R281-D301 IonicContact NE-OD1 3.63Å; R281-D301 PolarHBondContact NE-OD1 2.77Å; R281-D301 IonicContact NE-OD2 2.82Å; R281-D301 PolarHBondContact NE-OD2 2.99Å; R281-D301 IonicContact NH2-OD2 2.67Å; R281-D301 PolarHBondContact NH2-OD2 3.09Å; R281-L321 HydrophobicContact CB-CD1 3.95Å
282	L	96.8	Very high	94.6	Very high	15 Å²	15	61.3 Å²	61.3	8%	0.079	32%	0.322	C	S	.	.			trans	-69.8	138.5	-178.5	-60.4	-174.1	0	0	0	109.4	T280 F284 F299 D301 K310	T280-L282 VanDerWaalsContact C-N 3.27Å; T280-L282 PolarHBondContact OG1-N 2.84Å; T280-L282 VanDerWaalsContact OG1-N 3.12Å; L282-F284 HydrophobicContact CB-CE2 3.75Å; L282-F284 HydrophobicContact CB-CZ 3.82Å; L282-F284 HydrophobicContact CD1-CZ 4.13Å; L282-F299 HydrophobicContact CD1-CD2 4.23Å; L282-F299 HydrophobicContact CD2-CD2 4.15Å; L282-F299 HydrophobicContact CD2-CE2 4.44Å; L282-D301 HydrophobicContact CD2-CB 3.68Å; L282-D301 WeakPolarHBondContact CD2-OD2 3.1Å; L282-K310 HydrophobicContact CD1-CD 3.91Å
283	E	96.5	Very high	94.7	Very high	36 Å²	36	61.5 Å²	61.5	17%	0.168	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-102.6	140.5	172.9	-172.6	-175.3	166.1	0	0	110.1	R261 F299 R300 W307	R261-E283 WeakPolarHBondContact CD-OE2 3.46Å; R261-E283 IonicContact NE-OE2 3.86Å; E283-F299 CarbonylContact O-C 3.49Å; E283-F299 VanDerWaalsContact O-CA 3.22Å; E283-F299 WeakPolarHBondContact O-CA 3.35Å; E283-R300 HydrophobicContact CB-CG 3.98Å; E283-R300 VanDerWaalsContact CD-NE 3.3Å; E283-R300 PolarHBondContact N-O 3.43Å; E283-R300 PolarHBondContact O-N 3.3Å; E283-R300 IonicContact OE1-CZ 3.61Å; E283-R300 IonicContact OE1-NE 3.62Å; E283-R300 IonicContact OE1-NH2 3.89Å; E283-R300 PolarHBondContact OE1-NH2 2.88Å; E283-R300 IonicContact OE2-CZ 2.65Å; E283-R300 IonicContact OE2-NE 3.93Å; E283-R300 PolarHBondContact OE2-NE 3.42Å; E283-R300 IonicContact OE2-NH2 3.98Å; E283-R300 PolarHBondContact OE2-NH2 3.35Å; E283-W307 HydrophobicContact CG-CH2 4.31Å
284	F	96.4	Very high	94.9	Very high	21 Å²	21	58.5 Å²	58.5	9%	0.092	31%	0.314	C	S	.	.			trans	-125.9	156.5	177.9	-58.5	-83.5	0	0	0	108.8	T280 L282 R286 L288 V297 L298 F299 K310 D316	T280-F284 HydrophobicContact CG2-CE2 4.35Å; L282-F284 HydrophobicContact CB-CE2 3.75Å; L282-F284 HydrophobicContact CB-CZ 3.82Å; L282-F284 HydrophobicContact CD1-CZ 4.13Å; F284-R286 WeakPolarHBondContact CB-O 3.25Å; F284-R286 PolarHBondContact O-N 3.22Å; F284-L288 HydrophobicContact CB-CD2 4.4Å; F284-L288 HydrophobicContact CB-CG 4.27Å; F284-L288 HydrophobicContact CD1-CD1 3.66Å; F284-L288 HydrophobicContact CD1-CD2 4.45Å; F284-L288 HydrophobicContact CD1-CG 4.21Å; F284-L288 HydrophobicContact CD2-CD1 3.93Å; F284-L288 HydrophobicContact CD2-CG 4.17Å; F284-L288 HydrophobicContact CE1-CD1 3.67Å; F284-L288 HydrophobicContact CE2-CD1 3.93Å; F284-L288 HydrophobicContact CG-CD1 3.8Å; F284-L288 HydrophobicContact CG-CD2 4.41Å; F284-L288 HydrophobicContact CG-CG 3.96Å; F284-L288 HydrophobicContact CZ-CD1 3.82Å; F284-V297 HydrophobicContact CD1-CG2 3.78Å; F284-V297 HydrophobicContact CE1-CG2 3.84Å; F284-L298 WeakPolarHBondContact CD1-O 3.46Å; F284-F299 HydrophobicContact CD1-CB 3.81Å; F284-F299 HydrophobicContact CE1-CB 3.59Å; F284-F299 HydrophobicContact CZ-CB 4.4Å; F284-K310 HydrophobicContact CE1-CD 4.16Å; F284-K310 HydrophobicContact CE1-CG 4.43Å; F284-K310 HydrophobicContact CZ-CD 4.35Å; F284-D316 HydrophobicContact CE2-CB 3.99Å; F284-D316 HydrophobicContact CZ-CB 3.64Å
285	P	94.1	Very high	95.1	Very high	66 Å²	66	63.3 Å²	63.3	43%	0.429	34%	0.336	S	S	.	.	S	Bend	trans	-58.3	-23.1	178.3	-25.9	33.8	0	0	0	114.5	L298 W307	P285-L298 WeakPolarHBondContact CD-O 3.36Å; P285-L298 HydrophobicContact CG-CB 3.78Å; P285-L298 HydrophobicContact CG-CD1 4.29Å; P285-W307 HydrophobicContact CG-CH2 4.38Å; P285-W307 HydrophobicContact CG-CZ3 4.06Å
286	R	92.6	Very high	95.4	Very high	134 Å²	134	69.8 Å²	69.8	51%	0.506	36%	0.364	S	S	.	.	S	Bend	trans	-150	165.6	171.9	61	164.5	176.2	78.5	-0.7	110	F284 L288 D292	F284-R286 WeakPolarHBondContact CB-O 3.25Å; F284-R286 PolarHBondContact O-N 3.22Å; R286-L288 PolarHBondContact O-N 3.28Å; R286-D292 IonicContact CZ-OD1 3.57Å; R286-D292 IonicContact CZ-OD2 2.99Å; R286-D292 IonicContact NH1-OD1 3.54Å; R286-D292 IonicContact NH1-OD2 2.73Å; R286-D292 PolarHBondContact NH1-OD2 3.29Å; R286-D292 IonicContact NH2-OD1 3.34Å; R286-D292 PolarHBondContact NH2-OD1 3.12Å; R286-D292 IonicContact NH2-OD2 3.15Å; R286-D292 PolarHBondContact NH2-OD2 3.25Å
287	R	92.6	Very high	95.7	Very high	133 Å²	133	68 Å²	68	50%	0.502	35%	0.346	S	S	.	.			trans	-58.2	127.9	168.3	-173.2	174.6	178.6	-167.9	-1	110.2	Y319	R287-Y319 PolarHBondContact NH2-OH 3.13Å
288	L	95.9	Very high	96	Very high	10 Å²	10	68.9 Å²	68.9	5%	0.052	34%	0.341	C	S	.	.			trans	-79.2	150.6	176.4	-59.6	-178	0	0	0	111	F284 R286 D292 V297 V312 D316 L317	F284-L288 HydrophobicContact CB-CD2 4.4Å; F284-L288 HydrophobicContact CB-CG 4.27Å; F284-L288 HydrophobicContact CD1-CD1 3.66Å; F284-L288 HydrophobicContact CD1-CD2 4.45Å; F284-L288 HydrophobicContact CD1-CG 4.21Å; F284-L288 HydrophobicContact CD2-CD1 3.93Å; F284-L288 HydrophobicContact CD2-CG 4.17Å; F284-L288 HydrophobicContact CE1-CD1 3.67Å; F284-L288 HydrophobicContact CE2-CD1 3.93Å; F284-L288 HydrophobicContact CG-CD1 3.8Å; F284-L288 HydrophobicContact CG-CD2 4.41Å; F284-L288 HydrophobicContact CG-CG 3.96Å; F284-L288 HydrophobicContact CZ-CD1 3.82Å; R286-L288 PolarHBondContact O-N 3.28Å; L288-D292 WeakPolarHBondContact CA-OD2 3.31Å; L288-D292 HydrophobicContact CB-CB 4.5Å; L288-D292 HydrophobicContact CD2-CB 4.34Å; L288-V297 HydrophobicContact CD1-CG2 4.34Å; L288-V297 HydrophobicContact CD2-CG1 4.26Å; L288-V312 HydrophobicContact CD1-CG1 3.88Å; L288-V312 HydrophobicContact CD1-CG2 3.88Å; L288-D316 HydrophobicContact CD1-CB 3.87Å; L288-L317 HydrophobicContact CB-CD2 3.76Å
289	K	95.8	Very high	96.3	Very high	146 Å²	146	65.5 Å²	65.5	64%	0.635	33%	0.325	S	S	*	.			trans	-124.4	170	-179	-62.5	-176.7	-179.6	-179.6	0	110.1	D291 D292 L317	K289-D291 PolarHBondContact O-N 2.92Å; K289-D292 PolarHBondContact N-OD2 3.01Å; K289-D292 WeakPolarHBondContact O-CB 3.42Å; K289-D292 PolarHBondContact O-N 2.92Å; K289-L317 WeakPolarHBondContact O-CD2 3.38Å
290	G	96.4	Very high	96.4	Very high	44 Å²	44	67.4 Å²	67.4	45%	0.454	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-54.4	-37.8	179.9	0	0	0	0	0	113.7	D292 L293	G290-D292 PolarHBondContact O-N 3.1Å; G290-L293 WeakPolarHBondContact O-CB 3.42Å; G290-L293 VanDerWaalsContact O-CG 3.28Å; G290-L293 WeakPolarHBondContact O-CG 3.45Å; G290-L293 PolarHBondContact O-N 3.01Å; G290-L293 VanDerWaalsContact O-N 3.14Å
291	D	96.5	Very high	96.5	Very high	155 Å²	155	67.4 Å²	67.4	83%	0.829	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-69.2	-12.3	179.5	-56.3	-21.5	0	0	0	113.4	K289 L293	K289-D291 PolarHBondContact O-N 2.92Å; D291-L293 VanDerWaalsContact C-N 3.33Å
292	D	97.3	Very high	96.5	Very high	19 Å²	19	65.2 Å²	65.2	10%	0.102	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-84.6	-7.1	175.3	-58.9	-54	0	0	0	112.4	R286 L288 K289 G290 G294 E295 V312	R286-D292 IonicContact CZ-OD1 3.57Å; R286-D292 IonicContact CZ-OD2 2.99Å; R286-D292 IonicContact NH1-OD1 3.54Å; R286-D292 IonicContact NH1-OD2 2.73Å; R286-D292 PolarHBondContact NH1-OD2 3.29Å; R286-D292 IonicContact NH2-OD1 3.34Å; R286-D292 PolarHBondContact NH2-OD1 3.12Å; R286-D292 IonicContact NH2-OD2 3.15Å; R286-D292 PolarHBondContact NH2-OD2 3.25Å; L288-D292 WeakPolarHBondContact CA-OD2 3.31Å; L288-D292 HydrophobicContact CB-CB 4.5Å; L288-D292 HydrophobicContact CD2-CB 4.34Å; K289-D292 PolarHBondContact N-OD2 3.01Å; K289-D292 WeakPolarHBondContact O-CB 3.42Å; K289-D292 PolarHBondContact O-N 2.92Å; G290-D292 PolarHBondContact O-N 3.1Å; D292-G294 PolarHBondContact O-N 3.48Å; D292-E295 VanDerWaalsContact O-CB 3.27Å; D292-E295 WeakPolarHBondContact O-CB 3.33Å; D292-E295 PolarHBondContact O-N 3.39Å; D292-V312 HydrophobicContact CB-CG1 4.46Å; D292-V312 HydrophobicContact CB-CG2 4.39Å; D292-V312 WeakPolarHBondContact O-CB 3.49Å; D292-V312 WeakPolarHBondContact O-CG2 3.49Å
293	L	97.8	Very high	96.5	Very high	82 Å²	82	70.2 Å²	70.2	43%	0.429	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	127.7	-176.9	-76.7	171.9	0	0	0	111.7	G290 D291 E295 V312 K314 L317	G290-L293 WeakPolarHBondContact O-CB 3.42Å; G290-L293 VanDerWaalsContact O-CG 3.28Å; G290-L293 WeakPolarHBondContact O-CG 3.45Å; G290-L293 PolarHBondContact O-N 3.01Å; G290-L293 VanDerWaalsContact O-N 3.14Å; D291-L293 VanDerWaalsContact C-N 3.33Å; L293-E295 PolarHBondContact O-N 2.97Å; L293-V312 HydrophobicContact CD2-CG1 4.27Å; L293-K314 HydrophobicContact CD2-CB 4.46Å; L293-L317 HydrophobicContact CD1-CD1 4.09Å; L293-L317 HydrophobicContact CD2-CD1 3.84Å; L293-L317 HydrophobicContact CD2-CD2 4.43Å; L293-L317 HydrophobicContact CD2-CG 4.14Å; L293-L317 HydrophobicContact CG-CD1 3.93Å
294	G	97.4	Very high	96.5	Very high	34 Å²	34	70.4 Å²	70.4	35%	0.351	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-8.7	-177.5	0	0	0	0	0	114.5	D292 Q311 V312	D292-G294 PolarHBondContact O-N 3.48Å; G294-Q311 WeakPolarHBondContact O-CG 3.42Å; G294-Q311 PolarHBondContact O-NE2 3.26Å; G294-V312 PolarHBondContact N-O 3.26Å
295	E	98.2	Very high	96.4	Very high	118 Å²	118	75.5 Å²	75.5	55%	0.551	38%	0.377	S	S	*	.			trans	-75.1	156.8	175.5	-66.6	-59.1	135.9	0	0	111.8	D292 L293 Q311 V312	D292-E295 VanDerWaalsContact O-CB 3.27Å; D292-E295 WeakPolarHBondContact O-CB 3.33Å; D292-E295 PolarHBondContact O-N 3.39Å; L293-E295 PolarHBondContact O-N 2.97Å; E295-Q311 WeakPolarHBondContact O-CA 3.23Å; E295-V312 WeakPolarHBondContact O-CG2 3.39Å; E295-V312 PolarHBondContact O-N 2.94Å
296	K	98.1	Very high	96.5	Very high	151 Å²	151	74.5 Å²	74.5	66%	0.657	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.1	175.9	-170.4	177	-179.7	179.5	0	109.7	Y309 K310	K296-Y309 HydrophobicContact CD-CD1 4.37Å; K296-Y309 HydrophobicContact CD-CG 4.46Å; K296-Y309 HydrophobicContact CG-CD1 3.91Å; K296-Y309 HydrophobicContact CG-CG 4.27Å; K296-K310 WeakPolarHBondContact CA-O 3.28Å
297	V	98	Very high	96.8	Very high	22 Å²	22	73.3 Å²	73.3	13%	0.133	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	156.7	-176.8	-58.4	0	0	0	0	112.1	F284 L288 Y309 K310 V312	F284-V297 HydrophobicContact CD1-CG2 3.78Å; F284-V297 HydrophobicContact CE1-CG2 3.84Å; L288-V297 HydrophobicContact CD1-CG2 4.34Å; L288-V297 HydrophobicContact CD2-CG1 4.26Å; V297-Y309 VanDerWaalsContact O-CA 3.32Å; V297-Y309 WeakPolarHBondContact O-CA 3.02Å; V297-K310 PolarHBondContact N-O 3.05Å; V297-K310 PolarHBondContact O-N 3.02Å; V297-V312 HydrophobicContact CB-CG2 4.09Å; V297-V312 HydrophobicContact CG1-CG2 3.55Å; V297-V312 HydrophobicContact CG2-CG2 3.39Å
298	L	98.4	Very high	97	Very high	60 Å²	60	69.6 Å²	69.6	31%	0.314	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	138.9	169	-70.4	168.6	0	0	0	109.9	F284 P285 W307 S308 Y309	F284-L298 WeakPolarHBondContact CD1-O 3.46Å; P285-L298 WeakPolarHBondContact CD-O 3.36Å; P285-L298 HydrophobicContact CG-CB 3.78Å; P285-L298 HydrophobicContact CG-CD1 4.29Å; L298-W307 HydrophobicContact CB-CE3 4.05Å; L298-W307 HydrophobicContact CD2-CB 4.11Å; L298-S308 CarbonylContact C-O 3.59Å; L298-S308 VanDerWaalsContact CA-O 3.28Å; L298-S308 WeakPolarHBondContact CA-O 3.03Å; L298-Y309 HydrophobicContact CD2-CD1 3.99Å; L298-Y309 HydrophobicContact CD2-CD2 4.26Å; L298-Y309 HydrophobicContact CD2-CE1 3.56Å; L298-Y309 HydrophobicContact CD2-CE2 3.85Å; L298-Y309 HydrophobicContact CD2-CG 4.33Å; L298-Y309 VanDerWaalsContact CD2-CZ 3.47Å; L298-Y309 HydrophobicContact CG-CD1 4.32Å; L298-Y309 HydrophobicContact CG-CE1 3.79Å
299	F	98.1	Very high	97.1	Very high	28 Å²	28	75.6 Å²	75.6	12%	0.123	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	163.2	173.6	83.7	-72.1	0	0	0	111.2	L282 E283 F284 M304 S308 Y309 K310	L282-F299 HydrophobicContact CD1-CD2 4.23Å; L282-F299 HydrophobicContact CD2-CD2 4.15Å; L282-F299 HydrophobicContact CD2-CE2 4.44Å; E283-F299 CarbonylContact O-C 3.49Å; E283-F299 VanDerWaalsContact O-CA 3.22Å; E283-F299 WeakPolarHBondContact O-CA 3.35Å; F284-F299 HydrophobicContact CD1-CB 3.81Å; F284-F299 HydrophobicContact CE1-CB 3.59Å; F284-F299 HydrophobicContact CZ-CB 4.4Å; F299-M304 HydrophobicContact CE2-CE 4.2Å; F299-M304 HydrophobicContact CE2-SD 4.44Å; F299-M304 HydrophobicContact CZ-CE 4.07Å; F299-S308 WeakPolarHBondContact CD1-O 3.31Å; F299-S308 PolarHBondContact N-O 2.66Å; F299-S308 PolarHBondContact O-N 3.02Å; F299-Y309 VanDerWaalsContact CE1-C 3.48Å; F299-K310 HydrophobicContact CB-CD 4.33Å; F299-K310 HydrophobicContact CB-CG 4.21Å; F299-K310 HydrophobicContact CD1-CB 3.65Å; F299-K310 HydrophobicContact CD1-CD 4.19Å; F299-K310 HydrophobicContact CD1-CG 3.64Å; F299-K310 HydrophobicContact CD2-CD 4.21Å; F299-K310 HydrophobicContact CE1-CB 3.66Å; F299-K310 HydrophobicContact CE1-CG 4.15Å; F299-K310 HydrophobicContact CG-CB 4.33Å; F299-K310 HydrophobicContact CG-CD 3.97Å; F299-K310 HydrophobicContact CG-CG 3.87Å; F299-K310 HydrophobicContact CZ-CB 4.33Å
300	R	97.4	Very high	97.2	Very high	51 Å²	51	70.3 Å²	70.3	19%	0.192	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-143.9	146.7	165.4	64.3	-177.6	-176.7	-176	-4.8	111.7	E283 M304 G306 W307	E283-R300 HydrophobicContact CB-CG 3.98Å; E283-R300 VanDerWaalsContact CD-NE 3.3Å; E283-R300 PolarHBondContact N-O 3.43Å; E283-R300 PolarHBondContact O-N 3.3Å; E283-R300 IonicContact OE1-CZ 3.61Å; E283-R300 IonicContact OE1-NE 3.62Å; E283-R300 IonicContact OE1-NH2 3.89Å; E283-R300 PolarHBondContact OE1-NH2 2.88Å; E283-R300 IonicContact OE2-CZ 2.65Å; E283-R300 IonicContact OE2-NE 3.93Å; E283-R300 PolarHBondContact OE2-NE 3.42Å; E283-R300 IonicContact OE2-NH2 3.98Å; E283-R300 PolarHBondContact OE2-NH2 3.35Å; R300-M304 HydrophobicContact CB-CB 4.12Å; R300-M304 HydrophobicContact CB-SD 4.36Å; R300-G306 WeakPolarHBondContact CB-O 3.48Å; R300-W307 HydrophobicContact CB-CD2 4.48Å; R300-W307 HydrophobicContact CB-CE3 4.2Å; R300-W307 HydrophobicContact CG-CD2 4.41Å; R300-W307 HydrophobicContact CG-CE3 4.1Å; R300-W307 HydrophobicContact CG-CH2 4.15Å; R300-W307 HydrophobicContact CG-CZ2 4.46Å; R300-W307 HydrophobicContact CG-CZ3 3.95Å
301	D	96.6	Very high	97.3	Very high	11 Å²	11	74.7 Å²	74.7	6%	0.059	38%	0.377	C	S	.	.			trans	-114.4	179.4	177.8	-154.1	-14.8	0	0	0	110.7	R261 R281 L282 H303 M304	R261-D301 PolarHBondContact NH1-O 2.9Å; R281-D301 WeakPolarHBondContact CD-OD1 3.21Å; R281-D301 IonicContact CZ-OD2 2.93Å; R281-D301 IonicContact NE-OD1 3.63Å; R281-D301 PolarHBondContact NE-OD1 2.77Å; R281-D301 IonicContact NE-OD2 2.82Å; R281-D301 PolarHBondContact NE-OD2 2.99Å; R281-D301 IonicContact NH2-OD2 2.67Å; R281-D301 PolarHBondContact NH2-OD2 3.09Å; L282-D301 HydrophobicContact CD2-CB 3.68Å; L282-D301 WeakPolarHBondContact CD2-OD2 3.1Å; D301-H303 PolarHBondContact O-N 3.22Å; D301-H303 VanDerWaalsContact O-N 3.12Å; D301-M304 WeakPolarHBondContact O-CB 3.48Å; D301-M304 PolarHBondContact O-N 2.93Å
302	H	95.9	Very high	97.4	Very high	33 Å²	33	67.6 Å²	67.6	15%	0.153	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.7	-172.6	72.7	92.4	0	0	0	114.8	Q265 Q266 F269	Q265-H302 HydrophobicContact CB-CB 3.66Å; Q266-H302 HydrophobicContact CB-CB 4.14Å; F269-H302 AromaticContact CD1-CE1 4Å; F269-H302 AromaticContact CD1-NE2 3.8Å; F269-H302 AromaticContact CD2-CD2 3.91Å; F269-H302 AromaticContact CD2-NE2 3.77Å; F269-H302 AromaticContact CG-CD2 3.72Å; F269-H302 AromaticContact CG-NE2 3.66Å
303	H	96.1	Very high	97.4	Very high	121 Å²	121	71.8 Å²	71.8	56%	0.56	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-1.6	-178.2	61.4	-88.3	0	0	0	113.4	D301	D301-H303 PolarHBondContact O-N 3.22Å; D301-H303 VanDerWaalsContact O-N 3.12Å
304	M	96.9	Very high	97.4	Very high	40 Å²	40	76.4 Å²	76.4	20%	0.197	38%	0.375	C	S	.	.			trans	-101.3	134.1	-175.5	-61.2	-176.1	177.4	0	0	111	R261 Q262 F299 R300 D301	R261-M304 PolarHBondContact NH1-O 3.33Å; R261-M304 PolarHBondContact NH2-O 3.21Å; Q262-M304 PolarHBondContact NE2-O 3.35Å; F299-M304 HydrophobicContact CE2-CE 4.2Å; F299-M304 HydrophobicContact CE2-SD 4.44Å; F299-M304 HydrophobicContact CZ-CE 4.07Å; R300-M304 HydrophobicContact CB-CB 4.12Å; R300-M304 HydrophobicContact CB-SD 4.36Å; D301-M304 WeakPolarHBondContact O-CB 3.48Å; D301-M304 PolarHBondContact O-N 2.93Å
305	N	94.7	Very high	97.3	Very high	128 Å²	128	77.5 Å²	77.5	68%	0.684	38%	0.377	S	S	*	.	S	Bend	trans	-92.2	-35.4	162.4	-72.9	-36	0	0	0	111.5	Q262	Q262-N305 PolarHBondContact NE2-OD1 3.29Å
306	G	96.1	Very high	97.2	Very high	45 Å²	45	72.1 Å²	72.1	46%	0.464	35%	0.352	S	S	.	.	S	Bend	trans	-89	-165.1	175.9	0	0	0	0	0	113.5	R300	R300-G306 WeakPolarHBondContact CB-O 3.48Å
307	W	98.1	Very high	97.1	Very high	109 Å²	109	67 Å²	67	41%	0.413	33%	0.331	S	S	.	.			trans	-117.8	150.3	177.9	-63	85.8	0	0	0	110.7	E283 P285 L298 R300	E283-W307 HydrophobicContact CG-CH2 4.31Å; P285-W307 HydrophobicContact CG-CH2 4.38Å; P285-W307 HydrophobicContact CG-CZ3 4.06Å; L298-W307 HydrophobicContact CB-CE3 4.05Å; L298-W307 HydrophobicContact CD2-CB 4.11Å; R300-W307 HydrophobicContact CB-CD2 4.48Å; R300-W307 HydrophobicContact CB-CE3 4.2Å; R300-W307 HydrophobicContact CG-CD2 4.41Å; R300-W307 HydrophobicContact CG-CE3 4.1Å; R300-W307 HydrophobicContact CG-CH2 4.15Å; R300-W307 HydrophobicContact CG-CZ2 4.46Å; R300-W307 HydrophobicContact CG-CZ3 3.95Å
308	S	98.3	Very high	97	Very high	54 Å²	54	69.5 Å²	69.5	38%	0.378	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	177.1	170.5	-171.2	0	0	0	0	110	L298 F299	L298-S308 CarbonylContact C-O 3.59Å; L298-S308 VanDerWaalsContact CA-O 3.28Å; L298-S308 WeakPolarHBondContact CA-O 3.03Å; F299-S308 WeakPolarHBondContact CD1-O 3.31Å; F299-S308 PolarHBondContact N-O 2.66Å; F299-S308 PolarHBondContact O-N 3.02Å
309	Y	98.2	Very high	96.8	Very high	136 Å²	136	71.1 Å²	71.1	53%	0.533	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.1	175	-72.2	-81.8	0	0	0	111.6	K296 V297 L298 F299	K296-Y309 HydrophobicContact CD-CD1 4.37Å; K296-Y309 HydrophobicContact CD-CG 4.46Å; K296-Y309 HydrophobicContact CG-CD1 3.91Å; K296-Y309 HydrophobicContact CG-CG 4.27Å; V297-Y309 VanDerWaalsContact O-CA 3.32Å; V297-Y309 WeakPolarHBondContact O-CA 3.02Å; L298-Y309 HydrophobicContact CD2-CD1 3.99Å; L298-Y309 HydrophobicContact CD2-CD2 4.26Å; L298-Y309 HydrophobicContact CD2-CE1 3.56Å; L298-Y309 HydrophobicContact CD2-CE2 3.85Å; L298-Y309 HydrophobicContact CD2-CG 4.33Å; L298-Y309 VanDerWaalsContact CD2-CZ 3.47Å; L298-Y309 HydrophobicContact CG-CD1 4.32Å; L298-Y309 HydrophobicContact CG-CE1 3.79Å; F299-Y309 VanDerWaalsContact CE1-C 3.48Å
310	K	97.3	Very high	96.6	Very high	36 Å²	36	71 Å²	71	16%	0.157	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	162.2	165.3	73.4	170.3	-54.6	-144.8	0	110.6	L282 F284 K296 V297 F299 E313 D316	L282-K310 HydrophobicContact CD1-CD 3.91Å; F284-K310 HydrophobicContact CE1-CD 4.16Å; F284-K310 HydrophobicContact CE1-CG 4.43Å; F284-K310 HydrophobicContact CZ-CD 4.35Å; K296-K310 WeakPolarHBondContact CA-O 3.28Å; V297-K310 PolarHBondContact N-O 3.05Å; V297-K310 PolarHBondContact O-N 3.02Å; F299-K310 HydrophobicContact CB-CD 4.33Å; F299-K310 HydrophobicContact CB-CG 4.21Å; F299-K310 HydrophobicContact CD1-CB 3.65Å; F299-K310 HydrophobicContact CD1-CD 4.19Å; F299-K310 HydrophobicContact CD1-CG 3.64Å; F299-K310 HydrophobicContact CD2-CD 4.21Å; F299-K310 HydrophobicContact CE1-CB 3.66Å; F299-K310 HydrophobicContact CE1-CG 4.15Å; F299-K310 HydrophobicContact CG-CB 4.33Å; F299-K310 HydrophobicContact CG-CD 3.97Å; F299-K310 HydrophobicContact CG-CG 3.87Å; F299-K310 HydrophobicContact CZ-CB 4.33Å; K310-E313 IonicContact NZ-OE2 3.59Å; K310-E313 PolarHBondContact NZ-OE2 2.85Å; K310-D316 IonicContact NZ-OD1 2.97Å; K310-D316 PolarHBondContact NZ-OD1 2.77Å; K310-D316 IonicContact NZ-OD2 3.93Å; K310-D316 PolarHBondContact NZ-OD2 3.24Å
311	Q	98.3	Very high	96.4	Very high	135 Å²	135	68.8 Å²	68.8	63%	0.631	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	136.1	165.4	-162.2	171.6	6.8	0	0	109.1	G294 E295	G294-Q311 WeakPolarHBondContact O-CG 3.42Å; G294-Q311 PolarHBondContact O-NE2 3.26Å; E295-Q311 WeakPolarHBondContact O-CA 3.23Å
312	V	98.2	Very high	96.4	Very high	6 Å²	6	69.4 Å²	69.4	4%	0.036	34%	0.34	C	S	.	.			trans	-72.7	130.7	-177.5	179.3	0	0	0	0	111.1	L288 D292 L293 G294 E295 V297 D316 L317	L288-V312 HydrophobicContact CD1-CG1 3.88Å; L288-V312 HydrophobicContact CD1-CG2 3.88Å; D292-V312 HydrophobicContact CB-CG1 4.46Å; D292-V312 HydrophobicContact CB-CG2 4.39Å; D292-V312 WeakPolarHBondContact O-CB 3.49Å; D292-V312 WeakPolarHBondContact O-CG2 3.49Å; L293-V312 HydrophobicContact CD2-CG1 4.27Å; G294-V312 PolarHBondContact N-O 3.26Å; E295-V312 WeakPolarHBondContact O-CG2 3.39Å; E295-V312 PolarHBondContact O-N 2.94Å; V297-V312 HydrophobicContact CB-CG2 4.09Å; V297-V312 HydrophobicContact CG1-CG2 3.55Å; V297-V312 HydrophobicContact CG2-CG2 3.39Å; V312-D316 HydrophobicContact CG1-CB 4.2Å; V312-L317 HydrophobicContact CG1-CD2 4.09Å
313	E	97.6	Very high	96.2	Very high	108 Å²	108	70.2 Å²	70.2	51%	0.505	34%	0.344	S	S	.	.			trans	-112.5	162.2	176.3	-63	165.9	144.6	0	0	110.5	K310 S315 D316	K310-E313 IonicContact NZ-OE2 3.59Å; K310-E313 PolarHBondContact NZ-OE2 2.85Å; E313-S315 PolarHBondContact O-N 2.76Å; E313-S315 VanDerWaalsContact O-N 3.11Å; E313-D316 PolarHBondContact N-OD2 3.02Å; E313-D316 WeakPolarHBondContact O-CB 3.41Å; E313-D316 PolarHBondContact O-N 3.42Å
314	K	96.9	Very high	96	Very high	179 Å²	179	66.8 Å²	66.8	78%	0.778	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-56.3	-32.2	178.8	-171.2	176.7	179.4	179.8	0	113.2	L293 D316 L317	L293-K314 HydrophobicContact CD2-CB 4.46Å; K314-D316 VanDerWaalsContact C-N 3.25Å; K314-D316 PolarHBondContact O-N 2.89Å; K314-L317 PolarHBondContact O-N 2.88Å
315	S	95.2	Very high	95.6	Very high	56 Å²	56	71.3 Å²	71.3	39%	0.392	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-68.4	-19.9	176.5	47	0	0	0	0	114.3	E313 L317 K318	E313-S315 PolarHBondContact O-N 2.76Å; E313-S315 VanDerWaalsContact O-N 3.11Å; S315-L317 VanDerWaalsContact C-N 3.32Å; S315-K318 WeakPolarHBondContact O-CB 3.37Å; S315-K318 VanDerWaalsContact O-CD 3.31Å; S315-K318 WeakPolarHBondContact O-CD 3.11Å; S315-K318 VanDerWaalsContact O-CG 3.23Å; S315-K318 WeakPolarHBondContact O-CG 3.36Å
316	D	96.6	Very high	95.4	Very high	5 Å²	5	67.2 Å²	67.2	3%	0.027	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-81.4	-15.6	179.8	-57.9	-39.2	0	0	0	112.7	F284 L288 K310 V312 E313 K314 K318	F284-D316 HydrophobicContact CE2-CB 3.99Å; F284-D316 HydrophobicContact CZ-CB 3.64Å; L288-D316 HydrophobicContact CD1-CB 3.87Å; K310-D316 IonicContact NZ-OD1 2.97Å; K310-D316 PolarHBondContact NZ-OD1 2.77Å; K310-D316 IonicContact NZ-OD2 3.93Å; K310-D316 PolarHBondContact NZ-OD2 3.24Å; V312-D316 HydrophobicContact CG1-CB 4.2Å; E313-D316 PolarHBondContact N-OD2 3.02Å; E313-D316 WeakPolarHBondContact O-CB 3.41Å; E313-D316 PolarHBondContact O-N 3.42Å; K314-D316 VanDerWaalsContact C-N 3.25Å; K314-D316 PolarHBondContact O-N 2.89Å; D316-K318 PolarHBondContact O-N 3.33Å
317	L	96.4	Very high	94.9	Very high	43 Å²	43	72.1 Å²	72.1	23%	0.225	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-75.5	-3	177.5	-54.5	-172.1	0	0	0	113.3	L288 K289 L293 V312 K314 S315	L288-L317 HydrophobicContact CB-CD2 3.76Å; K289-L317 WeakPolarHBondContact O-CD2 3.38Å; L293-L317 HydrophobicContact CD1-CD1 4.09Å; L293-L317 HydrophobicContact CD2-CD1 3.84Å; L293-L317 HydrophobicContact CD2-CD2 4.43Å; L293-L317 HydrophobicContact CD2-CG 4.14Å; L293-L317 HydrophobicContact CG-CD1 3.93Å; V312-L317 HydrophobicContact CG1-CD2 4.09Å; K314-L317 PolarHBondContact O-N 2.88Å; S315-L317 VanDerWaalsContact C-N 3.32Å
318	K	95.1	Very high	94.5	Very high	75 Å²	75	74 Å²	74	33%	0.326	37%	0.368	S	S	.	.	S	Bend	trans	-65.2	165	175.4	-69.6	-179.5	-172.6	-159.9	0	111.6	G277 E278 T280 S315 D316	G277-K318 VanDerWaalsContact O-CD 3.23Å; G277-K318 WeakPolarHBondContact O-CD 3.39Å; G277-K318 WeakPolarHBondContact O-CE 3.15Å; G277-K318 PolarHBondContact O-NZ 3.33Å; E278-K318 WeakPolarHBondContact O-CB 3.29Å; T280-K318 HydrophobicContact CG2-CB 4.24Å; S315-K318 WeakPolarHBondContact O-CB 3.37Å; S315-K318 VanDerWaalsContact O-CD 3.31Å; S315-K318 WeakPolarHBondContact O-CD 3.11Å; S315-K318 VanDerWaalsContact O-CG 3.23Å; S315-K318 WeakPolarHBondContact O-CG 3.36Å; D316-K318 PolarHBondContact O-N 3.33Å
319	Y	94	Very high	94.3	Very high	94 Å²	94	71.6 Å²	71.6	37%	0.369	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	139.3	179.1	-69.8	-80	0	0	0	111.5	E278 F279 T280 R287 H323	E278-Y319 PolarHBondContact O-N 3.19Å; F279-Y319 CarbonylContact C-O 3.54Å; F279-Y319 WeakPolarHBondContact CA-O 3.4Å; F279-Y319 WeakPolarHBondContact CD1-O 3.19Å; T280-Y319 PolarHBondContact N-O 3.45Å; R287-Y319 PolarHBondContact NH2-OH 3.13Å; Y319-H323 AromaticContact CD1-CE1 3.67Å
320	P	94	Very high	94.2	Very high	26 Å²	26	69.2 Å²	69.2	17%	0.169	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	151.4	176.6	31.2	-35	0	0	0	111	F279 I322 H323	F279-P320 WeakPolarHBondContact CD1-O 3.28Å; P320-I322 WeakPolarHBondContact CB-O 3.46Å; P320-I322 WeakPolarHBondContact CG-O 3.37Å; P320-I322 PolarHBondContact O-N 3.09Å; P320-H323 PolarHBondContact O-CD2 3.13Å; P320-H323 PolarHBondContact O-NE2 3.1Å
321	L	95.1	Very high	94.2	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.026	33%	0.333	C	S	.	.	S	Bend	trans	-62.5	-28.9	173	-75.3	175.2	0	0	0	113.3	I264 Q265 A268 L275 F279 T280 R281 L332 F358	I264-L321 HydrophobicContact CG2-CB 4.04Å; I264-L321 HydrophobicContact CG2-CD1 3.93Å; I264-L321 HydrophobicContact CG2-CG 4.43Å; Q265-L321 HydrophobicContact CG-CD1 4.2Å; A268-L321 HydrophobicContact CB-CD1 3.56Å; L275-L321 HydrophobicContact CD2-CD1 4.46Å; L275-L321 HydrophobicContact CD2-CD2 3.54Å; L275-L321 HydrophobicContact CD2-CG 4.33Å; F279-L321 HydrophobicContact CB-CD2 4.25Å; T280-L321 PolarHBondContact O-N 3.34Å; R281-L321 HydrophobicContact CB-CD1 3.95Å; L321-L332 HydrophobicContact CD2-CD2 3.4Å; L321-L332 PolarHBondContact O-N 2.91Å; L321-F358 HydrophobicContact CD2-CE1 4.24Å; L321-F358 HydrophobicContact CD2-CZ 4.38Å
322	I	95.4	Very high	94	Very high	23 Å²	23	61.1 Å²	61.1	12%	0.118	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.1	179.1	-58.6	164.7	0	0	0	107.4	P257 E258 R261 P320 A329	P257-I322 HydrophobicContact CB-CB 4.43Å; P257-I322 HydrophobicContact CB-CD1 4.41Å; P257-I322 HydrophobicContact CB-CG1 3.9Å; P257-I322 HydrophobicContact CB-CG2 3.86Å; P257-I322 WeakPolarHBondContact O-CD1 3.29Å; E258-I322 HydrophobicContact CG-CG2 4.19Å; R261-I322 HydrophobicContact CB-CD1 3.61Å; R261-I322 HydrophobicContact CG-CD1 3.65Å; P320-I322 WeakPolarHBondContact CB-O 3.46Å; P320-I322 WeakPolarHBondContact CG-O 3.37Å; P320-I322 PolarHBondContact O-N 3.09Å; I322-A329 HydrophobicContact CG2-CB 4.32Å
323	H	92.2	Very high	93.8	Very high	50 Å²	50	62.8 Å²	62.8	23%	0.231	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.1	178.3	-77	-122.7	0	0	0	110.2	F279 Y319 P320 A329 R330 G333	F279-H323 AromaticContact CE1-NE2 3.79Å; Y319-H323 AromaticContact CD1-CE1 3.67Å; P320-H323 PolarHBondContact O-CD2 3.13Å; P320-H323 PolarHBondContact O-NE2 3.1Å; H323-A329 CarbonylContact O-C 3.5Å; H323-A329 WeakPolarHBondContact O-CA 3.17Å; H323-R330 HydrophobicContact CB-CB 4.44Å; H323-R330 PolarHBondContact N-O 2.79Å; H323-R330 PolarHBondContact O-N 3.31Å; H323-G333 PolarHBondContact CD2-N 3.03Å
324	G	90.9	Very high	93.7	Very high	49 Å²	49	59.6 Å²	59.6	51%	0.505	31%	0.31	S	S	.	.	S	Bend	trans	77.3	-172.7	-179	0	0	0	0	0	112.7
325	Q	90.1	Very high	93.6	Very high	136 Å²	136	51.8 Å²	51.8	64%	0.636	28%	0.276	S	S	*	.	S	Bend	trans	-145.1	152.5	-178.3	-70.2	-179	-24	0	0	109.9	E258 R327 Q328	E258-Q325 WeakPolarHBondContact OE1-CA 3.39Å; Q325-R327 PolarHBondContact O-N 3.1Å; Q325-Q328 PolarHBondContact O-N 2.81Å
326	G	89.5	Confident	93.7	Very high	42 Å²	42	50.8 Å²	50.8	43%	0.433	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	56.3	-134	-178.5	0	0	0	0	0	111.9	E258 Q328 A329	E258-G326 PolarHBondContact OE1-N 3.39Å; E258-G326 VanDerWaalsContact OE2-CA 3.29Å; E258-G326 WeakPolarHBondContact OE2-CA 3.23Å; E258-G326 PolarHBondContact OE2-N 2.87Å; G326-Q328 PolarHBondContact O-N 3.15Å; G326-Q328 VanDerWaalsContact O-N 3.09Å; G326-A329 WeakPolarHBondContact O-CB 3.35Å; G326-A329 PolarHBondContact O-N 2.82Å
327	R	84.9	Confident	93.7	Very high	147 Å²	147	50.8 Å²	50.8	56%	0.555	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-62.6	-18.2	-179.8	-61.5	-170.7	-173.3	171.4	5.9	114.7	Q325 R330 D390	Q325-R327 PolarHBondContact O-N 3.1Å; R327-R330 PolarHBondContact O-NH1 2.67Å; R327-D390 WeakPolarHBondContact CD-OD1 3.36Å; R327-D390 VanDerWaalsContact CZ-CG 3.5Å; R327-D390 IonicContact CZ-OD1 2.7Å; R327-D390 VanDerWaalsContact CZ-OD1 3.25Å; R327-D390 IonicContact CZ-OD2 3.33Å; R327-D390 IonicContact NE-OD1 3.9Å; R327-D390 PolarHBondContact NE-OD1 2.67Å; R327-D390 VanDerWaalsContact NE-OD1 3.13Å; R327-D390 IonicContact NE-OD2 3.86Å; R327-D390 VanDerWaalsContact NH1-CG 3.27Å; R327-D390 PolarHBondContact NH1-O 2.82Å; R327-D390 IonicContact NH1-OD1 3.46Å; R327-D390 IonicContact NH1-OD2 2.98Å; R327-D390 PolarHBondContact NH1-OD2 2.93Å; R327-D390 VanDerWaalsContact NH2-C 3.33Å; R327-D390 PolarHBondContact NH2-O 3.3Å; R327-D390 IonicContact NH2-OD1 3.88Å
328	Q	89.8	Confident	93.7	Very high	150 Å²	150	48.7 Å²	48.7	70%	0.701	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-91.6	0.6	175.8	-64.6	-176.3	-14.7	0	0	112.6	Q325 G326 R330	Q325-Q328 PolarHBondContact O-N 2.81Å; G326-Q328 PolarHBondContact O-N 3.15Å; G326-Q328 VanDerWaalsContact O-N 3.09Å; Q328-R330 PolarHBondContact O-N 2.93Å
329	A	94.6	Very high	93.9	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.017	25%	0.252	C	S	.	.			trans	-61.5	132.7	175.4	0	0	0	0	0	110.5	E258 I322 H323 G326	E258-A329 HydrophobicContact CG-CB 3.82Å; I322-A329 HydrophobicContact CG2-CB 4.32Å; H323-A329 CarbonylContact O-C 3.5Å; H323-A329 WeakPolarHBondContact O-CA 3.17Å; G326-A329 WeakPolarHBondContact O-CB 3.35Å; G326-A329 PolarHBondContact O-N 2.82Å
330	R	96.3	Very high	94.1	Very high	86 Å²	86	42.4 Å²	42.4	33%	0.325	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	125.5	179.6	-62.2	-66	178.9	-87.4	4.2	111	H323 R327 Q328 L332 G333 L335	H323-R330 HydrophobicContact CB-CB 4.44Å; H323-R330 PolarHBondContact N-O 2.79Å; H323-R330 PolarHBondContact O-N 3.31Å; R327-R330 PolarHBondContact O-NH1 2.67Å; Q328-R330 PolarHBondContact O-N 2.93Å; R330-L332 PolarHBondContact O-N 3.12Å; R330-G333 PolarHBondContact O-N 3.42Å; R330-L335 CarbonylContact C-O 3.58Å; R330-L335 WeakPolarHBondContact CA-O 3.35Å
331	L	96.4	Very high	94.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	117.3	170.8	175.2	61.2	0	0	0	108.5	P257 I264 G333 T334 L335 F358 L359	P257-L331 HydrophobicContact CB-CB 4.29Å; P257-L331 HydrophobicContact CG-CB 3.86Å; I264-L331 HydrophobicContact CD1-CD1 3.91Å; I264-L331 HydrophobicContact CG1-CD1 4.26Å; I264-L331 HydrophobicContact CG2-CD1 4.06Å; L331-G333 PolarHBondContact O-N 2.64Å; L331-G333 VanDerWaalsContact O-N 3.12Å; L331-T334 PolarHBondContact O-N 3.14Å; L331-L335 PolarHBondContact N-O 2.82Å; L331-L335 PolarHBondContact O-N 3.28Å; L331-F358 HydrophobicContact CD1-CB 3.91Å; L331-F358 HydrophobicContact CD2-CB 3.83Å; L331-F358 HydrophobicContact CG-CB 4.29Å; L331-L359 HydrophobicContact CD2-CB 4.44Å
332	L	95.2	Very high	94.5	Very high	2 Å²	2	41 Å²	41	1%	0.01	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	34.6	-175.6	-57.3	172.1	0	0	0	112.5	F279 L321 R330 T334 V348 I353 L355 F358	F279-L332 HydrophobicContact CD1-CD2 3.64Å; F279-L332 HydrophobicContact CD2-CD2 4.28Å; F279-L332 HydrophobicContact CE1-CB 4.19Å; F279-L332 HydrophobicContact CE1-CD2 3.69Å; F279-L332 HydrophobicContact CE2-CD2 4.35Å; F279-L332 HydrophobicContact CG-CD2 3.96Å; F279-L332 HydrophobicContact CZ-CB 4.23Å; F279-L332 HydrophobicContact CZ-CD2 4.07Å; L321-L332 HydrophobicContact CD2-CD2 3.4Å; L321-L332 PolarHBondContact O-N 2.91Å; R330-L332 PolarHBondContact O-N 3.12Å; L332-T334 PolarHBondContact O-N 2.66Å; L332-T334 VanDerWaalsContact O-N 3.16Å; L332-T334 PolarHBondContact O-OG1 2.82Å; L332-T334 VanDerWaalsContact O-OG1 3.07Å; L332-V348 HydrophobicContact CB-CG2 3.47Å; L332-V348 VanDerWaalsContact CB-CG2 3.47Å; L332-V348 HydrophobicContact CD1-CG2 3.71Å; L332-V348 HydrophobicContact CG-CG2 4.19Å; L332-I353 HydrophobicContact CD1-CG2 4.24Å; L332-L355 HydrophobicContact CD1-CG 4.46Å; L332-F358 HydrophobicContact CD1-CD2 3.68Å; L332-F358 HydrophobicContact CD1-CE2 3.94Å; L332-F358 HydrophobicContact CD1-CG 4.36Å
333	G	93.9	Very high	94.6	Very high	40 Å²	40	40.1 Å²	40.1	41%	0.412	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	67	11.8	-177.5	0	0	0	0	0	115.2	H323 R330 L331	H323-G333 PolarHBondContact CD2-N 3.03Å; R330-G333 PolarHBondContact O-N 3.42Å; L331-G333 PolarHBondContact O-N 2.64Å; L331-G333 VanDerWaalsContact O-N 3.12Å
334	T	95.1	Very high	94.8	Very high	41 Å²	41	40.2 Å²	40.2	25%	0.252	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-62.2	-169.7	-52.9	0	0	0	0	113.1	L331 L332 L346 L355	L331-T334 PolarHBondContact O-N 3.14Å; L332-T334 PolarHBondContact O-N 2.66Å; L332-T334 VanDerWaalsContact O-N 3.16Å; L332-T334 PolarHBondContact O-OG1 2.82Å; L332-T334 VanDerWaalsContact O-OG1 3.07Å; T334-L346 HydrophobicContact CG2-CD1 4.33Å; T334-L346 HydrophobicContact CG2-CD2 4.07Å; T334-L346 HydrophobicContact CG2-CG 4.24Å; T334-L355 HydrophobicContact CG2-CD1 4.12Å; T334-L355 HydrophobicContact CG2-CD2 3.74Å
335	L	95.5	Very high	94.9	Very high	15 Å²	15	42.5 Å²	42.5	8%	0.079	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-106.3	142.7	-175.4	-75.5	-177.6	0	0	0	113.5	R330 L331 V337 L346 L355 L359	R330-L335 CarbonylContact C-O 3.58Å; R330-L335 WeakPolarHBondContact CA-O 3.35Å; L331-L335 PolarHBondContact N-O 2.82Å; L331-L335 PolarHBondContact O-N 3.28Å; L335-V337 VanDerWaalsContact C-N 3.28Å; L335-L346 HydrophobicContact CD1-CD2 3.66Å; L335-L346 HydrophobicContact CD2-CD2 3.74Å; L335-L346 HydrophobicContact CG-CD2 3.6Å; L335-L355 HydrophobicContact CB-CD2 4.04Å; L335-L355 HydrophobicContact CD1-CD2 3.67Å; L335-L355 HydrophobicContact CG-CD2 3.57Å; L335-L359 HydrophobicContact CD1-CD1 4.09Å; L335-L359 HydrophobicContact CD1-CD2 3.72Å; L335-L359 HydrophobicContact CD1-CG 4.44Å
336	A	95.9	Very high	95.1	Very high	35 Å²	35	38.4 Å²	38.4	29%	0.289	20%	0.202	S	C	.	.	S	Bend	trans	-75.8	-15.8	174.9	0	0	0	0	0	113.8	P257	P257-A336 WeakPolarHBondContact CD-O 3.4Å
337	V	97.3	Very high	95.3	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.03	20%	0.203	C	C	.	.			trans	-111.9	157.2	179	-64.4	0	0	0	0	111.9	T219 D237 L335 L359	T219-V337 HydrophobicContact CG2-CG1 4.26Å; D237-V337 HydrophobicContact CB-CG1 4.16Å; D237-V337 VanDerWaalsContact CG-CG1 3.42Å; D237-V337 WeakPolarHBondContact OD2-CG1 3.18Å; L335-V337 VanDerWaalsContact C-N 3.28Å; V337-L359 HydrophobicContact CG2-CD1 4.28Å
338	S	97.5	Very high	95.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	-114.5	-4.4	175.4	69	0	0	0	0	113.3	F255 T256 E260 R263 L359 L360	F255-S338 PolarHBondContact O-N 3.05Å; F255-S338 PolarHBondContact O-OG 3.2Å; T256-S338 PolarHBondContact O-OG 3.2Å; E260-S338 WeakPolarHBondContact CB-OG 3.46Å; E260-S338 VanDerWaalsContact CG-OG 3.31Å; E260-S338 WeakPolarHBondContact CG-OG 3.39Å; R263-S338 PolarHBondContact NH2-O 3.23Å; S338-L359 WeakPolarHBondContact O-CA 3.13Å; S338-L360 PolarHBondContact O-N 3.4Å; S338-L360 VanDerWaalsContact O-N 3.12Å
339	R	98.4	Very high	95.5	Very high	35 Å²	35	35.1 Å²	35.1	13%	0.132	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-136.8	147.8	169.7	-55.9	-166.8	-173.6	-171.8	13.4	110.9	A235 G236 F255 E260 L360 I362	A235-R339 HydrophobicContact CB-CB 4.11Å; G236-R339 WeakPolarHBondContact CA-O 3.43Å; G236-R339 PolarHBondContact N-O 2.69Å; F255-R339 HydrophobicContact CB-CB 3.91Å; F255-R339 HydrophobicContact CB-CG 3.83Å; F255-R339 HydrophobicContact CD1-CG 4.1Å; F255-R339 VanDerWaalsContact CE1-CZ 3.45Å; F255-R339 HydrophobicContact CG-CB 4.23Å; F255-R339 HydrophobicContact CG-CG 3.92Å; E260-R339 VanDerWaalsContact CD-NH2 3.31Å; E260-R339 IonicContact OE1-CZ 2.83Å; E260-R339 IonicContact OE1-NE 3.04Å; E260-R339 IonicContact OE1-NH2 3.95Å; E260-R339 PolarHBondContact OE1-NH2 3.05Å; E260-R339 IonicContact OE2-CZ 3.68Å; E260-R339 IonicContact OE2-NE 3.59Å; E260-R339 PolarHBondContact OE2-NE 3.2Å; E260-R339 IonicContact OE2-NH2 2.97Å; E260-R339 PolarHBondContact OE2-NH2 2.9Å; R339-L360 CarbonylContact C-O 3.58Å; R339-L360 WeakPolarHBondContact CA-O 3.4Å; R339-L360 VanDerWaalsContact CB-O 3.28Å; R339-L360 WeakPolarHBondContact CB-O 3.29Å; R339-L360 HydrophobicContact CG-CB 4.18Å; R339-I362 WeakPolarHBondContact CD-O 3.25Å; R339-I362 PolarHBondContact NH1-O 2.98Å; R339-I362 VanDerWaalsContact NH1-O 3.13Å
340	G	98.1	Very high	94.9	Very high	2 Å²	2	42.5 Å²	42.5	2%	0.021	22%	0.22	C	C	.	.			trans	165.7	173.3	-178.1	0	0	0	0	0	112.5	C218 L360 S361	C218-G340 CarbonylContact O-C 3.45Å; C218-G340 WeakPolarHBondContact O-CA 3.43Å; G340-L360 PolarHBondContact N-O 3.31Å; G340-S361 VanDerWaalsContact O-CA 3.23Å; G340-S361 WeakPolarHBondContact O-CA 3.15Å; G340-S361 WeakPolarHBondContact O-CB 3.36Å
341	L	98.8	Very high	94.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	147.9	176.8	-54.6	175	0	0	0	110.2	A138 F198 D202 I205 G217 C218 A220	A138-L341 HydrophobicContact CB-CD1 3.92Å; F198-L341 HydrophobicContact CD1-CD2 4.2Å; D202-L341 HydrophobicContact CB-CD2 3.86Å; I205-L341 HydrophobicContact CD1-CB 3.79Å; I205-L341 HydrophobicContact CD1-CD1 4.03Å; I205-L341 HydrophobicContact CD1-CG 4.48Å; G217-L341 CarbonylContact C-O 3.46Å; G217-L341 WeakPolarHBondContact CA-O 3.39Å; C218-L341 PolarHBondContact N-O 3.05Å; C218-L341 PolarHBondContact O-N 3.41Å; A220-L341 HydrophobicContact CB-CD1 3.84Å; A220-L341 HydrophobicContact CB-CG 4.17Å
342	G	98	Very high	93.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	90.5	-149.5	179.2	0	0	0	0	0	113.3	D202 H344 K356	D202-G342 PolarHBondContact OD1-N 2.81Å; G342-H344 PolarHBondContact O-N 3.39Å; G342-K356 PolarHBondContact O-NZ 2.86Å
343	D	97.6	Very high	93.7	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.032	25%	0.253	C	S	.	.			trans	54.4	26.3	-179.3	-65	-51.1	0	0	0	115.5	H129 G216 G217 Q345 L346 L359	H129-D343 IonicContact CD2-OD1 3.91Å; H129-D343 IonicContact CD2-OD2 3.84Å; H129-D343 IonicContact CE1-OD2 3.65Å; H129-D343 PolarHBondContact CE1-OD2 2.84Å; H129-D343 IonicContact NE2-OD1 3.43Å; H129-D343 PolarHBondContact NE2-OD1 3.31Å; H129-D343 IonicContact NE2-OD2 2.69Å; H129-D343 PolarHBondContact NE2-OD2 3.47Å; G216-D343 PolarHBondContact O-N 2.84Å; G217-D343 PolarHBondContact N-OD1 2.88Å; D343-Q345 PolarHBondContact O-N 2.79Å; D343-L346 HydrophobicContact CB-CB 3.8Å; D343-L346 HydrophobicContact CB-CD2 4.04Å; D343-L346 WeakPolarHBondContact O-CB 3.25Å; D343-L346 PolarHBondContact O-N 3.44Å; D343-L346 VanDerWaalsContact O-N 3.11Å; D343-L346 WeakPolarHBondContact OD1-CD2 3.33Å; D343-L359 HydrophobicContact CB-CD2 3.63Å
344	H	96.3	Very high	93.6	Very high	51 Å²	51	49.2 Å²	49.2	24%	0.236	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-32.4	-178.1	-72.2	-103.6	0	0	0	113.1	D202 G206 G342 K356	D202-H344 PolarHBondContact O-CE1 3.44Å; D202-H344 PolarHBondContact O-NE2 3.13Å; D202-H344 IonicContact OD1-CD2 2.81Å; D202-H344 IonicContact OD1-CE1 2.7Å; D202-H344 IonicContact OD1-NE2 3.43Å; D202-H344 PolarHBondContact OD1-NE2 3.18Å; D202-H344 VanDerWaalsContact OD1-NE2 3.14Å; D202-H344 IonicContact OD2-CE1 3.9Å; D202-H344 IonicContact OD2-NE2 2.66Å; G206-H344 WeakPolarHBondContact CA-CD2 3.45Å; G206-H344 WeakPolarHBondContact CA-NE2 3.45Å; G206-H344 PolarHBondContact N-NE2 3.5Å; G342-H344 PolarHBondContact O-N 3.39Å; H344-K356 HydrophobicContact CB-CD 4.31Å; H344-K356 PolarHBondContact CD2-NZ 3.14Å; H344-K356 PolarHBondContact CE1-NZ 3.25Å; H344-K356 VanDerWaalsContact CG-NZ 3.28Å; H344-K356 PolarHBondContact ND1-NZ 2.87Å; H344-K356 PolarHBondContact NE2-NZ 3.42Å
345	Q	92.9	Very high	93.5	Very high	98 Å²	98	47.2 Å²	47.2	46%	0.458	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	2	-179.5	-58.7	-173.5	8.6	0	0	113	D343 R347	D343-Q345 PolarHBondContact O-N 2.79Å; Q345-R347 PolarHBondContact O-N 2.89Å
346	L	95	Very high	93.3	Very high	50 Å²	50	47.1 Å²	47.1	26%	0.262	24%	0.239	S	C	.	.			trans	-70.5	131	-176	-173	63.1	0	0	0	110.8	T334 L335 D343 L355	T334-L346 HydrophobicContact CG2-CD1 4.33Å; T334-L346 HydrophobicContact CG2-CD2 4.07Å; T334-L346 HydrophobicContact CG2-CG 4.24Å; L335-L346 HydrophobicContact CD1-CD2 3.66Å; L335-L346 HydrophobicContact CD2-CD2 3.74Å; L335-L346 HydrophobicContact CG-CD2 3.6Å; D343-L346 HydrophobicContact CB-CB 3.8Å; D343-L346 HydrophobicContact CB-CD2 4.04Å; D343-L346 WeakPolarHBondContact O-CB 3.25Å; D343-L346 PolarHBondContact O-N 3.44Å; D343-L346 VanDerWaalsContact O-N 3.11Å; D343-L346 WeakPolarHBondContact OD1-CD2 3.33Å; L346-L355 HydrophobicContact CD2-CD2 3.72Å; L346-L355 HydrophobicContact CG-CD1 4.37Å; L346-L355 HydrophobicContact CG-CD2 4.23Å; L346-L355 PolarHBondContact O-N 2.71Å; L346-L355 VanDerWaalsContact O-N 3.12Å
347	R	93.9	Very high	93.2	Very high	121 Å²	121	45.7 Å²	45.7	46%	0.457	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-122.2	152.6	179.6	-60.4	-179.7	-172.9	-153.1	-0.3	110.2	Q345 L349 N352 I353	Q345-R347 PolarHBondContact O-N 2.89Å; R347-L349 PolarHBondContact O-N 2.81Å; R347-N352 PolarHBondContact NH1-OD1 3Å; R347-I353 CarbonylContact C-O 3.57Å; R347-I353 WeakPolarHBondContact CA-O 3.13Å
348	V	92.6	Very high	93.2	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.067	23%	0.225	C	C	.	.			trans	-61.6	133	167.4	176.6	0	0	0	0	108.4	F279 L332 D350 T351 I353 L355	F279-V348 HydrophobicContact CE2-CG1 4.31Å; F279-V348 HydrophobicContact CZ-CG1 3.93Å; L332-V348 HydrophobicContact CB-CG2 3.47Å; L332-V348 VanDerWaalsContact CB-CG2 3.47Å; L332-V348 HydrophobicContact CD1-CG2 3.71Å; L332-V348 HydrophobicContact CG-CG2 4.19Å; V348-D350 PolarHBondContact O-N 3.08Å; V348-T351 HydrophobicContact CB-CG2 4.46Å; V348-T351 WeakPolarHBondContact CB-OG1 2.99Å; V348-T351 HydrophobicContact CG1-CG2 4.14Å; V348-T351 PolarHBondContact O-N 3.31Å; V348-T351 PolarHBondContact O-OG1 2.83Å; V348-I353 HydrophobicContact CB-CB 4.38Å; V348-I353 HydrophobicContact CG2-CB 4.13Å; V348-I353 HydrophobicContact CG2-CG2 4.19Å; V348-I353 PolarHBondContact N-O 3.15Å; V348-L355 HydrophobicContact CB-CD1 4.45Å; V348-L355 HydrophobicContact CG2-CD1 3.61Å
349	L	85.5	Confident	93.2	Very high	138 Å²	138	45.7 Å²	45.7	72%	0.723	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.7	131.8	-177.1	-173.6	68.2	0	0	0	111.4	R347 T351	R347-L349 PolarHBondContact O-N 2.81Å; L349-T351 WeakPolarHBondContact O-CG2 3.18Å; L349-T351 PolarHBondContact O-N 3.27Å
350	D	82.4	Confident	93.1	Very high	157 Å²	157	45.8 Å²	45.8	84%	0.84	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	21.6	-179.6	-56.3	-36.2	0	0	0	115.6	V348	V348-D350 PolarHBondContact O-N 3.08Å
351	T	86.4	Confident	93.1	Very high	41 Å²	41	46 Å²	46	25%	0.252	23%	0.23	S	C	.	.	S	Bend	trans	-133.1	173.1	175.5	81.9	0	0	0	0	113	V348 L349 I353	V348-T351 HydrophobicContact CB-CG2 4.46Å; V348-T351 WeakPolarHBondContact CB-OG1 2.99Å; V348-T351 HydrophobicContact CG1-CG2 4.14Å; V348-T351 PolarHBondContact O-N 3.31Å; V348-T351 PolarHBondContact O-OG1 2.83Å; L349-T351 WeakPolarHBondContact O-CG2 3.18Å; L349-T351 PolarHBondContact O-N 3.27Å; T351-I353 PolarHBondContact OG1-N 3.03Å; T351-I353 VanDerWaalsContact OG1-N 3.13Å
352	N	85.4	Confident	93.1	Very high	133 Å²	133	47.3 Å²	47.3	71%	0.711	24%	0.237	S	C	*	.			trans	-97	11.9	171.2	-71	-46.5	0	0	0	113.6	R347 Q354	R347-N352 PolarHBondContact NH1-OD1 3Å; N352-Q354 PolarHBondContact O-N 2.83Å
353	I	90.2	Very high	93.1	Very high	13 Å²	13	47.4 Å²	47.4	7%	0.067	24%	0.238	C	C	.	.			trans	-81.7	119.9	-177.1	-56.5	174.5	0	0	0	109	A276 E278 F279 L332 R347 V348 T351	A276-I353 HydrophobicContact CB-CD1 3.73Å; A276-I353 HydrophobicContact CB-CG1 3.74Å; E278-I353 HydrophobicContact CB-CD1 4.34Å; F279-I353 HydrophobicContact CD2-CD1 3.66Å; F279-I353 HydrophobicContact CE2-CD1 3.57Å; L332-I353 HydrophobicContact CD1-CG2 4.24Å; R347-I353 CarbonylContact C-O 3.57Å; R347-I353 WeakPolarHBondContact CA-O 3.13Å; V348-I353 HydrophobicContact CB-CB 4.38Å; V348-I353 HydrophobicContact CG2-CB 4.13Å; V348-I353 HydrophobicContact CG2-CG2 4.19Å; V348-I353 PolarHBondContact N-O 3.15Å; T351-I353 PolarHBondContact OG1-N 3.03Å; T351-I353 VanDerWaalsContact OG1-N 3.13Å
354	Q	92.1	Very high	93.1	Very high	81 Å²	81	51.1 Å²	51.1	38%	0.379	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-79.1	144.5	175.6	-67.5	-177.8	-11	0	0	111.2	N352 P357	N352-Q354 PolarHBondContact O-N 2.83Å; Q354-P357 WeakPolarHBondContact O-CD 3.18Å
355	L	94	Very high	93.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-81.5	-30.3	177.6	-94.3	75.5	0	0	0	113.7	L332 T334 L335 L346 V348 P357 F358 L359	L332-L355 HydrophobicContact CD1-CG 4.46Å; T334-L355 HydrophobicContact CG2-CD1 4.12Å; T334-L355 HydrophobicContact CG2-CD2 3.74Å; L335-L355 HydrophobicContact CB-CD2 4.04Å; L335-L355 HydrophobicContact CD1-CD2 3.67Å; L335-L355 HydrophobicContact CG-CD2 3.57Å; L346-L355 HydrophobicContact CD2-CD2 3.72Å; L346-L355 HydrophobicContact CG-CD1 4.37Å; L346-L355 HydrophobicContact CG-CD2 4.23Å; L346-L355 PolarHBondContact O-N 2.71Å; L346-L355 VanDerWaalsContact O-N 3.12Å; V348-L355 HydrophobicContact CB-CD1 4.45Å; V348-L355 HydrophobicContact CG2-CD1 3.61Å; L355-P357 VanDerWaalsContact C-N 3.33Å; L355-F358 CarbonylContact O-C 3.44Å; L355-F358 WeakPolarHBondContact O-CA 3.17Å; L355-F358 WeakPolarHBondContact O-CB 3.02Å; L355-F358 PolarHBondContact O-N 3.39Å; L355-L359 PolarHBondContact O-N 2.96Å
356	K	91.8	Very high	93.5	Very high	13 Å²	13	46.9 Å²	46.9	6%	0.057	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.3	-170.9	-157.8	139.5	-171.8	145.1	0	116.6	F10 D202 G342 H344 F358	F10-K356 HydrophobicContact CE1-CB 4.19Å; F10-K356 HydrophobicContact CE1-CG 3.98Å; F10-K356 HydrophobicContact CZ-CG 4.48Å; D202-K356 IonicContact OD1-NZ 3.41Å; D202-K356 PolarHBondContact OD1-NZ 2.77Å; D202-K356 WeakPolarHBondContact OD2-CE 3.35Å; D202-K356 IonicContact OD2-NZ 2.7Å; D202-K356 PolarHBondContact OD2-NZ 3.04Å; G342-K356 PolarHBondContact O-NZ 2.86Å; H344-K356 HydrophobicContact CB-CD 4.31Å; H344-K356 PolarHBondContact CD2-NZ 3.14Å; H344-K356 PolarHBondContact CE1-NZ 3.25Å; H344-K356 VanDerWaalsContact CG-NZ 3.28Å; H344-K356 PolarHBondContact ND1-NZ 2.87Å; H344-K356 PolarHBondContact NE2-NZ 3.42Å; K356-F358 PolarHBondContact O-N 2.96Å
357	P	93.7	Very high	93.7	Very high	5 Å²	5	46 Å²	46	3%	0.032	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-35.1	168.9	-26.4	36.5	0	0	0	112.6	F6 F10 L267 L274 Q354 L355	F6-P357 HydrophobicContact CZ-CB 4.02Å; F10-P357 HydrophobicContact CB-CG 4.16Å; F10-P357 HydrophobicContact CD1-CG 4.06Å; F10-P357 HydrophobicContact CG-CG 4.3Å; L267-P357 HydrophobicContact CD2-CB 4.28Å; L267-P357 WeakPolarHBondContact CD2-O 3.44Å; L274-P357 HydrophobicContact CD1-CB 3.92Å; L274-P357 HydrophobicContact CD2-CB 4.14Å; L274-P357 HydrophobicContact CD2-CG 4.1Å; Q354-P357 WeakPolarHBondContact O-CD 3.18Å; L355-P357 VanDerWaalsContact C-N 3.33Å
358	F	96.3	Very high	93.8	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-28.4	-178.3	-59.6	-83	0	0	0	113.5	R263 I264 L267 A268 L274 L275 L321 L331 L332 L355 K356	R263-F358 PolarHBondContact NH1-O 2.98Å; R263-F358 PolarHBondContact NH2-O 3.38Å; I264-F358 HydrophobicContact CG2-CD1 3.96Å; I264-F358 HydrophobicContact CG2-CE1 4.46Å; L267-F358 HydrophobicContact CD2-CD1 3.75Å; L267-F358 HydrophobicContact CD2-CE1 3.95Å; L267-F358 HydrophobicContact CD2-CG 4.25Å; A268-F358 HydrophobicContact CB-CE1 4.37Å; L274-F358 HydrophobicContact CB-CE2 4Å; L274-F358 HydrophobicContact CB-CZ 3.77Å; L274-F358 HydrophobicContact CD1-CE2 4.48Å; L274-F358 HydrophobicContact CD1-CZ 4.22Å; L275-F358 HydrophobicContact CD2-CZ 4.31Å; L321-F358 HydrophobicContact CD2-CE1 4.24Å; L321-F358 HydrophobicContact CD2-CZ 4.38Å; L331-F358 HydrophobicContact CD1-CB 3.91Å; L331-F358 HydrophobicContact CD2-CB 3.83Å; L331-F358 HydrophobicContact CG-CB 4.29Å; L332-F358 HydrophobicContact CD1-CD2 3.68Å; L332-F358 HydrophobicContact CD1-CE2 3.94Å; L332-F358 HydrophobicContact CD1-CG 4.36Å; L355-F358 CarbonylContact O-C 3.44Å; L355-F358 WeakPolarHBondContact O-CA 3.17Å; L355-F358 WeakPolarHBondContact O-CB 3.02Å; L355-F358 PolarHBondContact O-N 3.39Å; K356-F358 PolarHBondContact O-N 2.96Å
359	L	97.4	Very high	93.9	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	-91.1	110.2	177	178.7	72.7	0	0	0	111.3	L331 L335 V337 S338 D343 L355	L331-L359 HydrophobicContact CD2-CB 4.44Å; L335-L359 HydrophobicContact CD1-CD1 4.09Å; L335-L359 HydrophobicContact CD1-CD2 3.72Å; L335-L359 HydrophobicContact CD1-CG 4.44Å; V337-L359 HydrophobicContact CG2-CD1 4.28Å; S338-L359 WeakPolarHBondContact O-CA 3.13Å; D343-L359 HydrophobicContact CB-CD2 3.63Å; L355-L359 PolarHBondContact O-N 2.96Å
360	L	97.2	Very high	94.3	Very high	37 Å²	37	36.1 Å²	36.1	19%	0.194	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-93.5	140.7	-178.6	-59.8	-179.9	0	0	0	112.7	S338 R339 G340	S338-L360 PolarHBondContact O-N 3.4Å; S338-L360 VanDerWaalsContact O-N 3.12Å; R339-L360 CarbonylContact C-O 3.58Å; R339-L360 WeakPolarHBondContact CA-O 3.4Å; R339-L360 VanDerWaalsContact CB-O 3.28Å; R339-L360 WeakPolarHBondContact CB-O 3.29Å; R339-L360 HydrophobicContact CG-CB 4.18Å; G340-L360 PolarHBondContact N-O 3.31Å
361	S	97.8	Very high	94.7	Very high	7 Å²	7	34.1 Å²	34.1	5%	0.049	18%	0.182	C	C	.	.			trans	-86.9	-6.4	170.3	46.6	0	0	0	0	114.3	F198 D202 G340	F198-S361 WeakPolarHBondContact CB-O 3.46Å; F198-S361 WeakPolarHBondContact CD1-O 3.31Å; D202-S361 VanDerWaalsContact CG-CB 3.48Å; D202-S361 WeakPolarHBondContact OD2-CB 3.29Å; D202-S361 PolarHBondContact OD2-OG 3.02Å; D202-S361 VanDerWaalsContact OD2-OG 3.12Å; G340-S361 VanDerWaalsContact O-CA 3.23Å; G340-S361 WeakPolarHBondContact O-CA 3.15Å; G340-S361 WeakPolarHBondContact O-CB 3.36Å
362	I	97.8	Very high	94.9	Very high	27 Å²	27	39.5 Å²	39.5	14%	0.138	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-82.3	125.5	-174.8	-52	-55.3	0	0	0	111	M1 E195 Q199 R339	M1-I362 HydrophobicContact CE-CG1 4.12Å; E195-I362 HydrophobicContact CB-CG2 4.21Å; E195-I362 HydrophobicContact CG-CG2 4.03Å; Q199-I362 HydrophobicContact CB-CD1 3.8Å; Q199-I362 HydrophobicContact CG-CD1 4.49Å; R339-I362 WeakPolarHBondContact CD-O 3.25Å; R339-I362 PolarHBondContact NH1-O 2.98Å; R339-I362 VanDerWaalsContact NH1-O 3.13Å
363	P	98.5	Very high	95.2	Very high	2 Å²	2	35 Å²	35	1%	0.013	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-76.3	164.4	-179	33.4	-35.7	0	0	0	111.8	F198 A233 N234 A235 V365	F198-P363 HydrophobicContact CB-CG 4.2Å; F198-P363 HydrophobicContact CD1-CB 3.9Å; F198-P363 HydrophobicContact CD1-CG 3.79Å; F198-P363 HydrophobicContact CD2-CG 3.79Å; F198-P363 HydrophobicContact CE1-CB 3.7Å; F198-P363 HydrophobicContact CE1-CG 3.99Å; F198-P363 HydrophobicContact CE2-CB 4.34Å; F198-P363 HydrophobicContact CE2-CG 3.99Å; F198-P363 HydrophobicContact CG-CB 4.3Å; F198-P363 HydrophobicContact CG-CG 3.67Å; F198-P363 HydrophobicContact CZ-CB 3.93Å; F198-P363 HydrophobicContact CZ-CG 4.08Å; A233-P363 HydrophobicContact CB-CB 3.95Å; A233-P363 HydrophobicContact CB-CG 4.16Å; N234-P363 CarbonylContact O-C 3.58Å; N234-P363 WeakPolarHBondContact O-CA 3.38Å; N234-P363 WeakPolarHBondContact O-CB 3.3Å; A235-P363 HydrophobicContact CB-CB 4.37Å; P363-V365 HydrophobicContact CG-CG2 4.43Å
364	Q	98.5	Very high	95.3	Very high	83 Å²	83	38.2 Å²	38.2	39%	0.388	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	135.8	154.6	178.9	-176.7	56	0	0	108.9	A233 N234 T253 F255	A233-Q364 CarbonylContact C-O 3.57Å; A233-Q364 WeakPolarHBondContact CA-O 3.47Å; N234-Q364 PolarHBondContact N-O 3.16Å; N234-Q364 PolarHBondContact O-N 2.98Å; T253-Q364 PolarHBondContact OG1-OE1 3.25Å; F255-Q364 HydrophobicContact CE1-CB 4.48Å; F255-Q364 HydrophobicContact CE2-CB 3.84Å; F255-Q364 HydrophobicContact CZ-CB 3.39Å; F255-Q364 HydrophobicContact CZ-CG 4.27Å
365	V	98.7	Very high	95.3	Very high	24 Å²	24	36 Å²	36	15%	0.145	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.9	179.9	-170.9	0	0	0	0	110.6	I191 L194 Y231 V232 A233 P363	I191-V365 HydrophobicContact CG1-CB 4.09Å; I191-V365 HydrophobicContact CG1-CG1 3.89Å; I191-V365 HydrophobicContact CG2-CB 4.17Å; I191-V365 HydrophobicContact CG2-CG2 4.13Å; L194-V365 HydrophobicContact CB-CG2 4.2Å; L194-V365 HydrophobicContact CD1-CG1 3.88Å; L194-V365 HydrophobicContact CD1-CG2 4.21Å; Y231-V365 HydrophobicContact CD1-CG1 4.41Å; V232-V365 CarbonylContact O-C 3.53Å; V232-V365 WeakPolarHBondContact O-CA 3.4Å; A233-V365 HydrophobicContact CB-CG2 3.96Å; P363-V365 HydrophobicContact CG-CG2 4.43Å
366	T	98.6	Very high	95.2	Very high	37 Å²	37	39.9 Å²	39.9	23%	0.227	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.8	168.7	-57.7	0	0	0	0	109.2	Y231 V232 L251	Y231-T366 WeakPolarHBondContact CA-O 3.35Å; V232-T366 PolarHBondContact N-O 3.38Å; V232-T366 PolarHBondContact O-N 3.32Å; L251-T366 WeakPolarHBondContact O-CB 3.4Å; L251-T366 PolarHBondContact O-OG1 2.74Å
367	V	98.3	Very high	95.2	Very high	31 Å²	31	42.8 Å²	42.8	19%	0.188	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127	176.9	-172	0	0	0	0	109.6	I191 K229 Y231	I191-V367 HydrophobicContact CD1-CG2 3.91Å; I191-V367 HydrophobicContact CG1-CG2 4.23Å; K229-V367 HydrophobicContact CB-CG1 4.36Å; K229-V367 HydrophobicContact CD-CG1 4.03Å; Y231-V367 HydrophobicContact CD1-CG1 4.25Å; Y231-V367 HydrophobicContact CD1-CG2 3.72Å; Y231-V367 HydrophobicContact CE1-CG1 4Å; Y231-V367 HydrophobicContact CE1-CG2 3.89Å
368	L	97	Very high	95.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.2	170.8	-179.9	69.9	0	0	0	108.4	K229 L230 L242 R249 L251 V370 L373 L451	K229-L368 CarbonylContact C-O 3.55Å; K229-L368 WeakPolarHBondContact CA-O 3.29Å; L230-L368 HydrophobicContact CB-CB 4.25Å; L230-L368 HydrophobicContact CD2-CD2 4.38Å; L230-L368 PolarHBondContact N-O 2.92Å; L230-L368 PolarHBondContact O-N 3.36Å; L242-L368 HydrophobicContact CD2-CD2 3.89Å; R249-L368 VanDerWaalsContact CZ-CD1 3.43Å; L251-L368 HydrophobicContact CD2-CD2 4.39Å; L368-V370 HydrophobicContact CD2-CG2 4.32Å; L368-V370 HydrophobicContact CG-CG2 4.36Å; L368-V370 PolarHBondContact O-N 3.31Å; L368-L373 HydrophobicContact CD1-CD1 4.01Å; L368-L373 HydrophobicContact CD2-CD1 4.03Å; L368-L373 HydrophobicContact CG-CD1 4.11Å; L368-L451 HydrophobicContact CD2-CD1 4.42Å
369	D	95.5	Very high	95.1	Very high	42 Å²	42	43.6 Å²	43.6	23%	0.225	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	104	170.5	-163.4	-39.1	0	0	0	108.7	D371 Q372	D369-D371 PolarHBondContact OD1-N 3.09Å; D369-Q372 HydrophobicContact CB-CB 4.31Å; D369-Q372 HydrophobicContact CB-CG 4.18Å; D369-Q372 VanDerWaalsContact CG-NE2 3.3Å; D369-Q372 PolarHBondContact OD1-N 3.37Å; D369-Q372 PolarHBondContact OD2-NE2 3.25Å
370	V	93.3	Very high	95.1	Very high	19 Å²	19	43.4 Å²	43.4	12%	0.115	23%	0.234	C	C	.	.	S	Bend	trans	-79.5	-32.8	-172.5	-177.3	0	0	0	0	110.3	G228 L230 L368 Q372 L373 L375	G228-V370 WeakPolarHBondContact O-CA 3.49Å; G228-V370 VanDerWaalsContact O-CB 3.28Å; G228-V370 WeakPolarHBondContact O-CB 3.37Å; G228-V370 PolarHBondContact O-N 3.46Å; L230-V370 HydrophobicContact CB-CG2 3.7Å; L368-V370 HydrophobicContact CD2-CG2 4.32Å; L368-V370 HydrophobicContact CG-CG2 4.36Å; L368-V370 PolarHBondContact O-N 3.31Å; V370-Q372 PolarHBondContact O-N 3.27Å; V370-L373 WeakPolarHBondContact O-CB 3.44Å; V370-L373 PolarHBondContact O-N 3Å; V370-L375 HydrophobicContact CG1-CD1 3.54Å
371	D	90.1	Very high	95.2	Very high	116 Å²	116	41.7 Å²	41.7	62%	0.62	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.4	178.8	-75.3	-14.9	0	0	0	112.7	G228 D369 L373	G228-D371 VanDerWaalsContact CA-OD2 3.32Å; G228-D371 WeakPolarHBondContact CA-OD2 3.43Å; G228-D371 PolarHBondContact O-N 3.3Å; D369-D371 PolarHBondContact OD1-N 3.09Å; D371-L373 VanDerWaalsContact C-N 3.28Å
372	Q	91.8	Very high	95.3	Very high	153 Å²	153	41.3 Å²	41.3	72%	0.715	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-5.8	173.1	-66.7	-177.1	31.5	0	0	113.8	D369 V370	D369-Q372 HydrophobicContact CB-CB 4.31Å; D369-Q372 HydrophobicContact CB-CG 4.18Å; D369-Q372 VanDerWaalsContact CG-NE2 3.3Å; D369-Q372 PolarHBondContact OD1-N 3.37Å; D369-Q372 PolarHBondContact OD2-NE2 3.25Å; V370-Q372 PolarHBondContact O-N 3.27Å
373	L	90.7	Very high	95.3	Very high	38 Å²	38	40 Å²	40	20%	0.199	22%	0.216	C	C	.	.	S	Bend	trans	-97.4	134.1	-179.6	-57.3	177.4	0	0	0	111.5	L242 L368 V370 D371 L375	L242-L373 HydrophobicContact CD2-CD1 4.31Å; L368-L373 HydrophobicContact CD1-CD1 4.01Å; L368-L373 HydrophobicContact CD2-CD1 4.03Å; L368-L373 HydrophobicContact CG-CD1 4.11Å; V370-L373 WeakPolarHBondContact O-CB 3.44Å; V370-L373 PolarHBondContact O-N 3Å; D371-L373 VanDerWaalsContact C-N 3.28Å; L373-L375 HydrophobicContact CB-CD2 3.76Å; L373-L375 HydrophobicContact CB-CG 4.03Å; L373-L375 HydrophobicContact CD1-CD2 4.07Å; L373-L375 PolarHBondContact O-N 3.18Å
374	A	91.8	Very high	95.3	Very high	82 Å²	82	40 Å²	40	68%	0.678	22%	0.215	S	C	*	.			trans	-77	88.4	165	0	0	0	0	0	109.4	R244	R244-A374 PolarHBondContact NH2-O 3.39Å
375	L	91.8	Very high	95.3	Very high	33 Å²	33	36 Å²	36	17%	0.173	20%	0.197	C	C	.	.			trans	-82.2	128.5	-173.5	-64.4	175.2	0	0	0	113.5	V370 L373 D379 L451 H452	V370-L375 HydrophobicContact CG1-CD1 3.54Å; L373-L375 HydrophobicContact CB-CD2 3.76Å; L373-L375 HydrophobicContact CB-CG 4.03Å; L373-L375 HydrophobicContact CD1-CD2 4.07Å; L373-L375 PolarHBondContact O-N 3.18Å; L375-D379 WeakPolarHBondContact CA-OD2 3.23Å; L375-D379 HydrophobicContact CD2-CB 4.15Å; L375-L451 HydrophobicContact CD1-CB 3.76Å; L375-L451 WeakPolarHBondContact CD1-O 3.47Å; L375-L451 HydrophobicContact CD2-CB 3.84Å; L375-L451 HydrophobicContact CD2-CD1 3.98Å; L375-L451 HydrophobicContact CG-CB 4.39Å; L375-H452 PolarHBondContact O-ND1 3.4Å; L375-H452 VanDerWaalsContact O-ND1 3.1Å
376	E	93.1	Very high	95.1	Very high	82 Å²	82	36.1 Å²	36.1	38%	0.383	20%	0.196	S	C	.	.			trans	-95.6	162.1	170.2	-59.8	-171.2	164.8	0	0	111.6	E378 D379 H452	E376-E378 PolarHBondContact O-N 3.46Å; E376-E378 VanDerWaalsContact O-N 3.11Å; E376-D379 PolarHBondContact N-OD2 3.43Å; E376-D379 WeakPolarHBondContact O-CB 3.4Å; E376-D379 PolarHBondContact O-N 2.88Å; E376-H452 VanDerWaalsContact O-CB 3.31Å; E376-H452 WeakPolarHBondContact O-CB 3.21Å
377	E	90.8	Very high	94.9	Very high	74 Å²	74	34.3 Å²	34.3	35%	0.346	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.3	-178.8	-72.9	-166.9	-174.4	0	0	114.2	R414	E377-R414 PolarHBondContact O-NH2 2.83Å; E377-R414 IonicContact OE2-NH1 2.88Å; E377-R414 IonicContact OE2-NH2 2.75Å
378	E	93.4	Very high	94.8	Very high	23 Å²	23	32.9 Å²	32.9	11%	0.107	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-7	178.3	-61.1	81.7	179.1	0	0	113.9	E376 V380 L405 R409	E376-E378 PolarHBondContact O-N 3.46Å; E376-E378 VanDerWaalsContact O-N 3.11Å; E378-V380 PolarHBondContact O-N 3.38Å; E378-L405 HydrophobicContact CB-CB 4.23Å; E378-L405 HydrophobicContact CB-CD1 4.29Å; E378-L405 HydrophobicContact CG-CB 3.9Å; E378-L405 WeakPolarHBondContact O-CD1 3.45Å; E378-R409 IonicContact OE1-CZ 3.53Å; E378-R409 IonicContact OE1-NE 3.18Å; E378-R409 PolarHBondContact OE1-NE 3.02Å; E378-R409 IonicContact OE1-NH2 2.9Å; E378-R409 PolarHBondContact OE1-NH2 3.31Å; E378-R409 IonicContact OE2-NH2 2.76Å
379	D	95.6	Very high	94.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.178	C	C	.	.			trans	-73.6	112.6	-179.6	-71.2	-11.4	0	0	0	109.6	R244 L375 E376 L451	R244-D379 WeakPolarHBondContact CA-OD1 3.43Å; R244-D379 VanDerWaalsContact CB-OD1 3.26Å; R244-D379 WeakPolarHBondContact CB-OD1 3.46Å; R244-D379 HydrophobicContact CG-CB 4.15Å; R244-D379 WeakPolarHBondContact CG-OD1 3.32Å; R244-D379 IonicContact CZ-OD2 3.89Å; R244-D379 IonicContact NE-OD1 2.66Å; R244-D379 IonicContact NE-OD2 3.57Å; R244-D379 PolarHBondContact NE-OD2 3.2Å; R244-D379 IonicContact NH2-OD2 3.83Å; L375-D379 WeakPolarHBondContact CA-OD2 3.23Å; L375-D379 HydrophobicContact CD2-CB 4.15Å; E376-D379 PolarHBondContact N-OD2 3.43Å; E376-D379 WeakPolarHBondContact O-CB 3.4Å; E376-D379 PolarHBondContact O-N 2.88Å; D379-L451 PolarHBondContact O-N 2.87Å
380	V	97.9	Very high	94.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.6	-174.4	-61.8	0	0	0	0	111.9	L242 V243 E378 I382 V401 L405 F415 V448 I449	L242-V380 WeakPolarHBondContact CD1-O 3.09Å; V243-V380 HydrophobicContact CB-CG2 4.34Å; V243-V380 PolarHBondContact N-O 3.21Å; V243-V380 PolarHBondContact O-N 3.15Å; V243-V380 VanDerWaalsContact O-N 3.1Å; E378-V380 PolarHBondContact O-N 3.38Å; V380-I382 HydrophobicContact CG2-CD1 3.9Å; V380-I382 HydrophobicContact CG2-CG1 4.4Å; V380-V401 HydrophobicContact CG2-CG1 3.5Å; V380-L405 HydrophobicContact CG1-CD1 3.72Å; V380-L405 HydrophobicContact CG2-CD1 4.1Å; V380-F415 HydrophobicContact CG1-CD1 4.06Å; V380-F415 HydrophobicContact CG1-CE1 3.6Å; V380-V448 HydrophobicContact CB-CG1 4.22Å; V380-V448 HydrophobicContact CG1-CG1 4.17Å; V380-V448 HydrophobicContact CG2-CG1 4.47Å; V380-I449 CarbonylContact C-O 3.59Å; V380-I449 VanDerWaalsContact CA-O 3.3Å; V380-I449 WeakPolarHBondContact CA-O 3.41Å
381	V	98.6	Very high	94.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127.4	163.9	174.4	0	0	0	0	108.9	L230 I241 L242 L251 M383 I449 L451	L230-V381 HydrophobicContact CD2-CG2 3.77Å; I241-V381 CarbonylContact O-C 3.54Å; I241-V381 WeakPolarHBondContact O-CA 3.25Å; L242-V381 HydrophobicContact CB-CG2 4.43Å; L242-V381 HydrophobicContact CD1-CG2 4.28Å; L251-V381 HydrophobicContact CD1-CG1 3.93Å; L251-V381 HydrophobicContact CD1-CG2 3.83Å; V381-M383 HydrophobicContact CG1-CG 4.1Å; V381-I449 HydrophobicContact CB-CB 4.32Å; V381-I449 PolarHBondContact N-O 2.99Å; V381-I449 PolarHBondContact O-N 3.26Å; V381-L451 HydrophobicContact CG2-CD1 4.09Å; V381-L451 HydrophobicContact CG2-CD2 3.94Å; V381-L451 HydrophobicContact CG2-CG 4.16Å
382	I	98.8	Very high	94.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.2	171.5	-53	-59.9	0	0	0	107.5	A240 I241 V243 V380 W389 V397 V401 L422 V446 F447 V448	A240-I382 CarbonylContact C-O 3.43Å; A240-I382 VanDerWaalsContact CA-O 3.23Å; A240-I382 WeakPolarHBondContact CA-O 3.42Å; I241-I382 HydrophobicContact CG1-CB 4.09Å; I241-I382 PolarHBondContact N-O 3.04Å; I241-I382 PolarHBondContact O-N 2.7Å; V243-I382 HydrophobicContact CG2-CG1 4.14Å; V380-I382 HydrophobicContact CG2-CD1 3.9Å; V380-I382 HydrophobicContact CG2-CG1 4.4Å; I382-W389 HydrophobicContact CG2-CH2 4.17Å; I382-W389 HydrophobicContact CG2-CZ2 4.34Å; I382-V397 HydrophobicContact CB-CG1 4.49Å; I382-V397 HydrophobicContact CG1-CG1 4.16Å; I382-V397 HydrophobicContact CG2-CG1 4.17Å; I382-V401 HydrophobicContact CD1-CG2 3.84Å; I382-V401 HydrophobicContact CG1-CG2 4.02Å; I382-L422 HydrophobicContact CD1-CD1 4.26Å; I382-L422 HydrophobicContact CG2-CD1 4.23Å; I382-V446 HydrophobicContact CG2-CG1 4.26Å; I382-F447 WeakPolarHBondContact CA-O 3.15Å; I382-V448 HydrophobicContact CD1-CB 4.31Å; I382-V448 HydrophobicContact CD1-CG1 4.04Å; I382-V448 HydrophobicContact CD1-CG2 3.87Å
383	M	98.8	Very high	94.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.9	168.3	-60.3	163.4	69.3	0	0	107.9	W123 L125 L221 A223 R239 A240 V381 V446 F447 I449	W123-M383 HydrophobicContact CB-SD 4.29Å; L125-M383 HydrophobicContact CD1-CB 3.91Å; L125-M383 WeakPolarHBondContact CD1-O 3.46Å; L221-M383 HydrophobicContact CD2-CB 3.88Å; L221-M383 HydrophobicContact CD2-CE 4.11Å; L221-M383 HydrophobicContact CD2-CG 4.2Å; L221-M383 HydrophobicContact CG-CE 3.74Å; L221-M383 WeakPolarHBondContact O-CE 3.27Å; A223-M383 HydrophobicContact CB-CE 3.89Å; A223-M383 HydrophobicContact CB-SD 3.51Å; A223-M383 VanDerWaalsContact CB-SD 3.51Å; R239-M383 WeakPolarHBondContact O-CA 3.21Å; A240-M383 HydrophobicContact CB-CG 3.92Å; V381-M383 HydrophobicContact CG1-CG 4.1Å; M383-V446 CarbonylContact O-C 3.57Å; M383-V446 WeakPolarHBondContact O-CA 3.39Å; M383-F447 HydrophobicContact CB-CB 4.21Å; M383-F447 PolarHBondContact N-O 3.06Å; M383-F447 PolarHBondContact O-N 3.34Å; M383-I449 HydrophobicContact CG-CD1 4.46Å; M383-I449 HydrophobicContact SD-CD1 3.46Å; M383-I449 WeakPolarHBondContact SD-CD1 3.19Å
384	A	98.7	Very high	95.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157.4	175.2	0	0	0	0	0	112.9	L125 S238 R239 L388 W389 S445 V446	L125-A384 VanDerWaalsContact CD1-CA 3.46Å; S238-A384 WeakPolarHBondContact CA-O 3.45Å; R239-A384 PolarHBondContact N-O 2.88Å; R239-A384 PolarHBondContact O-N 2.87Å; A384-L388 HydrophobicContact CB-CB 3.71Å; A384-L388 HydrophobicContact CB-CD2 3.38Å; A384-L388 HydrophobicContact CB-CG 4.16Å; A384-W389 HydrophobicContact CB-CZ2 3.99Å; A384-W389 PolarHBondContact O-NE1 3.48Å; A384-S445 WeakPolarHBondContact CA-O 3.48Å; A384-S445 WeakPolarHBondContact CB-O 3.06Å; A384-V446 HydrophobicContact CB-CB 4.48Å; A384-V446 HydrophobicContact CB-CG1 4.49Å; A384-V446 HydrophobicContact CB-CG2 3.96Å
385	T	98	Very high	95.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.			trans	-70.7	167.2	168.6	52.9	0	0	0	0	111.5	D87 L125 D127 G387 L388 S445	D87-T385 WeakPolarHBondContact OD2-CG2 3.35Å; D87-T385 PolarHBondContact OD2-OG1 3.02Å; L125-T385 HydrophobicContact CB-CG2 4.42Å; D127-T385 HydrophobicContact CB-CG2 3.83Å; T385-G387 PolarHBondContact O-N 3.26Å; T385-L388 PolarHBondContact O-N 3.31Å; T385-S445 PolarHBondContact N-O 3.41Å; T385-S445 VanDerWaalsContact N-O 3.15Å; T385-S445 PolarHBondContact OG1-N 2.74Å
386	D	94.9	Very high	95.7	Very high	26 Å²	26	26.2 Å²	26.2	14%	0.139	13%	0.132	C	C	.	.	H	α-helix	trans	-59.9	-30.5	-172	71.7	-10.4	0	0	0	112.2	D127 L388 W389 D390	D127-D386 VanDerWaalsContact OD2-OD1 3.08Å; D386-L388 CarbonylContact O-C 3.54Å; D386-L388 PolarHBondContact O-N 2.92Å; D386-W389 CarbonylContact O-C 3.4Å; D386-W389 WeakPolarHBondContact O-CA 3.23Å; D386-W389 PolarHBondContact O-N 3.3Å; D386-D390 WeakPolarHBondContact O-CB 3.14Å; D386-D390 PolarHBondContact O-N 2.98Å
387	G	94.1	Very high	96	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.4	-24.7	178.2	0	0	0	0	0	115	T385 S440	T385-G387 PolarHBondContact O-N 3.26Å; G387-S440 WeakPolarHBondContact CA-OG 3.3Å; G387-S440 VanDerWaalsContact O-CB 3.25Å; G387-S440 WeakPolarHBondContact O-CB 3.24Å; G387-S440 PolarHBondContact O-OG 2.93Å
388	L	95.5	Very high	96.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-76.9	-49.1	169.1	-174.9	75.7	0	0	0	111	A384 T385 D386 D390 V391 L392 V397 L422 T426 V444 V446	A384-L388 HydrophobicContact CB-CB 3.71Å; A384-L388 HydrophobicContact CB-CD2 3.38Å; A384-L388 HydrophobicContact CB-CG 4.16Å; T385-L388 PolarHBondContact O-N 3.31Å; D386-L388 CarbonylContact O-C 3.54Å; D386-L388 PolarHBondContact O-N 2.92Å; L388-D390 PolarHBondContact O-N 3.24Å; L388-V391 PolarHBondContact O-N 2.8Å; L388-V391 VanDerWaalsContact O-N 3.16Å; L388-L392 HydrophobicContact CD1-CD1 3.81Å; L388-L392 HydrophobicContact CG-CD1 4.44Å; L388-L392 PolarHBondContact O-N 3.39Å; L388-V397 HydrophobicContact CD2-CG2 4.36Å; L388-L422 HydrophobicContact CD1-CB 4.15Å; L388-T426 HydrophobicContact CD1-CG2 3.69Å; L388-V444 HydrophobicContact CB-CG1 3.85Å; L388-V444 HydrophobicContact CD1-CG1 4.34Å; L388-V446 HydrophobicContact CD1-CG2 4.26Å; L388-V446 HydrophobicContact CD2-CG2 4.16Å
389	W	95.5	Very high	96.5	Very high	9 Å²	9	25.4 Å²	25.4	3%	0.034	12%	0.121	C	C	.	.	H	α-helix	trans	-71.9	-21.4	-171	-63.6	127.2	0	0	0	113.6	R239 I241 I382 A384 D386 V391 V397	R239-W389 HydrophobicContact CB-CD2 4.23Å; R239-W389 HydrophobicContact CB-CG 4.29Å; R239-W389 HydrophobicContact CB-CZ2 4.16Å; R239-W389 HydrophobicContact CG-CG 4.35Å; R239-W389 VanDerWaalsContact NE-CG 3.28Å; R239-W389 WeakPolarHBondContact O-CZ2 3.2Å; R239-W389 PolarHBondContact O-NE1 3.44Å; I241-W389 HydrophobicContact CD1-CH2 3.86Å; I241-W389 HydrophobicContact CD1-CZ3 4.16Å; I241-W389 HydrophobicContact CG1-CH2 3.96Å; I241-W389 HydrophobicContact CG2-CH2 4.45Å; I382-W389 HydrophobicContact CG2-CH2 4.17Å; I382-W389 HydrophobicContact CG2-CZ2 4.34Å; A384-W389 HydrophobicContact CB-CZ2 3.99Å; A384-W389 PolarHBondContact O-NE1 3.48Å; D386-W389 CarbonylContact O-C 3.4Å; D386-W389 WeakPolarHBondContact O-CA 3.23Å; D386-W389 PolarHBondContact O-N 3.3Å; W389-V391 PolarHBondContact O-N 2.91Å; W389-V397 HydrophobicContact CE3-CG2 4.44Å; W389-V397 HydrophobicContact CH2-CG2 4.43Å; W389-V397 HydrophobicContact CZ3-CB 4.34Å; W389-V397 HydrophobicContact CZ3-CG2 3.76Å
390	D	91.9	Very high	96.6	Very high	53 Å²	53	26.3 Å²	26.3	28%	0.283	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.7	173.2	-101.6	19.4	0	0	0	113	R327 D386 L388	R327-D390 WeakPolarHBondContact CD-OD1 3.36Å; R327-D390 VanDerWaalsContact CZ-CG 3.5Å; R327-D390 IonicContact CZ-OD1 2.7Å; R327-D390 VanDerWaalsContact CZ-OD1 3.25Å; R327-D390 IonicContact CZ-OD2 3.33Å; R327-D390 IonicContact NE-OD1 3.9Å; R327-D390 PolarHBondContact NE-OD1 2.67Å; R327-D390 VanDerWaalsContact NE-OD1 3.13Å; R327-D390 IonicContact NE-OD2 3.86Å; R327-D390 VanDerWaalsContact NH1-CG 3.27Å; R327-D390 PolarHBondContact NH1-O 2.82Å; R327-D390 IonicContact NH1-OD1 3.46Å; R327-D390 IonicContact NH1-OD2 2.98Å; R327-D390 PolarHBondContact NH1-OD2 2.93Å; R327-D390 VanDerWaalsContact NH2-C 3.33Å; R327-D390 PolarHBondContact NH2-O 3.3Å; R327-D390 IonicContact NH2-OD1 3.88Å; D386-D390 WeakPolarHBondContact O-CB 3.14Å; D386-D390 PolarHBondContact O-N 2.98Å; L388-D390 PolarHBondContact O-N 3.24Å
391	V	91.6	Very high	96.6	Very high	13 Å²	13	26.3 Å²	26.3	8%	0.079	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-36.5	-180	-178.2	0	0	0	0	111.8	L388 W389 T426 Q438 S440	L388-V391 PolarHBondContact O-N 2.8Å; L388-V391 VanDerWaalsContact O-N 3.16Å; W389-V391 PolarHBondContact O-N 2.91Å; V391-T426 HydrophobicContact CB-CG2 4.43Å; V391-Q438 HydrophobicContact CG1-CB 3.97Å; V391-Q438 WeakPolarHBondContact CG1-O 3.28Å; V391-S440 VanDerWaalsContact CG2-N 3.34Å
392	L	94.7	Very high	96.5	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.058	14%	0.139	C	C	.	.			trans	-114.6	126.1	-172.8	-57.2	-179.9	0	0	0	112	L388 Q396 V397 L400 N425	L388-L392 HydrophobicContact CD1-CD1 3.81Å; L388-L392 HydrophobicContact CG-CD1 4.44Å; L388-L392 PolarHBondContact O-N 3.39Å; L392-Q396 HydrophobicContact CB-CB 4.49Å; L392-Q396 HydrophobicContact CD2-CB 4.41Å; L392-V397 HydrophobicContact CB-CG2 3.74Å; L392-V397 HydrophobicContact CD1-CG2 4.15Å; L392-L400 HydrophobicContact CD1-CD1 4.28Å; L392-N425 HydrophobicContact CD1-CB 4.14Å; L392-N425 HydrophobicContact CD2-CB 4.48Å
393	S	96.4	Very high	96.4	Very high	45 Å²	45	38 Å²	38	32%	0.315	17%	0.17	S	C	.	.			trans	-68.4	160.5	165.9	60.4	0	0	0	0	112.1	E395 Q396 V397	S393-E395 PolarHBondContact O-N 3.43Å; S393-Q396 PolarHBondContact O-N 3.11Å; S393-Q396 VanDerWaalsContact O-N 3.13Å; S393-Q396 WeakPolarHBondContact OG-CB 3.36Å; S393-Q396 VanDerWaalsContact OG-CG 3.31Å; S393-Q396 WeakPolarHBondContact OG-CG 3.47Å; S393-Q396 PolarHBondContact OG-N 3.05Å; S393-Q396 PolarHBondContact OG-OE1 3.24Å; S393-V397 PolarHBondContact O-N 3.27Å
394	N	97.4	Very high	96.3	Very high	29 Å²	29	39.5 Å²	39.5	16%	0.155	18%	0.176	C	C	.	.	H	α-helix	trans	-55.1	-40.1	175	-66.1	-14.4	0	0	0	111.5	I241 I248 V397 A398	I241-N394 HydrophobicContact CD1-CB 4.28Å; I248-N394 HydrophobicContact CG2-CB 4.38Å; N394-V397 PolarHBondContact O-N 3.01Å; N394-A398 VanDerWaalsContact O-CB 3.31Å; N394-A398 WeakPolarHBondContact O-CB 3.33Å; N394-A398 PolarHBondContact O-N 2.81Å
395	E	97.8	Very high	96.2	Very high	112 Å²	112	39.5 Å²	39.5	52%	0.523	18%	0.176	S	C	.	.	H	α-helix	trans	-70	-36.7	179.9	-64.5	69.1	-151.2	0	0	112	I248 S393 R399	I248-E395 HydrophobicContact CD1-CG 4.36Å; S393-E395 PolarHBondContact O-N 3.43Å; E395-R399 WeakPolarHBondContact O-CB 3.07Å; E395-R399 VanDerWaalsContact O-CG 3.28Å; E395-R399 WeakPolarHBondContact O-CG 3.25Å; E395-R399 PolarHBondContact O-N 2.94Å; E395-R399 VanDerWaalsContact O-N 3.11Å; E395-R399 PolarHBondContact O-NE 3.16Å
396	Q	97.1	Very high	95.9	Very high	72 Å²	72	43.8 Å²	43.8	34%	0.336	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-49.1	172.4	-78.1	162.7	-56.3	0	0	110.9	L392 S393 A398 R399 L400	L392-Q396 HydrophobicContact CB-CB 4.49Å; L392-Q396 HydrophobicContact CD2-CB 4.41Å; S393-Q396 PolarHBondContact O-N 3.11Å; S393-Q396 VanDerWaalsContact O-N 3.13Å; S393-Q396 WeakPolarHBondContact OG-CB 3.36Å; S393-Q396 VanDerWaalsContact OG-CG 3.31Å; S393-Q396 WeakPolarHBondContact OG-CG 3.47Å; S393-Q396 PolarHBondContact OG-N 3.05Å; S393-Q396 PolarHBondContact OG-OE1 3.24Å; Q396-A398 PolarHBondContact O-N 2.55Å; Q396-R399 PolarHBondContact O-N 2.87Å; Q396-L400 WeakPolarHBondContact O-CG 3.45Å; Q396-L400 PolarHBondContact O-N 2.89Å
397	V	97.9	Very high	95.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-48.7	177.6	173.3	0	0	0	0	110.7	I241 I382 L388 W389 L392 S393 N394 R399 L400 V401 L422	I241-V397 HydrophobicContact CD1-CB 4.34Å; I241-V397 HydrophobicContact CD1-CG1 4.11Å; I382-V397 HydrophobicContact CB-CG1 4.49Å; I382-V397 HydrophobicContact CG1-CG1 4.16Å; I382-V397 HydrophobicContact CG2-CG1 4.17Å; L388-V397 HydrophobicContact CD2-CG2 4.36Å; W389-V397 HydrophobicContact CE3-CG2 4.44Å; W389-V397 HydrophobicContact CH2-CG2 4.43Å; W389-V397 HydrophobicContact CZ3-CB 4.34Å; W389-V397 HydrophobicContact CZ3-CG2 3.76Å; L392-V397 HydrophobicContact CB-CG2 3.74Å; L392-V397 HydrophobicContact CD1-CG2 4.15Å; S393-V397 PolarHBondContact O-N 3.27Å; N394-V397 PolarHBondContact O-N 3.01Å; V397-R399 VanDerWaalsContact C-N 3.35Å; V397-R399 PolarHBondContact O-N 2.79Å; V397-L400 PolarHBondContact O-N 3.26Å; V397-L400 VanDerWaalsContact O-N 3.14Å; V397-V401 HydrophobicContact CG1-CG2 4.09Å; V397-V401 VanDerWaalsContact O-CG2 3.25Å; V397-V401 WeakPolarHBondContact O-CG2 3.19Å; V397-V401 PolarHBondContact O-N 2.73Å; V397-L422 HydrophobicContact CG1-CD1 4.45Å; V397-L422 HydrophobicContact CG1-CD2 4.15Å
398	A	98.2	Very high	95.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-41.3	-179.8	0	0	0	0	0	113	V243 I248 N394 Q396 V401 R402	V243-A398 HydrophobicContact CG1-CB 3.89Å; V243-A398 HydrophobicContact CG2-CB 4.15Å; I248-A398 HydrophobicContact CD1-CB 3.34Å; I248-A398 HydrophobicContact CG1-CB 3.6Å; N394-A398 VanDerWaalsContact O-CB 3.31Å; N394-A398 WeakPolarHBondContact O-CB 3.33Å; N394-A398 PolarHBondContact O-N 2.81Å; Q396-A398 PolarHBondContact O-N 2.55Å; A398-V401 PolarHBondContact O-N 3.07Å; A398-R402 WeakPolarHBondContact O-CB 3.25Å; A398-R402 VanDerWaalsContact O-CG 3.24Å; A398-R402 WeakPolarHBondContact O-CG 3.24Å; A398-R402 PolarHBondContact O-N 3.37Å
399	R	97.4	Very high	95.7	Very high	163 Å²	163	54 Å²	54	62%	0.615	26%	0.263	S	S	*	.	H	α-helix	trans	-61.9	-43.4	174.7	-76.5	-174.3	-62.4	154.3	-2.6	112.1	E395 Q396 V397 R403	E395-R399 WeakPolarHBondContact O-CB 3.07Å; E395-R399 VanDerWaalsContact O-CG 3.28Å; E395-R399 WeakPolarHBondContact O-CG 3.25Å; E395-R399 PolarHBondContact O-N 2.94Å; E395-R399 VanDerWaalsContact O-N 3.11Å; E395-R399 PolarHBondContact O-NE 3.16Å; Q396-R399 PolarHBondContact O-N 2.87Å; V397-R399 VanDerWaalsContact C-N 3.35Å; V397-R399 PolarHBondContact O-N 2.79Å; R399-R403 WeakPolarHBondContact O-CB 3.31Å; R399-R403 PolarHBondContact O-N 3.28Å; R399-R403 VanDerWaalsContact O-N 3.13Å
400	L	97.5	Very high	95.4	Very high	19 Å²	19	62.3 Å²	62.3	10%	0.099	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-47.1	177.9	-70.1	173	0	0	0	111.4	L392 Q396 V397 R403 F404 M421 L422 N425	L392-L400 HydrophobicContact CD1-CD1 4.28Å; Q396-L400 WeakPolarHBondContact O-CG 3.45Å; Q396-L400 PolarHBondContact O-N 2.89Å; V397-L400 PolarHBondContact O-N 3.26Å; V397-L400 VanDerWaalsContact O-N 3.14Å; L400-R403 PolarHBondContact O-N 2.93Å; L400-F404 VanDerWaalsContact O-CB 3.26Å; L400-F404 WeakPolarHBondContact O-CB 3.32Å; L400-F404 PolarHBondContact O-N 3.12Å; L400-M421 HydrophobicContact CB-CE 4Å; L400-L422 HydrophobicContact CB-CD2 4.07Å; L400-L422 HydrophobicContact CD1-CD2 4Å; L400-N425 HydrophobicContact CD1-CB 4.25Å
401	V	98	Very high	95.4	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-54.5	178.1	169.4	0	0	0	0	111.1	V243 V380 I382 V397 A398 R403 F404 L405 L418	V243-V401 HydrophobicContact CB-CG1 4.13Å; V243-V401 HydrophobicContact CG1-CB 4.08Å; V243-V401 HydrophobicContact CG1-CG1 3.81Å; V380-V401 HydrophobicContact CG2-CG1 3.5Å; I382-V401 HydrophobicContact CD1-CG2 3.84Å; I382-V401 HydrophobicContact CG1-CG2 4.02Å; V397-V401 HydrophobicContact CG1-CG2 4.09Å; V397-V401 VanDerWaalsContact O-CG2 3.25Å; V397-V401 WeakPolarHBondContact O-CG2 3.19Å; V397-V401 PolarHBondContact O-N 2.73Å; A398-V401 PolarHBondContact O-N 3.07Å; V401-R403 PolarHBondContact O-N 3.01Å; V401-F404 PolarHBondContact O-N 3.21Å; V401-L405 HydrophobicContact CG1-CD1 3.74Å; V401-L405 HydrophobicContact CG1-CG 4.41Å; V401-L405 WeakPolarHBondContact O-CG 3.07Å; V401-L405 PolarHBondContact O-N 2.91Å; V401-L418 HydrophobicContact CB-CD2 4.42Å; V401-L418 HydrophobicContact CG1-CD2 4.08Å; V401-L418 HydrophobicContact CG2-CD1 4.04Å; V401-L418 HydrophobicContact CG2-CD2 4.13Å
402	R	96.8	Very high	95.3	Very high	74 Å²	74	65.3 Å²	65.3	28%	0.279	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-46.3	-178.3	-70.3	168.5	-174.5	161.5	-1.7	111.8	V243 R244 R245 E247 A398 T406	V243-R402 HydrophobicContact CG1-CG 4.2Å; R244-R402 VanDerWaalsContact O-CZ 3.24Å; R244-R402 PolarHBondContact O-NE 2.75Å; R244-R402 PolarHBondContact O-NH2 3.22Å; R245-R402 VanDerWaalsContact O-CZ 3.23Å; R245-R402 PolarHBondContact O-NE 2.74Å; E247-R402 PolarHBondContact O-NH2 3.47Å; A398-R402 WeakPolarHBondContact O-CB 3.25Å; A398-R402 VanDerWaalsContact O-CG 3.24Å; A398-R402 WeakPolarHBondContact O-CG 3.24Å; A398-R402 PolarHBondContact O-N 3.37Å; R402-T406 WeakPolarHBondContact O-CB 3.23Å; R402-T406 PolarHBondContact O-N 3.42Å; R402-T406 PolarHBondContact O-OG1 2.97Å
403	R	95.9	Very high	95.2	Very high	172 Å²	172	66.9 Å²	66.9	65%	0.649	33%	0.329	S	S	*	.	H	α-helix	trans	-62.4	-44.7	178.2	-175.5	178.9	67.9	-176.5	0.6	111.6	R399 L400 V401 G407	R399-R403 WeakPolarHBondContact O-CB 3.31Å; R399-R403 PolarHBondContact O-N 3.28Å; R399-R403 VanDerWaalsContact O-N 3.13Å; L400-R403 PolarHBondContact O-N 2.93Å; V401-R403 PolarHBondContact O-N 3.01Å; R403-G407 PolarHBondContact O-N 3.27Å
404	F	97.3	Very high	95.1	Very high	30 Å²	30	65.8 Å²	65.8	13%	0.132	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-50.5	-177.2	-174.5	-83.5	0	0	0	111.7	L400 V401 T406 G407 N408 R414 E417 L418 M421	L400-F404 VanDerWaalsContact O-CB 3.26Å; L400-F404 WeakPolarHBondContact O-CB 3.32Å; L400-F404 PolarHBondContact O-N 3.12Å; V401-F404 PolarHBondContact O-N 3.21Å; F404-T406 PolarHBondContact O-N 3.43Å; F404-G407 PolarHBondContact O-N 2.95Å; F404-N408 HydrophobicContact CD1-CB 4.43Å; F404-N408 HydrophobicContact CE1-CB 4Å; F404-N408 HydrophobicContact CZ-CB 4.37Å; F404-N408 WeakPolarHBondContact O-CB 3.31Å; F404-N408 PolarHBondContact O-N 3.15Å; F404-N408 PolarHBondContact O-ND2 2.9Å; F404-R414 HydrophobicContact CE1-CB 4.3Å; F404-R414 WeakPolarHBondContact CE1-O 3.39Å; F404-E417 HydrophobicContact CE1-CB 4.38Å; F404-E417 HydrophobicContact CZ-CB 3.66Å; F404-L418 HydrophobicContact CB-CD1 4.1Å; F404-L418 HydrophobicContact CD1-CB 3.74Å; F404-L418 HydrophobicContact CD1-CD1 4.2Å; F404-L418 HydrophobicContact CD1-CG 4.39Å; F404-L418 HydrophobicContact CE1-CB 3.86Å; F404-L418 HydrophobicContact CG-CB 4.42Å; F404-L418 HydrophobicContact CG-CD1 4.16Å; F404-M421 HydrophobicContact CB-CE 3.72Å; F404-M421 HydrophobicContact CB-SD 4.1Å; F404-M421 HydrophobicContact CD2-CB 4.43Å; F404-M421 HydrophobicContact CD2-CE 3.87Å; F404-M421 HydrophobicContact CD2-CG 4.45Å; F404-M421 HydrophobicContact CD2-SD 3.53Å; F404-M421 VanDerWaalsContact CD2-SD 3.53Å; F404-M421 HydrophobicContact CE2-CB 4.45Å; F404-M421 HydrophobicContact CE2-SD 4.38Å; F404-M421 HydrophobicContact CG-CE 3.93Å; F404-M421 HydrophobicContact CG-SD 4.15Å
405	L	95.8	Very high	95.1	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-67.6	-36.3	-175	-66.6	177.5	0	0	0	112.5	E378 V380 V401 G407 N408 R409 R414 F415 L418	E378-L405 HydrophobicContact CB-CB 4.23Å; E378-L405 HydrophobicContact CB-CD1 4.29Å; E378-L405 HydrophobicContact CG-CB 3.9Å; E378-L405 WeakPolarHBondContact O-CD1 3.45Å; V380-L405 HydrophobicContact CG1-CD1 3.72Å; V380-L405 HydrophobicContact CG2-CD1 4.1Å; V401-L405 HydrophobicContact CG1-CD1 3.74Å; V401-L405 HydrophobicContact CG1-CG 4.41Å; V401-L405 WeakPolarHBondContact O-CG 3.07Å; V401-L405 PolarHBondContact O-N 2.91Å; L405-G407 PolarHBondContact O-N 3.27Å; L405-N408 PolarHBondContact O-N 2.69Å; L405-R409 WeakPolarHBondContact O-CG 3.49Å; L405-R409 PolarHBondContact O-N 3.2Å; L405-R414 HydrophobicContact CD2-CG 4.16Å; L405-F415 HydrophobicContact CD1-CE1 4.37Å; L405-F415 HydrophobicContact CD2-CD1 3.99Å; L405-F415 HydrophobicContact CD2-CE1 3.84Å; L405-L418 HydrophobicContact CD1-CD2 3.96Å; L405-L418 HydrophobicContact CD2-CD2 3.8Å; L405-L418 HydrophobicContact CG-CD2 3.82Å
406	T	93.1	Very high	95	Very high	91 Å²	91	60.3 Å²	60.3	56%	0.558	29%	0.294	S	S	*	.	H	α-helix	trans	-59.6	-36.6	174.9	-54.3	0	0	0	0	111.9	R402 F404	R402-T406 WeakPolarHBondContact O-CB 3.23Å; R402-T406 PolarHBondContact O-N 3.42Å; R402-T406 PolarHBondContact O-OG1 2.97Å; F404-T406 PolarHBondContact O-N 3.43Å
407	G	93.2	Very high	94.9	Very high	61 Å²	61	59.2 Å²	59.2	63%	0.629	29%	0.288	S	S	*	.	H	α-helix	trans	-86.9	-11.8	-178.3	0	0	0	0	0	115.4	R403 F404 L405	R403-G407 PolarHBondContact O-N 3.27Å; F404-G407 PolarHBondContact O-N 2.95Å; L405-G407 PolarHBondContact O-N 3.27Å
408	N	94.3	Very high	94.9	Very high	57 Å²	57	59.2 Å²	59.2	31%	0.305	29%	0.288	S	S	.	.			trans	-129.2	34	-170.3	-64.2	-84	0	0	0	112.4	F404 L405 E410 D411 R414	F404-N408 HydrophobicContact CD1-CB 4.43Å; F404-N408 HydrophobicContact CE1-CB 4Å; F404-N408 HydrophobicContact CZ-CB 4.37Å; F404-N408 WeakPolarHBondContact O-CB 3.31Å; F404-N408 PolarHBondContact O-N 3.15Å; F404-N408 PolarHBondContact O-ND2 2.9Å; L405-N408 PolarHBondContact O-N 2.69Å; N408-E410 VanDerWaalsContact C-N 3.3Å; N408-E410 PolarHBondContact O-N 3.12Å; N408-D411 PolarHBondContact O-N 3.1Å; N408-R414 HydrophobicContact CB-CB 4.28Å; N408-R414 WeakPolarHBondContact O-CB 3.37Å; N408-R414 VanDerWaalsContact O-CD 3.25Å; N408-R414 WeakPolarHBondContact O-CD 3.48Å
409	R	91.2	Very high	94.9	Very high	123 Å²	123	59.2 Å²	59.2	46%	0.464	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-41.3	-176.3	-72.1	-177.9	170.5	-173.8	-6.4	113.3	E378 L405 D411 R414	E378-R409 IonicContact OE1-CZ 3.53Å; E378-R409 IonicContact OE1-NE 3.18Å; E378-R409 PolarHBondContact OE1-NE 3.02Å; E378-R409 IonicContact OE1-NH2 2.9Å; E378-R409 PolarHBondContact OE1-NH2 3.31Å; E378-R409 IonicContact OE2-NH2 2.76Å; L405-R409 WeakPolarHBondContact O-CG 3.49Å; L405-R409 PolarHBondContact O-N 3.2Å; R409-D411 PolarHBondContact O-N 3.1Å; R409-R414 PolarHBondContact O-NH1 3.43Å
410	E	91.1	Very high	94.9	Very high	182 Å²	182	53.4 Å²	53.4	85%	0.85	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.3	-175.6	-55.7	-55.7	138.4	0	0	114.2	N408 P412	N408-E410 VanDerWaalsContact C-N 3.3Å; N408-E410 PolarHBondContact O-N 3.12Å; E410-P412 VanDerWaalsContact O-CD 3.25Å; E410-P412 WeakPolarHBondContact O-CD 3.19Å
411	D	91.6	Very high	94.8	Very high	42 Å²	42	54 Å²	54	23%	0.225	27%	0.271	C	S	.	.			trans	-80.2	114.3	179	-178.8	3.4	0	0	0	110.2	N408 R409 H413 R414	N408-D411 PolarHBondContact O-N 3.1Å; R409-D411 PolarHBondContact O-N 3.1Å; D411-H413 PolarHBondContact O-N 3.47Å; D411-H413 WeakPolarHBondContact OD1-CB 3.41Å; D411-H413 PolarHBondContact OD1-N 3.19Å; D411-R414 HydrophobicContact CB-CB 4.15Å; D411-R414 VanDerWaalsContact O-CB 3.27Å; D411-R414 WeakPolarHBondContact O-CB 3.27Å; D411-R414 WeakPolarHBondContact O-CG 3.34Å; D411-R414 PolarHBondContact O-N 3.11Å
412	P	89.5	Confident	94.7	Very high	87 Å²	87	54 Å²	54	57%	0.565	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.3	178	27.4	-36.2	0	0	0	113	E410	E410-P412 VanDerWaalsContact O-CD 3.25Å; E410-P412 WeakPolarHBondContact O-CD 3.19Å
413	H	91.9	Very high	94.6	Very high	45 Å²	45	50.5 Å²	50.5	21%	0.208	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	9.7	177.8	-58.5	-49.6	0	0	0	113.6	D411 F415 S416 E417	D411-H413 PolarHBondContact O-N 3.47Å; D411-H413 WeakPolarHBondContact OD1-CB 3.41Å; D411-H413 PolarHBondContact OD1-N 3.19Å; H413-F415 PolarHBondContact O-N 3.47Å; H413-S416 PolarHBondContact O-N 3.04Å; H413-E417 PolarHBondContact O-N 2.94Å
414	R	94.8	Very high	94.4	Very high	21 Å²	21	47 Å²	47	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-50.1	-36.5	-174.4	70	-171.4	-164.1	-169.2	8.7	114.1	E377 F404 L405 N408 R409 D411 L418	E377-R414 PolarHBondContact O-NH2 2.83Å; E377-R414 IonicContact OE2-NH1 2.88Å; E377-R414 IonicContact OE2-NH2 2.75Å; F404-R414 HydrophobicContact CE1-CB 4.3Å; F404-R414 WeakPolarHBondContact CE1-O 3.39Å; L405-R414 HydrophobicContact CD2-CG 4.16Å; N408-R414 HydrophobicContact CB-CB 4.28Å; N408-R414 WeakPolarHBondContact O-CB 3.37Å; N408-R414 VanDerWaalsContact O-CD 3.25Å; N408-R414 WeakPolarHBondContact O-CD 3.48Å; R409-R414 PolarHBondContact O-NH1 3.43Å; D411-R414 HydrophobicContact CB-CB 4.15Å; D411-R414 VanDerWaalsContact O-CB 3.27Å; D411-R414 WeakPolarHBondContact O-CB 3.27Å; D411-R414 WeakPolarHBondContact O-CG 3.34Å; D411-R414 PolarHBondContact O-N 3.11Å; R414-L418 WeakPolarHBondContact O-CB 3.49Å; R414-L418 PolarHBondContact O-N 2.91Å
415	F	96.4	Very high	94.1	Very high	8 Å²	8	48.7 Å²	48.7	4%	0.035	26%	0.258	C	S	.	.	H	α-helix	trans	-72.8	-36.6	-179.5	-57.4	-60.3	0	0	0	112.9	N70 V380 L405 H413 A419 V448 P450	N70-F415 VanDerWaalsContact O-CD2 3.29Å; N70-F415 WeakPolarHBondContact O-CD2 3.3Å; V380-F415 HydrophobicContact CG1-CD1 4.06Å; V380-F415 HydrophobicContact CG1-CE1 3.6Å; L405-F415 HydrophobicContact CD1-CE1 4.37Å; L405-F415 HydrophobicContact CD2-CD1 3.99Å; L405-F415 HydrophobicContact CD2-CE1 3.84Å; H413-F415 PolarHBondContact O-N 3.47Å; F415-A419 PolarHBondContact O-N 3.2Å; F415-V448 HydrophobicContact CB-CB 4.19Å; F415-V448 HydrophobicContact CB-CG1 3.95Å; F415-V448 HydrophobicContact CD1-CG1 3.66Å; F415-V448 HydrophobicContact CG-CG1 4.22Å; F415-P450 HydrophobicContact CD2-CB 4.44Å; F415-P450 HydrophobicContact CD2-CG 4.05Å; F415-P450 HydrophobicContact CE1-CB 3.98Å; F415-P450 HydrophobicContact CE2-CB 3.75Å; F415-P450 HydrophobicContact CE2-CG 3.71Å; F415-P450 HydrophobicContact CZ-CB 3.48Å; F415-P450 VanDerWaalsContact CZ-CB 3.48Å; F415-P450 HydrophobicContact CZ-CG 3.99Å
416	S	95.8	Very high	93.7	Very high	19 Å²	19	48.9 Å²	48.9	13%	0.133	26%	0.259	C	S	.	.	H	α-helix	trans	-70.5	-38.7	173.8	-68.5	0	0	0	0	111.3	H413 A419 K420	H413-S416 PolarHBondContact O-N 3.04Å; S416-A419 PolarHBondContact O-N 2.96Å; S416-K420 WeakPolarHBondContact O-CG 3.5Å; S416-K420 PolarHBondContact O-N 2.73Å
417	E	96.2	Very high	93.2	Very high	48 Å²	48	46.7 Å²	46.7	22%	0.224	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-34.2	175.3	-63.4	-55.2	134.9	0	0	111.9	F404 H413 K420 M421	F404-E417 HydrophobicContact CE1-CB 4.38Å; F404-E417 HydrophobicContact CZ-CB 3.66Å; H413-E417 PolarHBondContact O-N 2.94Å; E417-K420 PolarHBondContact O-N 3.36Å; E417-K420 IonicContact OE1-NZ 3.13Å; E417-K420 PolarHBondContact OE1-NZ 3.4Å; E417-K420 IonicContact OE2-NZ 3.26Å; E417-M421 WeakPolarHBondContact O-CB 3.24Å; E417-M421 PolarHBondContact O-N 3.44Å
418	L	97.7	Very high	91.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-47.3	169.5	173.5	52.2	0	0	0	111.2	V401 F404 L405 R414 K420 M421 L422 V448	V401-L418 HydrophobicContact CB-CD2 4.42Å; V401-L418 HydrophobicContact CG1-CD2 4.08Å; V401-L418 HydrophobicContact CG2-CD1 4.04Å; V401-L418 HydrophobicContact CG2-CD2 4.13Å; F404-L418 HydrophobicContact CB-CD1 4.1Å; F404-L418 HydrophobicContact CD1-CB 3.74Å; F404-L418 HydrophobicContact CD1-CD1 4.2Å; F404-L418 HydrophobicContact CD1-CG 4.39Å; F404-L418 HydrophobicContact CE1-CB 3.86Å; F404-L418 HydrophobicContact CG-CB 4.42Å; F404-L418 HydrophobicContact CG-CD1 4.16Å; L405-L418 HydrophobicContact CD1-CD2 3.96Å; L405-L418 HydrophobicContact CD2-CD2 3.8Å; L405-L418 HydrophobicContact CG-CD2 3.82Å; R414-L418 WeakPolarHBondContact O-CB 3.49Å; R414-L418 PolarHBondContact O-N 2.91Å; L418-K420 VanDerWaalsContact C-N 3.32Å; L418-K420 PolarHBondContact O-N 3.02Å; L418-M421 HydrophobicContact CD1-CE 3.26Å; L418-M421 PolarHBondContact O-N 3.42Å; L418-M421 VanDerWaalsContact O-N 3.16Å; L418-L422 HydrophobicContact CD1-CD1 4.22Å; L418-L422 HydrophobicContact CD1-CG 4.08Å; L418-L422 HydrophobicContact CG-CD1 4.44Å; L418-L422 WeakPolarHBondContact O-CG 3.47Å; L418-L422 PolarHBondContact O-N 2.93Å; L418-V448 HydrophobicContact CB-CG2 4.41Å; L418-V448 HydrophobicContact CD2-CG1 3.73Å; L418-V448 HydrophobicContact CD2-CG2 4.31Å; L418-V448 HydrophobicContact CG-CG1 4.29Å; L418-V448 HydrophobicContact CG-CG2 4.01Å
419	A	97.9	Very high	90.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.5	-45.4	176.7	0	0	0	0	0	111.4	A74 F415 S416 L422 I423 V446 V448	A74-A419 HydrophobicContact CB-CB 3.7Å; F415-A419 PolarHBondContact O-N 3.2Å; S416-A419 PolarHBondContact O-N 2.96Å; A419-L422 PolarHBondContact O-N 3.21Å; A419-I423 PolarHBondContact O-N 3.21Å; A419-V446 HydrophobicContact CB-CB 4.39Å; A419-V446 HydrophobicContact CB-CG1 4.35Å; A419-V448 HydrophobicContact CB-CG2 3.86Å
420	K	96.1	Very high	88	Confident	41 Å²	41	53 Å²	53	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-48	173.8	-69.4	174.8	-173.2	168.5	0	111.9	V58 S60 A74 S416 E417 L418 L422 I423 H424	V58-K420 HydrophobicContact CG1-CB 4.22Å; V58-K420 HydrophobicContact CG1-CG 3.86Å; S60-K420 WeakPolarHBondContact OG-CE 3.12Å; S60-K420 PolarHBondContact OG-NZ 2.75Å; A74-K420 HydrophobicContact CB-CG 3.89Å; S416-K420 WeakPolarHBondContact O-CG 3.5Å; S416-K420 PolarHBondContact O-N 2.73Å; E417-K420 PolarHBondContact O-N 3.36Å; E417-K420 IonicContact OE1-NZ 3.13Å; E417-K420 PolarHBondContact OE1-NZ 3.4Å; E417-K420 IonicContact OE2-NZ 3.26Å; L418-K420 VanDerWaalsContact C-N 3.32Å; L418-K420 PolarHBondContact O-N 3.02Å; K420-L422 VanDerWaalsContact C-N 3.27Å; K420-L422 PolarHBondContact O-N 3.14Å; K420-I423 PolarHBondContact O-N 3.14Å; K420-I423 VanDerWaalsContact O-N 3.15Å; K420-H424 PolarHBondContact O-N 3.08Å; K420-H424 PolarHBondContact O-ND1 3.24Å
421	M	95.9	Very high	85.7	Confident	33 Å²	33	49.9 Å²	49.9	16%	0.163	26%	0.26	C	S	.	.	H	α-helix	trans	-58.7	-42.1	-179.1	-179.7	-154.6	48.9	0	0	110.7	L400 F404 E417 L418 I423 H424 N425	L400-M421 HydrophobicContact CB-CE 4Å; F404-M421 HydrophobicContact CB-CE 3.72Å; F404-M421 HydrophobicContact CB-SD 4.1Å; F404-M421 HydrophobicContact CD2-CB 4.43Å; F404-M421 HydrophobicContact CD2-CE 3.87Å; F404-M421 HydrophobicContact CD2-CG 4.45Å; F404-M421 HydrophobicContact CD2-SD 3.53Å; F404-M421 VanDerWaalsContact CD2-SD 3.53Å; F404-M421 HydrophobicContact CE2-CB 4.45Å; F404-M421 HydrophobicContact CE2-SD 4.38Å; F404-M421 HydrophobicContact CG-CE 3.93Å; F404-M421 HydrophobicContact CG-SD 4.15Å; E417-M421 WeakPolarHBondContact O-CB 3.24Å; E417-M421 PolarHBondContact O-N 3.44Å; L418-M421 HydrophobicContact CD1-CE 3.26Å; L418-M421 PolarHBondContact O-N 3.42Å; L418-M421 VanDerWaalsContact O-N 3.16Å; M421-I423 VanDerWaalsContact C-N 3.32Å; M421-I423 PolarHBondContact O-N 3.21Å; M421-H424 PolarHBondContact O-N 2.6Å; M421-N425 PolarHBondContact O-N 3.06Å; M421-N425 PolarHBondContact O-ND2 3.26Å
422	L	96.6	Very high	83.4	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-44.9	176.5	-71	174.1	0	0	0	111.3	I382 L388 V397 L400 L418 A419 K420 N425 V446	I382-L422 HydrophobicContact CD1-CD1 4.26Å; I382-L422 HydrophobicContact CG2-CD1 4.23Å; L388-L422 HydrophobicContact CD1-CB 4.15Å; V397-L422 HydrophobicContact CG1-CD1 4.45Å; V397-L422 HydrophobicContact CG1-CD2 4.15Å; L400-L422 HydrophobicContact CB-CD2 4.07Å; L400-L422 HydrophobicContact CD1-CD2 4Å; L418-L422 HydrophobicContact CD1-CD1 4.22Å; L418-L422 HydrophobicContact CD1-CG 4.08Å; L418-L422 HydrophobicContact CG-CD1 4.44Å; L418-L422 WeakPolarHBondContact O-CG 3.47Å; L418-L422 PolarHBondContact O-N 2.93Å; A419-L422 PolarHBondContact O-N 3.21Å; K420-L422 VanDerWaalsContact C-N 3.27Å; K420-L422 PolarHBondContact O-N 3.14Å; L422-N425 PolarHBondContact O-N 2.76Å; L422-V446 HydrophobicContact CD1-CG1 4.01Å
423	I	94.1	Very high	81.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-42.5	175.2	-67.4	179.7	0	0	0	112.2	V58 A74 I76 A419 K420 M421 N425 T426 V444 V446	V58-I423 HydrophobicContact CG1-CB 4.35Å; V58-I423 HydrophobicContact CG1-CD1 4.12Å; V58-I423 HydrophobicContact CG1-CG2 4.18Å; V58-I423 HydrophobicContact CG2-CG2 3.77Å; A74-I423 VanDerWaalsContact C-CD1 3.44Å; A74-I423 HydrophobicContact CB-CD1 3.63Å; A74-I423 WeakPolarHBondContact O-CD1 3.43Å; I76-I423 HydrophobicContact CB-CG2 3.86Å; I76-I423 HydrophobicContact CD1-CG2 4.49Å; I76-I423 HydrophobicContact CG2-CG2 3.4Å; A419-I423 PolarHBondContact O-N 3.21Å; K420-I423 PolarHBondContact O-N 3.14Å; K420-I423 VanDerWaalsContact O-N 3.15Å; M421-I423 VanDerWaalsContact C-N 3.32Å; M421-I423 PolarHBondContact O-N 3.21Å; I423-N425 PolarHBondContact O-N 3.42Å; I423-N425 VanDerWaalsContact O-N 3.12Å; I423-T426 PolarHBondContact O-N 2.99Å; I423-T426 PolarHBondContact O-OG1 3.13Å; I423-V444 HydrophobicContact CG1-CB 4.42Å; I423-V444 HydrophobicContact CG1-CG1 3.98Å; I423-V446 HydrophobicContact CD1-CG2 4.26Å; I423-V446 HydrophobicContact CG1-CG2 3.85Å
424	H	91.8	Very high	78.6	Confident	100 Å²	100	55.6 Å²	55.6	46%	0.463	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-24.2	177.9	-70.3	94.5	0	0	0	112.8	K420 M421 T426 Q427	K420-H424 PolarHBondContact O-N 3.08Å; K420-H424 PolarHBondContact O-ND1 3.24Å; M421-H424 PolarHBondContact O-N 2.6Å; H424-T426 PolarHBondContact O-N 2.83Å; H424-Q427 PolarHBondContact CD2-OE1 3.05Å
425	N	90.9	Very high	75.9	Confident	64 Å²	64	58.9 Å²	58.9	34%	0.342	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-4.3	174.5	-75.2	-94.9	0	0	0	113.2	L392 L400 M421 L422 I423	L392-N425 HydrophobicContact CD1-CB 4.14Å; L392-N425 HydrophobicContact CD2-CB 4.48Å; L400-N425 HydrophobicContact CD1-CB 4.25Å; M421-N425 PolarHBondContact O-N 3.06Å; M421-N425 PolarHBondContact O-ND2 3.26Å; L422-N425 PolarHBondContact O-N 2.76Å; I423-N425 PolarHBondContact O-N 3.42Å; I423-N425 VanDerWaalsContact O-N 3.12Å
426	T	88.1	Confident	73.2	Confident	4 Å²	4	67 Å²	67	3%	0.025	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-8.2	173.5	73.5	0	0	0	0	113.5	L388 V391 I423 H424 V439 S440	L388-T426 HydrophobicContact CD1-CG2 3.69Å; V391-T426 HydrophobicContact CB-CG2 4.43Å; I423-T426 PolarHBondContact O-N 2.99Å; I423-T426 PolarHBondContact O-OG1 3.13Å; H424-T426 PolarHBondContact O-N 2.83Å; T426-V439 CarbonylContact O-C 3.53Å; T426-V439 WeakPolarHBondContact O-CA 3.32Å; T426-S440 PolarHBondContact O-N 3.24Å
427	Q	81.1	Confident	71.1	Confident	46 Å²	46	68.7 Å²	68.7	22%	0.215	42%	0.424	C	S	.	.	S	Bend	trans	-87	-1.2	-175.7	-62.6	-178.7	-71.3	0	0	114.1	P53 I76 H424	P53-Q427 PolarHBondContact O-NE2 3.35Å; I76-Q427 HydrophobicContact CD1-CG 4.39Å; H424-Q427 PolarHBondContact CD2-OE1 3.05Å
428	G	66.3	Low	69.6	Low	31 Å²	31	72 Å²	72	32%	0.32	44%	0.44	S	S	.	.			trans	71.8	161.8	-173.9	0	0	0	0	0	113.9
429	K	56.8	Low	68.8	Low	167 Å²	167	74.4 Å²	74.4	73%	0.726	45%	0.454	S	S	*	.			trans	-120.8	134.9	164.8	-73.1	-175	176.1	-175.3	0	108.1	D431	K429-D431 PolarHBondContact O-N 3.01Å
430	D	46.5	Very low	68.1	Low	176 Å²	176	74.6 Å²	74.6	94%	0.941	46%	0.455	S	S	*	.			trans	-71.2	51	169.8	-108.1	-8.6	0	0	0	110.9	G432	D430-G432 PolarHBondContact O-N 2.63Å
431	D	43.2	Very low	67.4	Low	115 Å²	115	80.1 Å²	80.1	62%	0.615	48%	0.476	S	S	*	.			trans	-97.3	85.8	175.2	-73.8	-27.1	0	0	0	108.6	K429 A433	K429-D431 PolarHBondContact O-N 3.01Å; D431-A433 VanDerWaalsContact C-N 3.32Å; D431-A433 PolarHBondContact O-N 3.37Å
432	G	43.3	Very low	67.1	Low	86 Å²	86	79.9 Å²	79.9	89%	0.887	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	88.1	171.3	0	0	0	0	0	111.6	D430	D430-G432 PolarHBondContact O-N 2.63Å
433	A	41.4	Very low	66.9	Low	97 Å²	97	79.9 Å²	79.9	80%	0.802	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-168.8	-19.4	160.6	0	0	0	0	0	113.9	D431	D431-A433 VanDerWaalsContact C-N 3.32Å; D431-A433 PolarHBondContact O-N 3.37Å
434	T	40.1	Very low	66.9	Low	111 Å²	111	79.9 Å²	79.9	68%	0.681	48%	0.476	S	S	*	.	S	Bend	trans	-139	110.2	177	49.4	0	0	0	0	109	E436	T434-E436 PolarHBondContact O-N 3.47Å
435	G	37.3	Very low	67.2	Low	91 Å²	91	75.1 Å²	75.1	94%	0.938	45%	0.454	S	S	*	.	S	Bend	trans	-69.2	44.6	-171.4	0	0	0	0	0	116.5
436	E	41.1	Very low	67.6	Low	179 Å²	179	72.1 Å²	72.1	84%	0.836	44%	0.437	S	S	*	.			trans	-123.3	32.2	179.9	-66.1	-169.8	162.2	0	0	112.6	T434 Q438	T434-E436 PolarHBondContact O-N 3.47Å; E436-Q438 PolarHBondContact O-N 2.91Å
437	G	50.6	Low	68.1	Low	54 Å²	54	71.9 Å²	71.9	56%	0.557	44%	0.436	S	S	*	.			trans	-84.1	81.5	167.8	0	0	0	0	0	110.5	V439	G437-V439 PolarHBondContact O-N 2.85Å
438	Q	65.8	Low	68.9	Low	118 Å²	118	69.7 Å²	69.7	55%	0.551	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-72.3	125	172.3	-76.2	-178.1	-13.1	0	0	109.6	V391 E436	V391-Q438 HydrophobicContact CG1-CB 3.97Å; V391-Q438 WeakPolarHBondContact CG1-O 3.28Å; E436-Q438 PolarHBondContact O-N 2.91Å
439	V	79.6	Confident	70.4	Confident	50 Å²	50	68.3 Å²	68.3	30%	0.303	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-101.9	138.1	174.3	-177.4	0	0	0	0	107.3	T426 G437	T426-V439 CarbonylContact O-C 3.53Å; T426-V439 WeakPolarHBondContact O-CA 3.32Å; G437-V439 PolarHBondContact O-N 2.85Å
440	S	82.7	Confident	72.3	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.021	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-69	143.6	170.2	179.2	0	0	0	0	108.7	N78 G387 V391 T426 D442	N78-S440 PolarHBondContact ND2-O 3.13Å; G387-S440 WeakPolarHBondContact CA-OG 3.3Å; G387-S440 VanDerWaalsContact O-CB 3.25Å; G387-S440 WeakPolarHBondContact O-CB 3.24Å; G387-S440 PolarHBondContact O-OG 2.93Å; V391-S440 VanDerWaalsContact CG2-N 3.34Å; T426-S440 PolarHBondContact O-N 3.24Å; S440-D442 PolarHBondContact OG-N 3.44Å; S440-D442 VanDerWaalsContact OG-N 3.1Å; S440-D442 PolarHBondContact OG-O 3.38Å; S440-D442 VanDerWaalsContact OG-O 3.1Å
441	Y	83.1	Confident	74.5	Confident	158 Å²	158	53 Å²	53	62%	0.62	34%	0.337	S	S	*	.			trans	-106.5	0.3	169.5	-65.4	-83	0	0	0	112.5	N78	N78-Y441 WeakPolarHBondContact ND2-CA 3.38Å; N78-Y441 PolarHBondContact ND2-N 3.01Å
442	D	88.4	Confident	76.5	Confident	28 Å²	28	50.8 Å²	50.8	15%	0.15	32%	0.323	C	S	.	.	S	Bend	trans	-107.5	157.5	178.2	-145.6	-43.7	0	0	0	111.4	N78 K81 S440 V444	N78-D442 WeakPolarHBondContact CB-O 3.48Å; N78-D442 PolarHBondContact ND2-N 2.95Å; N78-D442 PolarHBondContact ND2-O 3.21Å; K81-D442 WeakPolarHBondContact CD-OD1 3.25Å; K81-D442 WeakPolarHBondContact CE-OD1 3.27Å; K81-D442 IonicContact NZ-OD1 3.69Å; K81-D442 PolarHBondContact NZ-OD1 2.88Å; K81-D442 IonicContact NZ-OD2 2.55Å; K81-D442 PolarHBondContact NZ-OD2 3.45Å; S440-D442 PolarHBondContact OG-N 3.44Å; S440-D442 VanDerWaalsContact OG-N 3.1Å; S440-D442 PolarHBondContact OG-O 3.38Å; S440-D442 VanDerWaalsContact OG-O 3.1Å; D442-V444 WeakPolarHBondContact O-CG2 3.35Å
443	D	92.9	Very high	77.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	29%	0.289	C	S	.	.			trans	-50.8	145.7	161.9	-68.9	-23.2	0	0	0	109.4	I77 N78 N85 E86	I77-D443 VanDerWaalsContact CA-OD1 3.25Å; I77-D443 WeakPolarHBondContact CA-OD1 2.95Å; I77-D443 VanDerWaalsContact CG2-OD1 3.31Å; I77-D443 WeakPolarHBondContact CG2-OD1 3.43Å; N78-D443 PolarHBondContact N-OD1 2.88Å; N85-D443 WeakPolarHBondContact CA-OD2 3.28Å; N85-D443 VanDerWaalsContact OD1-CB 3.32Å; N85-D443 WeakPolarHBondContact OD1-CB 3.37Å; N85-D443 PolarHBondContact OD1-OD2 3.46Å; E86-D443 PolarHBondContact N-OD2 2.96Å
444	V	94.7	Very high	78.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	120.8	-177.6	-168.1	0	0	0	0	109.2	E75 I76 L388 I423 D442 V446	E75-V444 CarbonylContact C-O 3.51Å; E75-V444 WeakPolarHBondContact CA-O 3.36Å; I76-V444 HydrophobicContact CG2-CB 3.92Å; I76-V444 HydrophobicContact CG2-CG2 4.18Å; I76-V444 PolarHBondContact N-O 3.25Å; I76-V444 PolarHBondContact O-N 2.95Å; I76-V444 VanDerWaalsContact O-N 3.15Å; L388-V444 HydrophobicContact CB-CG1 3.85Å; L388-V444 HydrophobicContact CD1-CG1 4.34Å; I423-V444 HydrophobicContact CG1-CB 4.42Å; I423-V444 HydrophobicContact CG1-CG1 3.98Å; D442-V444 WeakPolarHBondContact O-CG2 3.35Å; V444-V446 HydrophobicContact CG1-CG2 4.11Å
445	S	97.6	Very high	78.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.5	175	-59.9	0	0	0	0	110.2	D87 A384 T385	D87-S445 WeakPolarHBondContact CB-OG 3.42Å; D87-S445 VanDerWaalsContact OD2-CB 3.25Å; D87-S445 WeakPolarHBondContact OD2-CB 3.22Å; D87-S445 PolarHBondContact OD2-N 3.17Å; D87-S445 PolarHBondContact OD2-OG 3.33Å; A384-S445 WeakPolarHBondContact CA-O 3.48Å; A384-S445 WeakPolarHBondContact CB-O 3.06Å; T385-S445 PolarHBondContact N-O 3.41Å; T385-S445 VanDerWaalsContact N-O 3.15Å; T385-S445 PolarHBondContact OG1-N 2.74Å
446	V	98.6	Very high	78.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	126.6	-173.3	-175.5	0	0	0	0	110.7	Y73 A74 I382 M383 A384 L388 A419 L422 I423 V444 V448	Y73-V446 VanDerWaalsContact CA-O 3.29Å; Y73-V446 WeakPolarHBondContact CA-O 3.23Å; Y73-V446 WeakPolarHBondContact CD2-O 3.34Å; A74-V446 PolarHBondContact N-O 3.41Å; A74-V446 PolarHBondContact O-N 3.44Å; I382-V446 HydrophobicContact CG2-CG1 4.26Å; M383-V446 CarbonylContact O-C 3.57Å; M383-V446 WeakPolarHBondContact O-CA 3.39Å; A384-V446 HydrophobicContact CB-CB 4.48Å; A384-V446 HydrophobicContact CB-CG1 4.49Å; A384-V446 HydrophobicContact CB-CG2 3.96Å; L388-V446 HydrophobicContact CD1-CG2 4.26Å; L388-V446 HydrophobicContact CD2-CG2 4.16Å; A419-V446 HydrophobicContact CB-CB 4.39Å; A419-V446 HydrophobicContact CB-CG1 4.35Å; L422-V446 HydrophobicContact CD1-CG1 4.01Å; I423-V446 HydrophobicContact CD1-CG2 4.26Å; I423-V446 HydrophobicContact CG1-CG2 3.85Å; V444-V446 HydrophobicContact CG1-CG2 4.11Å; V446-V448 HydrophobicContact CG1-CG2 4.33Å
447	F	98.7	Very high	78.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.7	161.2	-86.9	-72	0	0	0	111.2	F36 L67 G72 Y73 A89 C91 W123 A124 L125 I382 M383 I449	F36-F447 HydrophobicContact CE1-CZ 4.06Å; F36-F447 HydrophobicContact CZ-CE1 4.45Å; F36-F447 AromaticContact CZ-CZ 3.89Å; F36-F447 HydrophobicContact CZ-CZ 3.89Å; L67-F447 HydrophobicContact CD1-CE1 3.94Å; G72-F447 WeakPolarHBondContact O-CA 3.4Å; G72-F447 WeakPolarHBondContact O-CD1 3.35Å; Y73-F447 AromaticContact CD2-CD1 3.77Å; Y73-F447 HydrophobicContact CD2-CD1 3.77Å; Y73-F447 AromaticContact CD2-CD2 3.84Å; Y73-F447 HydrophobicContact CD2-CD2 3.84Å; Y73-F447 AromaticContact CD2-CE1 3.6Å; Y73-F447 HydrophobicContact CD2-CE1 3.6Å; Y73-F447 AromaticContact CD2-CE2 3.68Å; Y73-F447 HydrophobicContact CD2-CE2 3.68Å; Y73-F447 AromaticContact CD2-CG 3.88Å; Y73-F447 HydrophobicContact CD2-CG 3.88Å; Y73-F447 AromaticContact CD2-CZ 3.55Å; Y73-F447 HydrophobicContact CD2-CZ 3.55Å; Y73-F447 HydrophobicContact CE2-CD2 4.14Å; Y73-F447 AromaticContact CE2-CE2 3.84Å; Y73-F447 HydrophobicContact CE2-CE2 3.84Å; Y73-F447 HydrophobicContact CE2-CZ 4.04Å; Y73-F447 HydrophobicContact CG-CD1 4.43Å; Y73-F447 HydrophobicContact CG-CE1 4.18Å; Y73-F447 HydrophobicContact CG-CZ 4.41Å; A89-F447 HydrophobicContact CB-CE2 3.78Å; A89-F447 HydrophobicContact CB-CZ 4.07Å; C91-F447 HydrophobicContact CB-CE1 4.27Å; C91-F447 HydrophobicContact CB-CZ 4.14Å; W123-F447 AromaticContact CD1-CD1 3.96Å; W123-F447 AromaticContact CD1-CE1 3.83Å; A124-F447 WeakPolarHBondContact O-CE2 3.33Å; L125-F447 HydrophobicContact CD1-CD2 4.35Å; L125-F447 HydrophobicContact CD2-CD2 3.52Å; L125-F447 HydrophobicContact CD2-CE2 3.69Å; L125-F447 HydrophobicContact CG-CD2 3.77Å; L125-F447 HydrophobicContact CG-CE2 4.2Å; I382-F447 WeakPolarHBondContact CA-O 3.15Å; M383-F447 HydrophobicContact CB-CB 4.21Å; M383-F447 PolarHBondContact N-O 3.06Å; M383-F447 PolarHBondContact O-N 3.34Å; F447-I449 HydrophobicContact CB-CG1 4.35Å
448	V	98.5	Very high	77.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	107.9	169.6	-179.1	0	0	0	0	107.8	A71 G72 V380 I382 F415 L418 A419 V446	A71-V448 CarbonylContact C-O 3.57Å; A71-V448 WeakPolarHBondContact CA-O 3.22Å; G72-V448 PolarHBondContact N-O 3.16Å; G72-V448 PolarHBondContact O-N 3.43Å; V380-V448 HydrophobicContact CB-CG1 4.22Å; V380-V448 HydrophobicContact CG1-CG1 4.17Å; V380-V448 HydrophobicContact CG2-CG1 4.47Å; I382-V448 HydrophobicContact CD1-CB 4.31Å; I382-V448 HydrophobicContact CD1-CG1 4.04Å; I382-V448 HydrophobicContact CD1-CG2 3.87Å; F415-V448 HydrophobicContact CB-CB 4.19Å; F415-V448 HydrophobicContact CB-CG1 3.95Å; F415-V448 HydrophobicContact CD1-CG1 3.66Å; F415-V448 HydrophobicContact CG-CG1 4.22Å; L418-V448 HydrophobicContact CB-CG2 4.41Å; L418-V448 HydrophobicContact CD2-CG1 3.73Å; L418-V448 HydrophobicContact CD2-CG2 4.31Å; L418-V448 HydrophobicContact CG-CG1 4.29Å; L418-V448 HydrophobicContact CG-CG2 4.01Å; A419-V448 HydrophobicContact CB-CG2 3.86Å; V446-V448 HydrophobicContact CG1-CG2 4.33Å
449	I	97.8	Very high	75.6	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.2	-173.9	-57.1	166.8	0	0	0	108.7	A71 W123 A223 V380 V381 M383 F447	A71-I449 HydrophobicContact CB-CG1 4.3Å; W123-I449 HydrophobicContact CB-CD1 3.79Å; W123-I449 HydrophobicContact CD2-CD1 3.64Å; W123-I449 HydrophobicContact CD2-CG1 4.12Å; W123-I449 HydrophobicContact CD2-CG2 4.38Å; W123-I449 HydrophobicContact CE3-CD1 3.9Å; W123-I449 HydrophobicContact CE3-CG2 4.4Å; W123-I449 HydrophobicContact CG-CD1 3.58Å; W123-I449 HydrophobicContact CG-CG1 4.1Å; W123-I449 HydrophobicContact CH2-CG2 3.92Å; W123-I449 HydrophobicContact CZ2-CG2 3.96Å; W123-I449 HydrophobicContact CZ3-CG2 4.17Å; A223-I449 HydrophobicContact CB-CD1 4.28Å; V380-I449 CarbonylContact C-O 3.59Å; V380-I449 VanDerWaalsContact CA-O 3.3Å; V380-I449 WeakPolarHBondContact CA-O 3.41Å; V381-I449 HydrophobicContact CB-CB 4.32Å; V381-I449 PolarHBondContact N-O 2.99Å; V381-I449 PolarHBondContact O-N 3.26Å; M383-I449 HydrophobicContact CG-CD1 4.46Å; M383-I449 HydrophobicContact SD-CD1 3.46Å; M383-I449 WeakPolarHBondContact SD-CD1 3.19Å; F447-I449 HydrophobicContact CB-CG1 4.35Å
450	P	95.9	Very high	73.5	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	139.1	173.9	28.1	-32.3	0	0	0	111.4	W69 F415	W69-P450 PolarHBondContact NE1-O 3.19Å; W69-P450 WeakPolarHBondContact O-CG 3.36Å; F415-P450 HydrophobicContact CD2-CB 4.44Å; F415-P450 HydrophobicContact CD2-CG 4.05Å; F415-P450 HydrophobicContact CE1-CB 3.98Å; F415-P450 HydrophobicContact CE2-CB 3.75Å; F415-P450 HydrophobicContact CE2-CG 3.71Å; F415-P450 HydrophobicContact CZ-CB 3.48Å; F415-P450 VanDerWaalsContact CZ-CB 3.48Å; F415-P450 HydrophobicContact CZ-CG 3.99Å
451	L	92.4	Very high	70.9	Confident	16 Å²	16	69.3 Å²	69.3	8%	0.084	38%	0.378	C	S	.	.	S	Bend	trans	-92.6	-29.6	174.6	-64.5	-171.3	0	0	0	112.2	L230 L242 L368 L375 D379 V381 S453	L230-L451 HydrophobicContact CD2-CD2 4.4Å; L242-L451 HydrophobicContact CD1-CD1 3.54Å; L368-L451 HydrophobicContact CD2-CD1 4.42Å; L375-L451 HydrophobicContact CD1-CB 3.76Å; L375-L451 WeakPolarHBondContact CD1-O 3.47Å; L375-L451 HydrophobicContact CD2-CB 3.84Å; L375-L451 HydrophobicContact CD2-CD1 3.98Å; L375-L451 HydrophobicContact CG-CB 4.39Å; D379-L451 PolarHBondContact O-N 2.87Å; V381-L451 HydrophobicContact CG2-CD1 4.09Å; V381-L451 HydrophobicContact CG2-CD2 3.94Å; V381-L451 HydrophobicContact CG2-CG 4.16Å; L451-S453 PolarHBondContact O-N 3.4Å
452	H	86.2	Confident	70.3	Confident	69 Å²	69	64.9 Å²	64.9	32%	0.319	37%	0.366	S	S	.	.	S	Bend	trans	-75.3	115.4	174.3	-167.6	89.2	0	0	0	110.5	L375 E376	L375-H452 PolarHBondContact O-ND1 3.4Å; L375-H452 VanDerWaalsContact O-ND1 3.1Å; E376-H452 VanDerWaalsContact O-CB 3.31Å; E376-H452 WeakPolarHBondContact O-CB 3.21Å
453	S	68.2	Low	69.3	Low	23 Å²	23	66.8 Å²	66.8	16%	0.161	38%	0.378	C	S	.	.			trans	-96.3	130.1	176.6	179.8	0	0	0	0	110.9	L451 D455	L451-S453 PolarHBondContact O-N 3.4Å; S453-D455 PolarHBondContact O-N 2.99Å; S453-D455 WeakPolarHBondContact OG-CB 3.49Å; S453-D455 PolarHBondContact OG-N 2.92Å; S453-D455 VanDerWaalsContact OG-N 3.14Å
454	Q	51.9	Low	68	Low	163 Å²	163	70.5 Å²	70.5	76%	0.762	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-72.1	-7.8	170.5	-70.4	-165.9	-17	0	0	113.1	K456	Q454-K456 PolarHBondContact O-N 3.15Å
455	D	48.2	Very low	66.4	Low	131 Å²	131	74.6 Å²	74.6	70%	0.701	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-76.3	-1.4	-178.6	-77.8	-25.6	0	0	0	114.3	S453 G457	S453-D455 PolarHBondContact O-N 2.99Å; S453-D455 WeakPolarHBondContact OG-CB 3.49Å; S453-D455 PolarHBondContact OG-N 2.92Å; S453-D455 VanDerWaalsContact OG-N 3.14Å; D455-G457 PolarHBondContact O-N 3.04Å; D455-G457 VanDerWaalsContact O-N 3.1Å
456	K	40.3	Very low	64.5	Low	174 Å²	174	79.3 Å²	79.3	76%	0.757	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-69.6	-0.6	173.8	-72.7	-169.3	175.7	-176.7	0	113.8	Q454	Q454-K456 PolarHBondContact O-N 3.15Å
457	G	31.1	Very low	62.2	Low	67 Å²	67	84.6 Å²	84.6	69%	0.691	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-94.2	-6.4	-174.9	0	0	0	0	0	118	D455	D455-G457 PolarHBondContact O-N 3.04Å; D455-G457 VanDerWaalsContact O-N 3.1Å
458	N	28.8	Very low	59.6	Low	161 Å²	161	90.6 Å²	90.6	86%	0.861	51%	0.513	S	S	*	.	S	Bend	trans	-130.2	12.2	-169.1	-116.6	17.7	0	0	0	117.2
459	S	31.2	Very low	56.6	Low	118 Å²	118	97.6 Å²	97.6	83%	0.825	55%	0.552	S	S	*	*	S	Bend	trans	-102.4	61	172.6	63.6	0	0	0	0	111.7
460	G	35.3	Very low	53.2	Low	69 Å²	69	105.6 Å²	105.6	71%	0.711	60%	0.597	S	S	*	*			trans	173.3	69.4	177.6	0	0	0	0	0	114.3
461	Q	28.5	Very low	49.3	Very low	272 Å²	272	114.8 Å²	114.8	100%	1.271	65%	0.649	S	S	*	*			trans	-145.8	0	142.6	-95.2	-171.9	12.7	0	0	109.4

Retrieved 461 of 461 residues in 102.9 ms (Link to these results)

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